NMR Restraints Grid

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

image mrblock_id pdb_id bmrb_id cing stage position program type subtype subsubtype
572839 2mff 19547 cing 1-original 1 AMBER distance NOE simple


#
# 1 MET HA 121 ASN HA 4.90 
 &rst
  ixpk= 0, nxpk= 0, iat=   6,2245, r1= 1.30, r2= 1.80, r3= 4.90, r4= 5.40, 
      rk2=50, rk3=50, ir6=1, ialtd=0,
 &end
#
# 1 MET HA 122 ALA H 5.09 
 &rst
  ixpk= 0, nxpk= 0, iat=   6,2257, r1= 1.30, r2= 1.80, r3= 5.09, r4= 5.59,  &end
#
# 1 MET HB2 120 ILE H 5.66 
 &rst
  ixpk= 0, nxpk= 0, iat=   8,2224, r1= 1.30, r2= 1.80, r3= 5.66, r4= 6.16,  &end
#
# 1 MET HB2 121 ASN HA 4.90 
 &rst
  ixpk= 0, nxpk= 0, iat=   8,2245, r1= 1.30, r2= 1.80, r3= 4.90, r4= 5.40,  &end
#
# 1 MET HG2 120 ILE H 5.55 
 &rst
  ixpk= 0, nxpk= 0, iat=  11,2224, r1= 1.30, r2= 1.80, r3= 5.55, r4= 6.05,  &end
#
# 1 MET HG3 119 GLY HA2 5.45 
 &rst
  ixpk= 0, nxpk= 0, iat=  12,2219, r1= 1.30, r2= 1.80, r3= 5.45, r4= 5.95,  &end
#
# 1 MET HG3 120 ILE H 5.29 
 &rst
  ixpk= 0, nxpk= 0, iat=  12,2224, r1= 1.30, r2= 1.80, r3= 5.29, r4= 5.79,  &end
#
# 1 MET QE 107 THR HB 4.71 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,2035, r1= 1.30, r2= 1.80, r3= 5.66, r4= 6.16,
 igr1=  15,  16,  17,
 &end
#
# 1 MET QE 109 LEU QD1 4.40 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.35, r4= 6.85,
 igr1=  15,  16,  17,
 igr2=2073,2074,2075,
 &end
#
# 1 MET QE 109 LEU QD2 4.00 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.77, r4= 6.27,
 igr1=  15,  16,  17,
 igr2=2077,2078,2079,
 &end
#
# 1 MET QE 119 GLY HA2 4.71 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,2219, r1= 1.30, r2= 1.80, r3= 5.66, r4= 6.16,
 igr1=  15,  16,  17,
 &end
#
# 1 MET QE 119 GLY H 5.36 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,2217, r1= 1.30, r2= 1.80, r3= 6.44, r4= 6.94,
 igr1=  15,  16,  17,
 &end
#
# 1 MET QE 120 ILE HA 5.50 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,2226, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr1=  15,  16,  17,
 &end
#
# 1 MET QE 120 ILE H 5.15 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,2224, r1= 1.30, r2= 1.80, r3= 6.18, r4= 6.68,
 igr1=  15,  16,  17,
 &end
#
# 1 MET QE 121 ASN HD21 5.55 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,2253, r1= 1.30, r2= 1.80, r3= 6.67, r4= 7.17,
 igr1=  15,  16,  17,
 &end
#
# 1 MET QE 121 ASN HD22 5.29 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,2252, r1= 1.30, r2= 1.80, r3= 6.35, r4= 6.85,
 igr1=  15,  16,  17,
 &end
#
# 2 LEU H 120 ILE H 4.80 
 &rst
  ixpk= 0, nxpk= 0, iat=  21,2224, r1= 1.30, r2= 1.80, r3= 4.80, r4= 5.30,  &end
#
# 2 LEU H 120 ILE QD1 4.78 
 &rst
  ixpk= 0, nxpk= 0, iat=  21,  -1, r1= 1.30, r2= 1.80, r3= 5.74, r4= 6.24,
 igr2=2237,2238,2239,
 &end
#
# 2 LEU H 120 ILE QG2 5.45 
 &rst
  ixpk= 0, nxpk= 0, iat=  21,  -1, r1= 1.30, r2= 1.80, r3= 6.55, r4= 7.05,
 igr2=2230,2231,2232,
 &end
#
# 2 LEU H 121 ASN HA 4.00 
 &rst
  ixpk= 0, nxpk= 0, iat=  21,2245, r1= 1.30, r2= 1.80, r3= 4.00, r4= 4.50,  &end
#
# 2 LEU H 122 ALA H 5.15 
 &rst
  ixpk= 0, nxpk= 0, iat=  21,2257, r1= 1.30, r2= 1.80, r3= 5.15, r4= 5.65,  &end
#
# 2 LEU H 128 VAL QG2 5.15 
 &rst
  ixpk= 0, nxpk= 0, iat=  21,  -1, r1= 1.30, r2= 1.80, r3= 6.18, r4= 6.68,
 igr2=2351,2352,2353,
 &end
#
# 2 LEU QD1 120 ILE HB 5.45 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,2228, r1= 1.30, r2= 1.80, r3= 6.55, r4= 7.05,
 igr1=  30,  31,  32,
 &end
#
# 2 LEU QD1 120 ILE QD1 4.08 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.88, r4= 6.38,
 igr1=  30,  31,  32,
 igr2=2237,2238,2239,
 &end
#
# 2 LEU QD1 120 ILE QG2 4.62 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.66, r4= 7.16,
 igr1=  30,  31,  32,
 igr2=2230,2231,2232,
 &end
#
# 2 LEU QD1 122 ALA QB 5.45 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.86, r4= 8.36,
 igr1=  30,  31,  32,
 igr2=2261,2262,2263,
 &end
#
# 2 LEU QD1 128 VAL HB 5.04 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,2345, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55,
 igr1=  30,  31,  32,
 &end
#
# 2 LEU QD1 128 VAL H 5.50 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,2341, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr1=  30,  31,  32,
 &end
#
# 2 LEU QD1 128 VAL QG1 4.00 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.77, r4= 6.27,
 igr1=  30,  31,  32,
 igr2=2347,2348,2349,
 &end
#
# 2 LEU QD1 128 VAL QG2 3.49 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.03, r4= 5.53,
 igr1=  30,  31,  32,
 igr2=2351,2352,2353,
 &end
#
# 2 LEU QD2 120 ILE H 5.66 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,2224, r1= 1.30, r2= 1.80, r3= 6.80, r4= 7.30,
 igr1=  34,  35,  36,
 &end
#
# 3 ILE HA 109 LEU QD1 4.71 
 &rst
  ixpk= 0, nxpk= 0, iat=  42,  -1, r1= 1.30, r2= 1.80, r3= 5.66, r4= 6.16,
 igr2=2073,2074,2075,
 &end
#
# 3 ILE HA 109 LEU QD2 5.09 
 &rst
  ixpk= 0, nxpk= 0, iat=  42,  -1, r1= 1.30, r2= 1.80, r3= 6.11, r4= 6.61,
 igr2=2077,2078,2079,
 &end
#
# 3 ILE HA 118 ILE QG2 5.00 
 &rst
  ixpk= 0, nxpk= 0, iat=  42,  -1, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,
 igr2=2204,2205,2206,
 &end
#
# 3 ILE QD1 119 GLY HA2 4.86 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,2219, r1= 1.30, r2= 1.80, r3= 5.84, r4= 6.34,
 igr1=  53,  54,  55,
 &end
#
# 3 ILE QD1 120 ILE H 5.45 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,2224, r1= 1.30, r2= 1.80, r3= 6.55, r4= 7.05,
 igr1=  53,  54,  55,
 &end
#
# 3 ILE QG2 117 ARG HE 5.00 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,2187, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,
 igr1=  46,  47,  48,
 &end
#
# 3 ILE QG2 117 ARG HD2 4.80 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,2184, r1= 1.30, r2= 1.80, r3= 5.76, r4= 6.26,
 igr1=  46,  47,  48,
 &end
#
# 3 ILE QG2 118 ILE H 5.50 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,2198, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr1=  46,  47,  48,
 &end
#
# 4 LEU H 118 ILE H 4.00 
 &rst
  ixpk= 0, nxpk= 0, iat=  59,2198, r1= 1.30, r2= 1.80, r3= 4.00, r4= 4.50,  &end
#
# 4 LEU H 120 ILE H 5.50 
 &rst
  ixpk= 0, nxpk= 0, iat=  59,2224, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
# 4 LEU QD1 129 HIS HA 5.00 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,2359, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,
 igr1=  68,  69,  70,
 &end
#
# 4 LEU QD1 130 ARG HA 5.09 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,2376, r1= 1.30, r2= 1.80, r3= 6.11, r4= 6.61,
 igr1=  68,  69,  70,
 &end
#
# 4 LEU QD2 120 ILE QD1 4.50 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.49, r4= 6.99,
 igr1=  72,  73,  74,
 igr2=2237,2238,2239,
 &end
#
# 4 LEU QD2 130 ARG QD 5.50 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1=  72,  73,  74,
 igr2=2384,2385,
 &end
#
# 5 THR HA 117 ARG HB3 5.55 
 &rst
  ixpk= 0, nxpk= 0, iat=  80,2179, r1= 1.30, r2= 1.80, r3= 5.55, r4= 6.05,  &end
#
# 5 THR HA 117 ARG H 5.66 
 &rst
  ixpk= 0, nxpk= 0, iat=  80,2174, r1= 1.30, r2= 1.80, r3= 5.66, r4= 6.16,  &end
#
# 5 THR HA 117 ARG H 5.36 
 &rst
  ixpk= 0, nxpk= 0, iat=  80,2174, r1= 1.30, r2= 1.80, r3= 5.36, r4= 5.86,  &end
#
# 5 THR QG2 115 GLN HB3 4.68 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,2146, r1= 1.30, r2= 1.80, r3= 5.62, r4= 6.12,
 igr1=  84,  85,  86,
 &end
#
# 5 THR QG2 115 GLN HE21 4.18 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,2154, r1= 1.30, r2= 1.80, r3= 5.02, r4= 5.52,
 igr1=  84,  85,  86,
 &end
#
# 5 THR QG2 115 GLN HE22 4.17 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,2153, r1= 1.30, r2= 1.80, r3= 5.01, r4= 5.51,
 igr1=  84,  85,  86,
 &end
#
# 5 THR QG2 115 GLN HG2 5.00 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,2148, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,
 igr1=  84,  85,  86,
 &end
#
# 5 THR QG2 115 GLN HG3 4.49 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,2149, r1= 1.30, r2= 1.80, r3= 5.39, r4= 5.89,
 igr1=  84,  85,  86,
 &end
#
# 5 THR QG2 115 GLN H 6.12 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,2141, r1= 1.30, r2= 1.80, r3= 7.35, r4= 7.85,
 igr1=  84,  85,  86,
 &end
#
# 5 THR QG2 117 ARG HA 5.50 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,2176, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr1=  84,  85,  86,
 &end
#
# 5 THR QG2 117 ARG HB2 4.71 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,2178, r1= 1.30, r2= 1.80, r3= 5.66, r4= 6.16,
 igr1=  84,  85,  86,
 &end
#
# 5 THR QG2 117 ARG HB3 4.68 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,2179, r1= 1.30, r2= 1.80, r3= 5.62, r4= 6.12,
 igr1=  84,  85,  86,
 &end
#
# 5 THR QG2 117 ARG HD2 4.42 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,2184, r1= 1.30, r2= 1.80, r3= 5.31, r4= 5.81,
 igr1=  84,  85,  86,
 &end
#
# 5 THR QG2 117 ARG HE 4.56 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,2187, r1= 1.30, r2= 1.80, r3= 5.48, r4= 5.98,
 igr1=  84,  85,  86,
 &end
#
# 5 THR QG2 117 ARG H 4.49 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,2174, r1= 1.30, r2= 1.80, r3= 5.39, r4= 5.89,
 igr1=  84,  85,  86,
 &end
#
# 6 ARG HB2 116 VAL H 5.66 
 &rst
  ixpk= 0, nxpk= 0, iat=  96,2158, r1= 1.30, r2= 1.80, r3= 5.66, r4= 6.16,  &end
#
# 6 ARG HD2 118 ILE QD1 5.50 
 &rst
  ixpk= 0, nxpk= 0, iat= 102,  -1, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr2=2211,2212,2213,
 &end
#
# 6 ARG H 116 VAL H 4.50 
 &rst
  ixpk= 0, nxpk= 0, iat=  92,2158, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
# 6 ARG H 116 VAL QG1 6.00 
 &rst
  ixpk= 0, nxpk= 0, iat=  92,  -1, r1= 1.30, r2= 1.80, r3= 7.21, r4= 7.71,
 igr2=2164,2165,2166,
 &end
#
# 6 ARG H 116 VAL QG2 5.55 
 &rst
  ixpk= 0, nxpk= 0, iat=  92,  -1, r1= 1.30, r2= 1.80, r3= 6.67, r4= 7.17,
 igr2=2168,2169,2170,
 &end
#
# 6 ARG H 117 ARG HA 5.00 
 &rst
  ixpk= 0, nxpk= 0, iat=  92,2176, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50,  &end
#
# 6 ARG H 117 ARG H 5.45 
 &rst
  ixpk= 0, nxpk= 0, iat=  92,2174, r1= 1.30, r2= 1.80, r3= 5.45, r4= 5.95,  &end
#
# 6 ARG H 118 ILE QD1 4.50 
 &rst
  ixpk= 0, nxpk= 0, iat=  92,  -1, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr2=2211,2212,2213,
 &end
#
# 7 LYS HA 115 GLN HA 3.80 
 &rst
  ixpk= 0, nxpk= 0, iat= 118,2143, r1= 1.30, r2= 1.80, r3= 3.80, r4= 4.30,  &end
#
# 7 LYS HA 115 GLN HG3 6.00 
 &rst
  ixpk= 0, nxpk= 0, iat= 118,2149, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,  &end
#
# 7 LYS HA 116 VAL QG2 4.90 
 &rst
  ixpk= 0, nxpk= 0, iat= 118,  -1, r1= 1.30, r2= 1.80, r3= 5.88, r4= 6.38,
 igr2=2168,2169,2170,
 &end
#
# 7 LYS HB3 115 GLN HB3 4.74 
 &rst
  ixpk= 0, nxpk= 0, iat= 121,2146, r1= 1.30, r2= 1.80, r3= 4.74, r4= 5.24,  &end
#
# 7 LYS HB3 115 GLN H 5.93 
 &rst
  ixpk= 0, nxpk= 0, iat= 121,2141, r1= 1.30, r2= 1.80, r3= 5.93, r4= 6.43,  &end
#
# 7 LYS H 116 VAL QG2 5.66 
 &rst
  ixpk= 0, nxpk= 0, iat= 116,  -1, r1= 1.30, r2= 1.80, r3= 6.80, r4= 7.30,
 igr2=2168,2169,2170,
 &end
#
# 7 LYS QG 115 GLN HG2 5.50 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,2148, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 123, 124,
 &end
#
# 7 LYS QG 116 VAL H 6.35 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,2158, r1= 1.30, r2= 1.80, r3= 7.13, r4= 7.63,
 igr1= 123, 124,
 &end
#
# 8 VAL HA 116 VAL QG1 6.00 
 &rst
  ixpk= 0, nxpk= 0, iat= 140,  -1, r1= 1.30, r2= 1.80, r3= 7.21, r4= 7.71,
 igr2=2164,2165,2166,
 &end
#
# 8 VAL HA 116 VAL QG2 4.65 
 &rst
  ixpk= 0, nxpk= 0, iat= 140,  -1, r1= 1.30, r2= 1.80, r3= 5.58, r4= 6.08,
 igr2=2168,2169,2170,
 &end
#
# 8 VAL H 114 GLN QG 4.00 
 &rst
  ixpk= 0, nxpk= 0, iat= 138,  -1, r1= 1.30, r2= 1.80, r3= 4.49, r4= 4.99,
 igr2=2131,2132,
 &end
#
# 8 VAL QG1 114 GLN HA 4.15 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,2126, r1= 1.30, r2= 1.80, r3= 4.98, r4= 5.48,
 igr1= 144, 145, 146,
 &end
#
# 8 VAL QG1 114 GLN HB2 5.00 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,2128, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,
 igr1= 144, 145, 146,
 &end
#
# 8 VAL QG1 114 GLN HB3 5.00 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,2129, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,
 igr1= 144, 145, 146,
 &end
#
# 8 VAL QG1 114 GLN HE21 5.45 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,2137, r1= 1.30, r2= 1.80, r3= 6.55, r4= 7.05,
 igr1= 144, 145, 146,
 &end
#
# 8 VAL QG1 114 GLN QG 4.50 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr1= 144, 145, 146,
 igr2=2131,2132,
 &end
#
# 8 VAL QG2 114 GLN HA 4.50 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,2126, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr1= 148, 149, 150,
 &end
#
# 8 VAL QG2 114 GLN H 6.00 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,2124, r1= 1.30, r2= 1.80, r3= 7.21, r4= 7.71,
 igr1= 148, 149, 150,
 &end
#
# 8 VAL QG2 114 GLN QG 4.00 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.39, r4= 5.89,
 igr1= 148, 149, 150,
 igr2=2131,2132,
 &end
#
# 11 SER HB2 131 GLU HG2 5.04 
 &rst
  ixpk= 0, nxpk= 0, iat= 180,2405, r1= 1.30, r2= 1.80, r3= 5.04, r4= 5.54,  &end
#
# 11 SER HB2 131 GLU QB 4.65 
 &rst
  ixpk= 0, nxpk= 0, iat= 180,  -1, r1= 1.30, r2= 1.80, r3= 5.22, r4= 5.72,
 igr2=2402,2403,
 &end
#
# 11 SER HB3 131 GLU HG2 4.99 
 &rst
  ixpk= 0, nxpk= 0, iat= 181,2405, r1= 1.30, r2= 1.80, r3= 4.99, r4= 5.49,  &end
#
# 11 SER HB3 131 GLU HG3 5.36 
 &rst
  ixpk= 0, nxpk= 0, iat= 181,2406, r1= 1.30, r2= 1.80, r3= 5.36, r4= 5.86,  &end
#
# 11 SER H 131 GLU HG2 6.00 
 &rst
  ixpk= 0, nxpk= 0, iat= 176,2405, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,  &end
#
# 11 SER H 131 GLU H 5.45 
 &rst
  ixpk= 0, nxpk= 0, iat= 176,2398, r1= 1.30, r2= 1.80, r3= 5.45, r4= 5.95,  &end
#
# 11 SER H 131 GLU QB 5.50 
 &rst
  ixpk= 0, nxpk= 0, iat= 176,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=2402,2403,
 &end
#
# 11 SER QB 131 GLU HG2 6.00 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,2405, r1= 1.30, r2= 1.80, r3= 6.73, r4= 7.23,
 igr1= 180, 181,
 &end
#
# 11 SER QB 131 GLU QB 5.00 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.30, r4= 6.80,
 igr1= 180, 181,
 igr2=2402,2403,
 &end
#
# 12 ILE HA 130 ARG HA 4.50 
 &rst
  ixpk= 0, nxpk= 0, iat= 189,2376, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
# 12 ILE HG12 131 GLU H 5.09 
 &rst
  ixpk= 0, nxpk= 0, iat= 197,2398, r1= 1.30, r2= 1.80, r3= 5.09, r4= 5.59,  &end
#
# 12 ILE QD1 130 ARG HA 4.90 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,2376, r1= 1.30, r2= 1.80, r3= 5.88, r4= 6.38,
 igr1= 200, 201, 202,
 &end
#
# 12 ILE QD1 131 GLU H 5.45 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,2398, r1= 1.30, r2= 1.80, r3= 6.55, r4= 7.05,
 igr1= 200, 201, 202,
 &end
#
# 12 ILE QG2 118 ILE QG2 6.00 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.65, r4= 9.15,
 igr1= 193, 194, 195,
 igr2=2204,2205,2206,
 &end
#
# 12 ILE QG2 120 ILE QG2 4.50 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.49, r4= 6.99,
 igr1= 193, 194, 195,
 igr2=2230,2231,2232,
 &end
#
# 12 ILE QG2 128 VAL QG2 5.50 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.93, r4= 8.43,
 igr1= 193, 194, 195,
 igr2=2351,2352,2353,
 &end
#
# 12 ILE QG2 129 HIS H 4.51 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,2357, r1= 1.30, r2= 1.80, r3= 5.42, r4= 5.92,
 igr1= 193, 194, 195,
 &end
#
# 12 ILE QG2 130 ARG HA 4.82 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,2376, r1= 1.30, r2= 1.80, r3= 5.79, r4= 6.29,
 igr1= 193, 194, 195,
 &end
#
# 12 ILE QG2 131 GLU H 5.04 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,2398, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55,
 igr1= 193, 194, 195,
 &end
#
# 13 ASN HA 134 TYR QD 6.00 
 &rst
  ixpk= 0, nxpk= 0, iat= 208,  -1, r1= 1.30, r2= 1.80, r3= 6.73, r4= 7.23,
 igr2=2455,2464,
 &end
#
# 13 ASN HA 134 TYR QE 6.00 
 &rst
  ixpk= 0, nxpk= 0, iat= 208,  -1, r1= 1.30, r2= 1.80, r3= 6.73, r4= 7.23,
 igr2=2457,2462,
 &end
#
# 13 ASN HB2 129 HIS HD2 4.85 
 &rst
  ixpk= 0, nxpk= 0, iat= 210,2370, r1= 1.30, r2= 1.80, r3= 4.85, r4= 5.35,  &end
#
# 13 ASN HB2 129 HIS H 5.36 
 &rst
  ixpk= 0, nxpk= 0, iat= 210,2357, r1= 1.30, r2= 1.80, r3= 5.36, r4= 5.86,  &end
#
# 13 ASN HB2 134 TYR QD 5.00 
 &rst
  ixpk= 0, nxpk= 0, iat= 210,  -1, r1= 1.30, r2= 1.80, r3= 5.61, r4= 6.11,
 igr2=2455,2464,
 &end
#
# 13 ASN HB2 134 TYR QE 4.07 
 &rst
  ixpk= 0, nxpk= 0, iat= 210,  -1, r1= 1.30, r2= 1.80, r3= 4.57, r4= 5.07,
 igr2=2457,2462,
 &end
#
# 13 ASN HB3 129 HIS HB2 5.45 
 &rst
  ixpk= 0, nxpk= 0, iat= 211,2361, r1= 1.30, r2= 1.80, r3= 5.45, r4= 5.95,  &end
#
# 13 ASN HB3 129 HIS H 5.36 
 &rst
  ixpk= 0, nxpk= 0, iat= 211,2357, r1= 1.30, r2= 1.80, r3= 5.36, r4= 5.86,  &end
#
# 13 ASN HB3 134 TYR QD 5.00 
 &rst
  ixpk= 0, nxpk= 0, iat= 211,  -1, r1= 1.30, r2= 1.80, r3= 5.61, r4= 6.11,
 igr2=2455,2464,
 &end
#
# 13 ASN HD22 131 GLU HG2 5.55 
 &rst
  ixpk= 0, nxpk= 0, iat= 215,2405, r1= 1.30, r2= 1.80, r3= 5.55, r4= 6.05,  &end
#
# 13 ASN H 129 HIS H 4.50 
 &rst
  ixpk= 0, nxpk= 0, iat= 206,2357, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
# 13 ASN H 130 ARG HA 5.00 
 &rst
  ixpk= 0, nxpk= 0, iat= 206,2376, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50,  &end
#
# 13 ASN H 131 GLU H 5.55 
 &rst
  ixpk= 0, nxpk= 0, iat= 206,2398, r1= 1.30, r2= 1.80, r3= 5.55, r4= 6.05,  &end
#
# 14 ILE HG12 128 VAL HB 4.94 
 &rst
  ixpk= 0, nxpk= 0, iat= 230,2345, r1= 1.30, r2= 1.80, r3= 4.94, r4= 5.44,  &end
#
# 14 ILE H 134 TYR QD 6.66 
 &rst
  ixpk= 0, nxpk= 0, iat= 220,  -1, r1= 1.30, r2= 1.80, r3= 7.48, r4= 7.98,
 igr2=2455,2464,
 &end
#
# 14 ILE QG2 126 VAL HB 3.50 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,2319, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
 igr1= 226, 227, 228,
 &end
#
# 15 GLY HA2 126 VAL QG2 5.20 
 &rst
  ixpk= 0, nxpk= 0, iat= 241,  -1, r1= 1.30, r2= 1.80, r3= 6.24, r4= 6.74,
 igr2=2325,2326,2327,
 &end
#
# 15 GLY HA3 126 VAL QG2 5.00 
 &rst
  ixpk= 0, nxpk= 0, iat= 242,  -1, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,
 igr2=2325,2326,2327,
 &end
#
# 15 GLY H 126 VAL QG2 5.00 
 &rst
  ixpk= 0, nxpk= 0, iat= 239,  -1, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,
 igr2=2325,2326,2327,
 &end
#
# 15 GLY H 127 ALA H 5.50 
 &rst
  ixpk= 0, nxpk= 0, iat= 239,2331, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
# 15 GLY H 127 ALA QB 5.00 
 &rst
  ixpk= 0, nxpk= 0, iat= 239,  -1, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,
 igr2=2335,2336,2337,
 &end
#
# 15 GLY H 128 VAL QG2 5.50 
 &rst
  ixpk= 0, nxpk= 0, iat= 239,  -1, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr2=2351,2352,2353,
 &end
#
# 16 ASP HA 134 TYR QD 6.00 
 &rst
  ixpk= 0, nxpk= 0, iat= 248,  -1, r1= 1.30, r2= 1.80, r3= 6.73, r4= 7.23,
 igr2=2455,2464,
 &end
#
# 16 ASP HA 134 TYR QE 4.86 
 &rst
  ixpk= 0, nxpk= 0, iat= 248,  -1, r1= 1.30, r2= 1.80, r3= 5.46, r4= 5.96,
 igr2=2457,2462,
 &end
#
# 16 ASP HB3 134 TYR QE 5.36 
 &rst
  ixpk= 0, nxpk= 0, iat= 251,  -1, r1= 1.30, r2= 1.80, r3= 6.02, r4= 6.52,
 igr2=2457,2462,
 &end
#
# 22 ILE HB 116 VAL QG2 4.29 
 &rst
  ixpk= 0, nxpk= 0, iat= 340,  -1, r1= 1.30, r2= 1.80, r3= 5.15, r4= 5.65,
 igr2=2168,2169,2170,
 &end
#
# 22 ILE HB 118 ILE QD1 4.50 
 &rst
  ixpk= 0, nxpk= 0, iat= 340,  -1, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr2=2211,2212,2213,
 &end
#
# 22 ILE QD1 116 VAL HB 3.83 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,2162, r1= 1.30, r2= 1.80, r3= 4.60, r4= 5.10,
 igr1= 349, 350, 351,
 &end
#
# 22 ILE QD1 116 VAL QG1 2.98 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.30, r4= 4.80,
 igr1= 349, 350, 351,
 igr2=2164,2165,2166,
 &end
#
# 22 ILE QD1 116 VAL QG2 2.80 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.04, r4= 4.54,
 igr1= 349, 350, 351,
 igr2=2168,2169,2170,
 &end
#
# 25 VAL QG1 114 GLN HA 3.76 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,2126, r1= 1.30, r2= 1.80, r3= 4.52, r4= 5.02,
 igr1= 387, 388, 389,
 &end
#
# 25 VAL QG1 116 VAL QG1 5.50 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.93, r4= 8.43,
 igr1= 387, 388, 389,
 igr2=2164,2165,2166,
 &end
#
# 25 VAL QG1 116 VAL QG2 4.50 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.49, r4= 6.99,
 igr1= 387, 388, 389,
 igr2=2168,2169,2170,
 &end
#
# 87 MET HA 35 ASN HA 4.90 
 &rst
  ixpk= 0, nxpk= 0, iat=1715, 536, r1= 1.30, r2= 1.80, r3= 4.90, r4= 5.40,  &end
#
# 87 MET HA 36 ALA H 5.09 
 &rst
  ixpk= 0, nxpk= 0, iat=1715, 548, r1= 1.30, r2= 1.80, r3= 5.09, r4= 5.59,  &end
#
# 87 MET HB2 34 ILE H 5.66 
 &rst
  ixpk= 0, nxpk= 0, iat=1717, 515, r1= 1.30, r2= 1.80, r3= 5.66, r4= 6.16,  &end
#
# 87 MET HB2 35 ASN HA 4.90 
 &rst
  ixpk= 0, nxpk= 0, iat=1717, 536, r1= 1.30, r2= 1.80, r3= 4.90, r4= 5.40,  &end
#
# 87 MET HG2 34 ILE H 5.55 
 &rst
  ixpk= 0, nxpk= 0, iat=1720, 515, r1= 1.30, r2= 1.80, r3= 5.55, r4= 6.05,  &end
#
# 87 MET HG3 33 GLY HA2 5.45 
 &rst
  ixpk= 0, nxpk= 0, iat=1721, 510, r1= 1.30, r2= 1.80, r3= 5.45, r4= 5.95,  &end
#
# 87 MET HG3 34 ILE H 5.29 
 &rst
  ixpk= 0, nxpk= 0, iat=1721, 515, r1= 1.30, r2= 1.80, r3= 5.29, r4= 5.79,  &end
#
# 87 MET QE 21 THR HB 4.71 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 326, r1= 1.30, r2= 1.80, r3= 5.66, r4= 6.16,
 igr1=1724,1725,1726,
 &end
#
# 87 MET QE 23 LEU QD1 4.40 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.35, r4= 6.85,
 igr1=1724,1725,1726,
 igr2= 364, 365, 366,
 &end
#
# 87 MET QE 23 LEU QD2 4.00 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.77, r4= 6.27,
 igr1=1724,1725,1726,
 igr2= 368, 369, 370,
 &end
#
# 87 MET QE 33 GLY HA2 4.71 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 510, r1= 1.30, r2= 1.80, r3= 5.66, r4= 6.16,
 igr1=1724,1725,1726,
 &end
#
# 87 MET QE 33 GLY H 5.36 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 508, r1= 1.30, r2= 1.80, r3= 6.44, r4= 6.94,
 igr1=1724,1725,1726,
 &end
#
# 87 MET QE 34 ILE HA 5.50 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 517, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr1=1724,1725,1726,
 &end
#
# 87 MET QE 34 ILE H 5.15 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 515, r1= 1.30, r2= 1.80, r3= 6.18, r4= 6.68,
 igr1=1724,1725,1726,
 &end
#
# 87 MET QE 35 ASN HD21 5.55 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 544, r1= 1.30, r2= 1.80, r3= 6.67, r4= 7.17,
 igr1=1724,1725,1726,
 &end
#
# 87 MET QE 35 ASN HD22 5.29 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 543, r1= 1.30, r2= 1.80, r3= 6.35, r4= 6.85,
 igr1=1724,1725,1726,
 &end
#
# 88 LEU H 34 ILE H 4.80 
 &rst
  ixpk= 0, nxpk= 0, iat=1730, 515, r1= 1.30, r2= 1.80, r3= 4.80, r4= 5.30,  &end
#
# 88 LEU H 34 ILE QD1 4.78 
 &rst
  ixpk= 0, nxpk= 0, iat=1730,  -1, r1= 1.30, r2= 1.80, r3= 5.74, r4= 6.24,
 igr2= 528, 529, 530,
 &end
#
# 88 LEU H 34 ILE QG2 5.45 
 &rst
  ixpk= 0, nxpk= 0, iat=1730,  -1, r1= 1.30, r2= 1.80, r3= 6.55, r4= 7.05,
 igr2= 521, 522, 523,
 &end
#
# 88 LEU H 35 ASN HA 4.00 
 &rst
  ixpk= 0, nxpk= 0, iat=1730, 536, r1= 1.30, r2= 1.80, r3= 4.00, r4= 4.50,  &end
#
# 88 LEU H 36 ALA H 5.15 
 &rst
  ixpk= 0, nxpk= 0, iat=1730, 548, r1= 1.30, r2= 1.80, r3= 5.15, r4= 5.65,  &end
#
# 88 LEU H 42 VAL QG2 5.15 
 &rst
  ixpk= 0, nxpk= 0, iat=1730,  -1, r1= 1.30, r2= 1.80, r3= 6.18, r4= 6.68,
 igr2= 642, 643, 644,
 &end
#
# 88 LEU QD1 34 ILE HB 5.45 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 519, r1= 1.30, r2= 1.80, r3= 6.55, r4= 7.05,
 igr1=1739,1740,1741,
 &end
#
# 88 LEU QD1 34 ILE QD1 4.08 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.88, r4= 6.38,
 igr1=1739,1740,1741,
 igr2= 528, 529, 530,
 &end
#
# 88 LEU QD1 34 ILE QG2 4.62 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.66, r4= 7.16,
 igr1=1739,1740,1741,
 igr2= 521, 522, 523,
 &end
#
# 88 LEU QD1 36 ALA QB 5.45 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.86, r4= 8.36,
 igr1=1739,1740,1741,
 igr2= 552, 553, 554,
 &end
#
# 88 LEU QD1 42 VAL HB 5.04 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 636, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55,
 igr1=1739,1740,1741,
 &end
#
# 88 LEU QD1 42 VAL H 5.50 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 632, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr1=1739,1740,1741,
 &end
#
# 88 LEU QD1 42 VAL QG1 4.00 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.77, r4= 6.27,
 igr1=1739,1740,1741,
 igr2= 638, 639, 640,
 &end
#
# 88 LEU QD1 42 VAL QG2 3.49 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.03, r4= 5.53,
 igr1=1739,1740,1741,
 igr2= 642, 643, 644,
 &end
#
# 88 LEU QD2 34 ILE H 5.66 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 515, r1= 1.30, r2= 1.80, r3= 6.80, r4= 7.30,
 igr1=1743,1744,1745,
 &end
#
# 89 ILE HA 23 LEU QD1 4.71 
 &rst
  ixpk= 0, nxpk= 0, iat=1751,  -1, r1= 1.30, r2= 1.80, r3= 5.66, r4= 6.16,
 igr2= 364, 365, 366,
 &end
#
# 89 ILE HA 23 LEU QD2 5.09 
 &rst
  ixpk= 0, nxpk= 0, iat=1751,  -1, r1= 1.30, r2= 1.80, r3= 6.11, r4= 6.61,
 igr2= 368, 369, 370,
 &end
#
# 89 ILE HA 32 ILE QG2 5.00 
 &rst
  ixpk= 0, nxpk= 0, iat=1751,  -1, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,
 igr2= 495, 496, 497,
 &end
#
# 89 ILE QD1 33 GLY HA2 4.86 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 510, r1= 1.30, r2= 1.80, r3= 5.84, r4= 6.34,
 igr1=1762,1763,1764,
 &end
#
# 89 ILE QD1 34 ILE H 5.45 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 515, r1= 1.30, r2= 1.80, r3= 6.55, r4= 7.05,
 igr1=1762,1763,1764,
 &end
#
# 89 ILE QG2 31 ARG HE 5.00 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 478, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,
 igr1=1755,1756,1757,
 &end
#
# 89 ILE QG2 31 ARG HD2 4.80 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 475, r1= 1.30, r2= 1.80, r3= 5.76, r4= 6.26,
 igr1=1755,1756,1757,
 &end
#
# 89 ILE QG2 32 ILE H 5.50 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 489, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr1=1755,1756,1757,
 &end
#
# 90 LEU H 32 ILE H 4.00 
 &rst
  ixpk= 0, nxpk= 0, iat=1768, 489, r1= 1.30, r2= 1.80, r3= 4.00, r4= 4.50,  &end
#
# 90 LEU H 34 ILE H 5.50 
 &rst
  ixpk= 0, nxpk= 0, iat=1768, 515, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
# 90 LEU QD1 43 HIS HA 5.00 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 650, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,
 igr1=1777,1778,1779,
 &end
#
# 90 LEU QD1 44 ARG HA 5.09 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 667, r1= 1.30, r2= 1.80, r3= 6.11, r4= 6.61,
 igr1=1777,1778,1779,
 &end
#
# 90 LEU QD2 34 ILE QD1 4.50 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.49, r4= 6.99,
 igr1=1781,1782,1783,
 igr2= 528, 529, 530,
 &end
#
# 90 LEU QD2 44 ARG QD 5.50 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1=1781,1782,1783,
 igr2= 675, 676,
 &end
#
# 91 THR HA 31 ARG HB3 5.55 
 &rst
  ixpk= 0, nxpk= 0, iat=1789, 470, r1= 1.30, r2= 1.80, r3= 5.55, r4= 6.05,  &end
#
# 91 THR HA 31 ARG H 5.66 
 &rst
  ixpk= 0, nxpk= 0, iat=1789, 465, r1= 1.30, r2= 1.80, r3= 5.66, r4= 6.16,  &end
#
# 91 THR HA 31 ARG H 5.36 
 &rst
  ixpk= 0, nxpk= 0, iat=1789, 465, r1= 1.30, r2= 1.80, r3= 5.36, r4= 5.86,  &end
#
# 91 THR QG2 29 GLN HB3 4.68 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 437, r1= 1.30, r2= 1.80, r3= 5.62, r4= 6.12,
 igr1=1793,1794,1795,
 &end
#
# 91 THR QG2 29 GLN HE21 4.18 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 445, r1= 1.30, r2= 1.80, r3= 5.02, r4= 5.52,
 igr1=1793,1794,1795,
 &end
#
# 91 THR QG2 29 GLN HE22 4.17 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 444, r1= 1.30, r2= 1.80, r3= 5.01, r4= 5.51,
 igr1=1793,1794,1795,
 &end
#
# 91 THR QG2 29 GLN HG2 5.00 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 439, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,
 igr1=1793,1794,1795,
 &end
#
# 91 THR QG2 29 GLN HG3 4.49 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 440, r1= 1.30, r2= 1.80, r3= 5.39, r4= 5.89,
 igr1=1793,1794,1795,
 &end
#
# 91 THR QG2 29 GLN H 6.12 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 432, r1= 1.30, r2= 1.80, r3= 7.35, r4= 7.85,
 igr1=1793,1794,1795,
 &end
#
# 91 THR QG2 31 ARG HA 5.50 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 467, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr1=1793,1794,1795,
 &end
#
# 91 THR QG2 31 ARG HB2 4.71 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 469, r1= 1.30, r2= 1.80, r3= 5.66, r4= 6.16,
 igr1=1793,1794,1795,
 &end
#
# 91 THR QG2 31 ARG HB3 4.68 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 470, r1= 1.30, r2= 1.80, r3= 5.62, r4= 6.12,
 igr1=1793,1794,1795,
 &end
#
# 91 THR QG2 31 ARG HD2 4.42 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 475, r1= 1.30, r2= 1.80, r3= 5.31, r4= 5.81,
 igr1=1793,1794,1795,
 &end
#
# 91 THR QG2 31 ARG HE 4.56 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 478, r1= 1.30, r2= 1.80, r3= 5.48, r4= 5.98,
 igr1=1793,1794,1795,
 &end
#
# 91 THR QG2 31 ARG H 4.49 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 465, r1= 1.30, r2= 1.80, r3= 5.39, r4= 5.89,
 igr1=1793,1794,1795,
 &end
#
# 92 ARG HB2 30 VAL H 5.66 
 &rst
  ixpk= 0, nxpk= 0, iat=1805, 449, r1= 1.30, r2= 1.80, r3= 5.66, r4= 6.16,  &end
#
# 92 ARG HD2 32 ILE QD1 5.50 
 &rst
  ixpk= 0, nxpk= 0, iat=1811,  -1, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr2= 502, 503, 504,
 &end
#
# 92 ARG H 30 VAL H 4.50 
 &rst
  ixpk= 0, nxpk= 0, iat=1801, 449, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
# 92 ARG H 30 VAL QG1 6.00 
 &rst
  ixpk= 0, nxpk= 0, iat=1801,  -1, r1= 1.30, r2= 1.80, r3= 7.21, r4= 7.71,
 igr2= 455, 456, 457,
 &end
#
# 92 ARG H 30 VAL QG2 5.55 
 &rst
  ixpk= 0, nxpk= 0, iat=1801,  -1, r1= 1.30, r2= 1.80, r3= 6.67, r4= 7.17,
 igr2= 459, 460, 461,
 &end
#
# 92 ARG H 31 ARG HA 5.00 
 &rst
  ixpk= 0, nxpk= 0, iat=1801, 467, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50,  &end
#
# 92 ARG H 31 ARG H 5.45 
 &rst
  ixpk= 0, nxpk= 0, iat=1801, 465, r1= 1.30, r2= 1.80, r3= 5.45, r4= 5.95,  &end
#
# 92 ARG H 32 ILE QD1 4.50 
 &rst
  ixpk= 0, nxpk= 0, iat=1801,  -1, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr2= 502, 503, 504,
 &end
#
# 93 LYS HA 29 GLN HA 3.80 
 &rst
  ixpk= 0, nxpk= 0, iat=1827, 434, r1= 1.30, r2= 1.80, r3= 3.80, r4= 4.30,  &end
#
# 93 LYS HA 29 GLN HG3 6.00 
 &rst
  ixpk= 0, nxpk= 0, iat=1827, 440, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,  &end
#
# 93 LYS HA 30 VAL QG2 4.90 
 &rst
  ixpk= 0, nxpk= 0, iat=1827,  -1, r1= 1.30, r2= 1.80, r3= 5.88, r4= 6.38,
 igr2= 459, 460, 461,
 &end
#
# 93 LYS HB3 29 GLN HB3 4.74 
 &rst
  ixpk= 0, nxpk= 0, iat=1830, 437, r1= 1.30, r2= 1.80, r3= 4.74, r4= 5.24,  &end
#
# 93 LYS HB3 29 GLN H 5.93 
 &rst
  ixpk= 0, nxpk= 0, iat=1830, 432, r1= 1.30, r2= 1.80, r3= 5.93, r4= 6.43,  &end
#
# 93 LYS H 30 VAL QG2 5.66 
 &rst
  ixpk= 0, nxpk= 0, iat=1825,  -1, r1= 1.30, r2= 1.80, r3= 6.80, r4= 7.30,
 igr2= 459, 460, 461,
 &end
#
# 93 LYS QG 29 GLN HG2 5.50 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 439, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=1832,1833,
 &end
#
# 93 LYS QG 30 VAL H 6.35 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 449, r1= 1.30, r2= 1.80, r3= 7.13, r4= 7.63,
 igr1=1832,1833,
 &end
#
# 94 VAL HA 30 VAL QG1 6.00 
 &rst
  ixpk= 0, nxpk= 0, iat=1849,  -1, r1= 1.30, r2= 1.80, r3= 7.21, r4= 7.71,
 igr2= 455, 456, 457,
 &end
#
# 94 VAL HA 30 VAL QG2 4.65 
 &rst
  ixpk= 0, nxpk= 0, iat=1849,  -1, r1= 1.30, r2= 1.80, r3= 5.58, r4= 6.08,
 igr2= 459, 460, 461,
 &end
#
# 94 VAL H 28 GLN QG 4.00 
 &rst
  ixpk= 0, nxpk= 0, iat=1847,  -1, r1= 1.30, r2= 1.80, r3= 4.49, r4= 4.99,
 igr2= 422, 423,
 &end
#
# 94 VAL QG1 28 GLN HA 4.15 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 417, r1= 1.30, r2= 1.80, r3= 4.98, r4= 5.48,
 igr1=1853,1854,1855,
 &end
#
# 94 VAL QG1 28 GLN HB2 5.00 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 419, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,
 igr1=1853,1854,1855,
 &end
#
# 94 VAL QG1 28 GLN HB3 5.00 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 420, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,
 igr1=1853,1854,1855,
 &end
#
# 94 VAL QG1 28 GLN HE21 5.45 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 428, r1= 1.30, r2= 1.80, r3= 6.55, r4= 7.05,
 igr1=1853,1854,1855,
 &end
#
# 94 VAL QG1 28 GLN QG 4.50 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr1=1853,1854,1855,
 igr2= 422, 423,
 &end
#
# 94 VAL QG2 28 GLN HA 4.50 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 417, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr1=1857,1858,1859,
 &end
#
# 94 VAL QG2 28 GLN H 6.00 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 415, r1= 1.30, r2= 1.80, r3= 7.21, r4= 7.71,
 igr1=1857,1858,1859,
 &end
#
# 94 VAL QG2 28 GLN QG 4.00 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.39, r4= 5.89,
 igr1=1857,1858,1859,
 igr2= 422, 423,
 &end
#
# 97 SER HB2 45 GLU HG2 5.04 
 &rst
  ixpk= 0, nxpk= 0, iat=1889, 696, r1= 1.30, r2= 1.80, r3= 5.04, r4= 5.54,  &end
#
# 97 SER HB2 45 GLU QB 4.65 
 &rst
  ixpk= 0, nxpk= 0, iat=1889,  -1, r1= 1.30, r2= 1.80, r3= 5.22, r4= 5.72,
 igr2= 693, 694,
 &end
#
# 97 SER HB3 45 GLU HG2 4.99 
 &rst
  ixpk= 0, nxpk= 0, iat=1890, 696, r1= 1.30, r2= 1.80, r3= 4.99, r4= 5.49,  &end
#
# 97 SER HB3 45 GLU HG3 5.36 
 &rst
  ixpk= 0, nxpk= 0, iat=1890, 697, r1= 1.30, r2= 1.80, r3= 5.36, r4= 5.86,  &end
#
# 97 SER H 45 GLU HG2 6.00 
 &rst
  ixpk= 0, nxpk= 0, iat=1885, 696, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,  &end
#
# 97 SER H 45 GLU H 5.45 
 &rst
  ixpk= 0, nxpk= 0, iat=1885, 689, r1= 1.30, r2= 1.80, r3= 5.45, r4= 5.95,  &end
#
# 97 SER H 45 GLU QB 5.50 
 &rst
  ixpk= 0, nxpk= 0, iat=1885,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2= 693, 694,
 &end
#
# 97 SER QB 45 GLU HG2 6.00 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 696, r1= 1.30, r2= 1.80, r3= 6.73, r4= 7.23,
 igr1=1889,1890,
 &end
#
# 97 SER QB 45 GLU QB 5.00 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.30, r4= 6.80,
 igr1=1889,1890,
 igr2= 693, 694,
 &end
#
# 98 ILE HA 44 ARG HA 4.50 
 &rst
  ixpk= 0, nxpk= 0, iat=1898, 667, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
# 98 ILE HG12 45 GLU H 5.09 
 &rst
  ixpk= 0, nxpk= 0, iat=1906, 689, r1= 1.30, r2= 1.80, r3= 5.09, r4= 5.59,  &end
#
# 98 ILE QD1 44 ARG HA 4.90 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 667, r1= 1.30, r2= 1.80, r3= 5.88, r4= 6.38,
 igr1=1909,1910,1911,
 &end
#
# 98 ILE QD1 45 GLU H 5.45 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 689, r1= 1.30, r2= 1.80, r3= 6.55, r4= 7.05,
 igr1=1909,1910,1911,
 &end
#
# 98 ILE QG2 32 ILE QG2 6.00 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.65, r4= 9.15,
 igr1=1902,1903,1904,
 igr2= 495, 496, 497,
 &end
#
# 98 ILE QG2 34 ILE QG2 4.50 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.49, r4= 6.99,
 igr1=1902,1903,1904,
 igr2= 521, 522, 523,
 &end
#
# 98 ILE QG2 42 VAL QG2 5.50 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.93, r4= 8.43,
 igr1=1902,1903,1904,
 igr2= 642, 643, 644,
 &end
#
# 98 ILE QG2 43 HIS H 4.51 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 648, r1= 1.30, r2= 1.80, r3= 5.42, r4= 5.92,
 igr1=1902,1903,1904,
 &end
#
# 98 ILE QG2 44 ARG HA 4.82 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 667, r1= 1.30, r2= 1.80, r3= 5.79, r4= 6.29,
 igr1=1902,1903,1904,
 &end
#
# 98 ILE QG2 45 GLU H 5.04 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 689, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55,
 igr1=1902,1903,1904,
 &end
#
# 99 ASN HA 48 TYR QD 6.00 
 &rst
  ixpk= 0, nxpk= 0, iat=1917,  -1, r1= 1.30, r2= 1.80, r3= 6.73, r4= 7.23,
 igr2= 746, 755,
 &end
#
# 99 ASN HA 48 TYR QE 6.00 
 &rst
  ixpk= 0, nxpk= 0, iat=1917,  -1, r1= 1.30, r2= 1.80, r3= 6.73, r4= 7.23,
 igr2= 748, 753,
 &end
#
# 99 ASN HB2 43 HIS HD2 4.85 
 &rst
  ixpk= 0, nxpk= 0, iat=1919, 661, r1= 1.30, r2= 1.80, r3= 4.85, r4= 5.35,  &end
#
# 99 ASN HB2 43 HIS H 5.36 
 &rst
  ixpk= 0, nxpk= 0, iat=1919, 648, r1= 1.30, r2= 1.80, r3= 5.36, r4= 5.86,  &end
#
# 99 ASN HB2 48 TYR QD 5.00 
 &rst
  ixpk= 0, nxpk= 0, iat=1919,  -1, r1= 1.30, r2= 1.80, r3= 5.61, r4= 6.11,
 igr2= 746, 755,
 &end
#
# 99 ASN HB2 48 TYR QE 4.07 
 &rst
  ixpk= 0, nxpk= 0, iat=1919,  -1, r1= 1.30, r2= 1.80, r3= 4.57, r4= 5.07,
 igr2= 748, 753,
 &end
#
# 99 ASN HB3 43 HIS HB2 5.45 
 &rst
  ixpk= 0, nxpk= 0, iat=1920, 652, r1= 1.30, r2= 1.80, r3= 5.45, r4= 5.95,  &end
#
# 99 ASN HB3 43 HIS H 5.36 
 &rst
  ixpk= 0, nxpk= 0, iat=1920, 648, r1= 1.30, r2= 1.80, r3= 5.36, r4= 5.86,  &end
#
# 99 ASN HB3 48 TYR QD 5.00 
 &rst
  ixpk= 0, nxpk= 0, iat=1920,  -1, r1= 1.30, r2= 1.80, r3= 5.61, r4= 6.11,
 igr2= 746, 755,
 &end
#
# 99 ASN HD22 45 GLU HG2 5.55 
 &rst
  ixpk= 0, nxpk= 0, iat=1924, 696, r1= 1.30, r2= 1.80, r3= 5.55, r4= 6.05,  &end
#
# 99 ASN H 43 HIS H 4.50 
 &rst
  ixpk= 0, nxpk= 0, iat=1915, 648, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
# 99 ASN H 44 ARG HA 5.00 
 &rst
  ixpk= 0, nxpk= 0, iat=1915, 667, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50,  &end
#
# 99 ASN H 45 GLU H 5.55 
 &rst
  ixpk= 0, nxpk= 0, iat=1915, 689, r1= 1.30, r2= 1.80, r3= 5.55, r4= 6.05,  &end
#
# 100 ILE HG12 42 VAL HB 4.94 
 &rst
  ixpk= 0, nxpk= 0, iat=1939, 636, r1= 1.30, r2= 1.80, r3= 4.94, r4= 5.44,  &end
#
# 100 ILE H 48 TYR QD 6.66 
 &rst
  ixpk= 0, nxpk= 0, iat=1929,  -1, r1= 1.30, r2= 1.80, r3= 7.48, r4= 7.98,
 igr2= 746, 755,
 &end
#
# 100 ILE QG2 40 VAL HB 3.50 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 610, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
 igr1=1935,1936,1937,
 &end
#
# 101 GLY HA2 40 VAL QG2 5.20 
 &rst
  ixpk= 0, nxpk= 0, iat=1950,  -1, r1= 1.30, r2= 1.80, r3= 6.24, r4= 6.74,
 igr2= 616, 617, 618,
 &end
#
# 101 GLY HA3 40 VAL QG2 5.00 
 &rst
  ixpk= 0, nxpk= 0, iat=1951,  -1, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,
 igr2= 616, 617, 618,
 &end
#
# 101 GLY H 40 VAL QG2 5.00 
 &rst
  ixpk= 0, nxpk= 0, iat=1948,  -1, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,
 igr2= 616, 617, 618,
 &end
#
# 101 GLY H 41 ALA H 5.50 
 &rst
  ixpk= 0, nxpk= 0, iat=1948, 622, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
# 101 GLY H 41 ALA QB 5.00 
 &rst
  ixpk= 0, nxpk= 0, iat=1948,  -1, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,
 igr2= 626, 627, 628,
 &end
#
# 101 GLY H 42 VAL QG2 5.50 
 &rst
  ixpk= 0, nxpk= 0, iat=1948,  -1, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr2= 642, 643, 644,
 &end
#
# 102 ASP HA 48 TYR QD 6.00 
 &rst
  ixpk= 0, nxpk= 0, iat=1957,  -1, r1= 1.30, r2= 1.80, r3= 6.73, r4= 7.23,
 igr2= 746, 755,
 &end
#
# 102 ASP HA 48 TYR QE 4.86 
 &rst
  ixpk= 0, nxpk= 0, iat=1957,  -1, r1= 1.30, r2= 1.80, r3= 5.46, r4= 5.96,
 igr2= 748, 753,
 &end
#
# 102 ASP HB3 48 TYR QE 5.36 
 &rst
  ixpk= 0, nxpk= 0, iat=1960,  -1, r1= 1.30, r2= 1.80, r3= 6.02, r4= 6.52,
 igr2= 748, 753,
 &end
#
# 108 ILE HB 30 VAL QG2 4.29 
 &rst
  ixpk= 0, nxpk= 0, iat=2049,  -1, r1= 1.30, r2= 1.80, r3= 5.15, r4= 5.65,
 igr2= 459, 460, 461,
 &end
#
# 108 ILE HB 32 ILE QD1 4.50 
 &rst
  ixpk= 0, nxpk= 0, iat=2049,  -1, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr2= 502, 503, 504,
 &end
#
# 108 ILE QD1 30 VAL HB 3.83 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 453, r1= 1.30, r2= 1.80, r3= 4.60, r4= 5.10,
 igr1=2058,2059,2060,
 &end
#
# 108 ILE QD1 30 VAL QG1 2.98 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.30, r4= 4.80,
 igr1=2058,2059,2060,
 igr2= 455, 456, 457,
 &end
#
# 108 ILE QD1 30 VAL QG2 2.80 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.04, r4= 4.54,
 igr1=2058,2059,2060,
 igr2= 459, 460, 461,
 &end
#
# 111 VAL QG1 28 GLN HA 3.76 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 417, r1= 1.30, r2= 1.80, r3= 4.52, r4= 5.02,
 igr1=2096,2097,2098,
 &end
#
# 111 VAL QG1 30 VAL QG1 5.50 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.93, r4= 8.43,
 igr1=2096,2097,2098,
 igr2= 455, 456, 457,
 &end
#
# 111 VAL QG1 30 VAL QG2 4.50 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.49, r4= 6.99,
 igr1=2096,2097,2098,
 igr2= 459, 460, 461,
 &end
#
# 1 MET HB2 77 RADE H3' 4.74 
 &rst
  ixpk= 0, nxpk= 0, iat=   8,1415, r1= 1.30, r2= 1.80, r3= 4.74, r4= 5.24,  &end
#
# 1 MET HB2 78 RADE H5' 5.50 
 &rst
  ixpk= 0, nxpk= 0, iat=   8,1426, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
# 1 MET HB2 78 RADE H5" 5.50 
 &rst
  ixpk= 0, nxpk= 0, iat=   8,1427, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
# 1 MET HB2 78 RADE H8 4.82 
 &rst
  ixpk= 0, nxpk= 0, iat=   8,1435, r1= 1.30, r2= 1.80, r3= 4.82, r4= 5.32,  &end
#
# 1 MET HB3 77 RADE H3' 4.94 
 &rst
  ixpk= 0, nxpk= 0, iat=   9,1415, r1= 1.30, r2= 1.80, r3= 4.94, r4= 5.44,  &end
#
# 1 MET HB3 78 RADE H4' 4.25 
 &rst
  ixpk= 0, nxpk= 0, iat=   9,1429, r1= 1.30, r2= 1.80, r3= 4.25, r4= 4.75,  &end
#
# 1 MET HB3 78 RADE H5' 4.37 
 &rst
  ixpk= 0, nxpk= 0, iat=   9,1426, r1= 1.30, r2= 1.80, r3= 4.37, r4= 4.87,  &end
#
# 1 MET HB3 78 RADE H5" 4.90 
 &rst
  ixpk= 0, nxpk= 0, iat=   9,1427, r1= 1.30, r2= 1.80, r3= 4.90, r4= 5.40,  &end
#
# 1 MET HB3 78 RADE H8 4.85 
 &rst
  ixpk= 0, nxpk= 0, iat=   9,1435, r1= 1.30, r2= 1.80, r3= 4.85, r4= 5.35,  &end
#
# 1 MET HG2 77 RADE H3' 4.94 
 &rst
  ixpk= 0, nxpk= 0, iat=  11,1415, r1= 1.30, r2= 1.80, r3= 4.94, r4= 5.44,  &end
#
# 1 MET HG2 78 RADE H4' 5.50 
 &rst
  ixpk= 0, nxpk= 0, iat=  11,1429, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
# 1 MET HG2 78 RADE H8 5.56 
 &rst
  ixpk= 0, nxpk= 0, iat=  11,1435, r1= 1.30, r2= 1.80, r3= 5.56, r4= 6.06,  &end
#
# 1 MET HG3 77 RADE H3' 4.99 
 &rst
  ixpk= 0, nxpk= 0, iat=  12,1415, r1= 1.30, r2= 1.80, r3= 4.99, r4= 5.49,  &end
#
# 1 MET HG3 78 RADE H8 5.50 
 &rst
  ixpk= 0, nxpk= 0, iat=  12,1435, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
# 1 MET QE 77 RADE H3' 5.20 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1415, r1= 1.30, r2= 1.80, r3= 6.24, r4= 6.74,
 igr1=  15,  16,  17,
 &end
#
# 1 MET QE 78 RADE H1' 4.51 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1432, r1= 1.30, r2= 1.80, r3= 5.42, r4= 5.92,
 igr1=  15,  16,  17,
 &end
#
# 1 MET QE 78 RADE H2' 5.00 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1450, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,
 igr1=  15,  16,  17,
 &end
#
# 1 MET QE 78 RADE H3' 5.70 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1448, r1= 1.30, r2= 1.80, r3= 6.85, r4= 7.35,
 igr1=  15,  16,  17,
 &end
#
# 1 MET QE 78 RADE H4' 4.50 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1429, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr1=  15,  16,  17,
 &end
#
# 1 MET QE 78 RADE H5" 5.00 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1427, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,
 igr1=  15,  16,  17,
 &end
#
# 1 MET QE 78 RADE H5' 5.00 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1426, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,
 igr1=  15,  16,  17,
 &end
#
# 1 MET QE 78 RADE H8 4.36 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1435, r1= 1.30, r2= 1.80, r3= 5.24, r4= 5.74,
 igr1=  15,  16,  17,
 &end
#
# 1 MET QG 78 RADE H1' 5.50 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1432, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=  11,  12,
 &end
#
# 1 MET QG 78 RADE H8 3.71 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1435, r1= 1.30, r2= 1.80, r3= 4.16, r4= 4.66,
 igr1=  11,  12,
 &end
#
# 2 LEU HB2 75 RGUA H1' 6.50 
 &rst
  ixpk= 0, nxpk= 0, iat=  25,1331, r1= 1.30, r2= 1.80, r3= 6.50, r4= 7.00,  &end
#
# 2 LEU HB2 76 RGUA H1' 5.35 
 &rst
  ixpk= 0, nxpk= 0, iat=  25,1365, r1= 1.30, r2= 1.80, r3= 5.35, r4= 5.85,  &end
#
# 2 LEU HB2 76 RGUA H8 4.76 
 &rst
  ixpk= 0, nxpk= 0, iat=  25,1368, r1= 1.30, r2= 1.80, r3= 4.76, r4= 5.26,  &end
#
# 2 LEU HB3 76 RGUA H1' 5.00 
 &rst
  ixpk= 0, nxpk= 0, iat=  26,1365, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50,  &end
#
# 2 LEU HG 76 RGUA H1' 5.03 
 &rst
  ixpk= 0, nxpk= 0, iat=  28,1365, r1= 1.30, r2= 1.80, r3= 5.03, r4= 5.53,  &end
#
# 2 LEU H 76 RGUA H1' 5.78 
 &rst
  ixpk= 0, nxpk= 0, iat=  21,1365, r1= 1.30, r2= 1.80, r3= 5.78, r4= 6.28,  &end
#
# 2 LEU QD1 75 RGUA H1' 5.19 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1331, r1= 1.30, r2= 1.80, r3= 6.23, r4= 6.73,
 igr1=  30,  31,  32,
 &end
#
# 2 LEU QD1 76 RGUA H1' 6.00 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1365, r1= 1.30, r2= 1.80, r3= 7.21, r4= 7.71,
 igr1=  30,  31,  32,
 &end
#
# 2 LEU QD1 76 RGUA H1 6.24 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1374, r1= 1.30, r2= 1.80, r3= 7.49, r4= 7.99,
 igr1=  30,  31,  32,
 &end
#
# 2 LEU QD1 76 RGUA H8 5.00 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1368, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,
 igr1=  30,  31,  32,
 &end
#
# 2 LEU QD2 75 RGUA H1' 4.25 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1331, r1= 1.30, r2= 1.80, r3= 5.10, r4= 5.60,
 igr1=  34,  35,  36,
 &end
#
# 2 LEU QD2 75 RGUA H2' 4.89 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1350, r1= 1.30, r2= 1.80, r3= 5.87, r4= 6.37,
 igr1=  34,  35,  36,
 &end
#
# 2 LEU QD2 75 RGUA H3' 5.20 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1348, r1= 1.30, r2= 1.80, r3= 6.24, r4= 6.74,
 igr1=  34,  35,  36,
 &end
#
# 2 LEU QD2 75 RGUA H8 4.45 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1334, r1= 1.30, r2= 1.80, r3= 5.34, r4= 5.84,
 igr1=  34,  35,  36,
 &end
#
# 2 LEU QD2 76 RGUA H1' 4.55 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1365, r1= 1.30, r2= 1.80, r3= 5.46, r4= 5.96,
 igr1=  34,  35,  36,
 &end
#
# 2 LEU QD2 76 RGUA H2' 4.89 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1384, r1= 1.30, r2= 1.80, r3= 5.87, r4= 6.37,
 igr1=  34,  35,  36,
 &end
#
# 2 LEU QD2 76 RGUA H3' 5.50 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1382, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr1=  34,  35,  36,
 &end
#
# 2 LEU QD2 76 RGUA H4' 5.20 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1362, r1= 1.30, r2= 1.80, r3= 6.24, r4= 6.74,
 igr1=  34,  35,  36,
 &end
#
# 2 LEU QD2 76 RGUA H5' 5.42 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1359, r1= 1.30, r2= 1.80, r3= 6.51, r4= 7.01,
 igr1=  34,  35,  36,
 &end
#
# 2 LEU QD2 76 RGUA H5" 5.42 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1360, r1= 1.30, r2= 1.80, r3= 6.51, r4= 7.01,
 igr1=  34,  35,  36,
 &end
#
# 2 LEU QD2 76 RGUA H8 4.21 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1368, r1= 1.30, r2= 1.80, r3= 5.06, r4= 5.56,
 igr1=  34,  35,  36,
 &end
#
# 2 LEU QD2 77 RADE H8 5.35 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1402, r1= 1.30, r2= 1.80, r3= 6.43, r4= 6.93,
 igr1=  34,  35,  36,
 &end
#
# 3 ILE HB 79 RGUA H8 4.59 
 &rst
  ixpk= 0, nxpk= 0, iat=  44,1468, r1= 1.30, r2= 1.80, r3= 4.59, r4= 5.09,  &end
#
# 3 ILE H 77 RADE H8 6.12 
 &rst
  ixpk= 0, nxpk= 0, iat=  40,1402, r1= 1.30, r2= 1.80, r3= 6.12, r4= 6.62,  &end
#
# 3 ILE QD1 77 RADE H1' 4.60 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1399, r1= 1.30, r2= 1.80, r3= 5.52, r4= 6.02,
 igr1=  53,  54,  55,
 &end
#
# 3 ILE QD1 77 RADE H2' 4.09 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1417, r1= 1.30, r2= 1.80, r3= 4.91, r4= 5.41,
 igr1=  53,  54,  55,
 &end
#
# 3 ILE QD1 77 RADE H3' 3.95 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1415, r1= 1.30, r2= 1.80, r3= 4.74, r4= 5.24,
 igr1=  53,  54,  55,
 &end
#
# 3 ILE QD1 77 RADE H4' 5.50 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1396, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr1=  53,  54,  55,
 &end
#
# 3 ILE QD1 77 RADE H8 4.02 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1402, r1= 1.30, r2= 1.80, r3= 4.83, r4= 5.33,
 igr1=  53,  54,  55,
 &end
#
# 3 ILE QD1 78 RADE H1' 4.00 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1432, r1= 1.30, r2= 1.80, r3= 4.80, r4= 5.30,
 igr1=  53,  54,  55,
 &end
#
# 3 ILE QD1 78 RADE H3' 4.20 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1448, r1= 1.30, r2= 1.80, r3= 5.04, r4= 5.54,
 igr1=  53,  54,  55,
 &end
#
# 3 ILE QD1 78 RADE H4' 3.79 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1429, r1= 1.30, r2= 1.80, r3= 4.55, r4= 5.05,
 igr1=  53,  54,  55,
 &end
#
# 3 ILE QD1 78 RADE H5' 3.61 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1426, r1= 1.30, r2= 1.80, r3= 4.34, r4= 4.84,
 igr1=  53,  54,  55,
 &end
#
# 3 ILE QD1 78 RADE H5" 3.61 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1427, r1= 1.30, r2= 1.80, r3= 4.34, r4= 4.84,
 igr1=  53,  54,  55,
 &end
#
# 3 ILE QD1 78 RADE H8 4.70 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1435, r1= 1.30, r2= 1.80, r3= 5.64, r4= 6.14,
 igr1=  53,  54,  55,
 &end
#
# 3 ILE QD1 79 RGUA H1' 4.50 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1465, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr1=  53,  54,  55,
 &end
#
# 3 ILE QD1 79 RGUA H5" 3.35 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1460, r1= 1.30, r2= 1.80, r3= 4.02, r4= 4.52,
 igr1=  53,  54,  55,
 &end
#
# 3 ILE QD1 79 RGUA H8 3.97 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1468, r1= 1.30, r2= 1.80, r3= 4.77, r4= 5.27,
 igr1=  53,  54,  55,
 &end
#
# 3 ILE QG2 74 RADE H2 5.50 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1310, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr1=  46,  47,  48,
 &end
#
# 3 ILE QG2 77 RADE H8 5.50 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1402, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr1=  46,  47,  48,
 &end
#
# 3 ILE QG2 78 RADE H1' 5.50 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1432, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr1=  46,  47,  48,
 &end
#
# 3 ILE QG2 78 RADE H4' 4.00 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1429, r1= 1.30, r2= 1.80, r3= 4.80, r4= 5.30,
 igr1=  46,  47,  48,
 &end
#
# 3 ILE QG2 79 RGUA H5" 5.50 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1460, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr1=  46,  47,  48,
 &end
#
# 3 ILE QG2 79 RGUA H8 3.17 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1468, r1= 1.30, r2= 1.80, r3= 3.81, r4= 4.31,
 igr1=  46,  47,  48,
 &end
#
# 4 LEU HB2 74 RADE H2 5.50 
 &rst
  ixpk= 0, nxpk= 0, iat=  63,1310, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
# 4 LEU HB3 74 RADE H2 5.56 
 &rst
  ixpk= 0, nxpk= 0, iat=  64,1310, r1= 1.30, r2= 1.80, r3= 5.56, r4= 6.06,  &end
#
# 4 LEU HG 74 RADE H2 4.85 
 &rst
  ixpk= 0, nxpk= 0, iat=  66,1310, r1= 1.30, r2= 1.80, r3= 4.85, r4= 5.35,  &end
#
# 4 LEU HG 75 RGUA H1' 6.00 
 &rst
  ixpk= 0, nxpk= 0, iat=  66,1331, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,  &end
#
# 4 LEU QD1 74 RADE H2 4.85 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1310, r1= 1.30, r2= 1.80, r3= 5.82, r4= 6.32,
 igr1=  68,  69,  70,
 &end
#
# 4 LEU QD2 74 RADE H2 4.30 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1310, r1= 1.30, r2= 1.80, r3= 5.16, r4= 5.66,
 igr1=  72,  73,  74,
 &end
#
# 4 LEU QD2 75 RGUA H1' 4.96 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1331, r1= 1.30, r2= 1.80, r3= 5.96, r4= 6.46,
 igr1=  72,  73,  74,
 &end
#
# 4 LEU QD2 75 RGUA H8 4.85 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1334, r1= 1.30, r2= 1.80, r3= 5.82, r4= 6.32,
 igr1=  72,  73,  74,
 &end
#
# 5 THR QG2 72 RGUA H1 6.24 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1242, r1= 1.30, r2= 1.80, r3= 7.49, r4= 7.99,
 igr1=  84,  85,  86,
 &end
#
# 5 THR QG2 74 RADE H2 5.50 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1310, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr1=  84,  85,  86,
 &end
#
# 5 THR QG2 79 RGUA H1 5.56 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1474, r1= 1.30, r2= 1.80, r3= 6.68, r4= 7.18,
 igr1=  84,  85,  86,
 &end
#
# 107 THR QG2 78 RADE H1' 5.50 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1432, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr1=2037,2038,2039,
 &end
#
# 107 THR QG2 78 RADE H2 4.51 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1444, r1= 1.30, r2= 1.80, r3= 5.42, r4= 5.92,
 igr1=2037,2038,2039,
 &end
#
# 107 THR QG2 78 RADE H8 6.00 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1435, r1= 1.30, r2= 1.80, r3= 7.21, r4= 7.71,
 igr1=2037,2038,2039,
 &end
#
# 109 LEU HA 78 RADE H2 4.57 
 &rst
  ixpk= 0, nxpk= 0, iat=2066,1444, r1= 1.30, r2= 1.80, r3= 4.57, r4= 5.07,  &end
#
# 109 LEU HB2 78 RADE H1' 4.45 
 &rst
  ixpk= 0, nxpk= 0, iat=2068,1432, r1= 1.30, r2= 1.80, r3= 4.45, r4= 4.95,  &end
#
# 109 LEU HB2 78 RADE H2 5.00 
 &rst
  ixpk= 0, nxpk= 0, iat=2068,1444, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50,  &end
#
# 109 LEU HG 78 RADE H1' 5.00 
 &rst
  ixpk= 0, nxpk= 0, iat=2071,1432, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50,  &end
#
# 109 LEU QD1 78 RADE H1' 4.00 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1432, r1= 1.30, r2= 1.80, r3= 4.80, r4= 5.30,
 igr1=2073,2074,2075,
 &end
#
# 109 LEU QD1 78 RADE H2' 5.50 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1450, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr1=2073,2074,2075,
 &end
#
# 109 LEU QD1 78 RADE H2 4.95 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1444, r1= 1.30, r2= 1.80, r3= 5.94, r4= 6.44,
 igr1=2073,2074,2075,
 &end
#
# 109 LEU QD1 78 RADE H4' 3.91 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1429, r1= 1.30, r2= 1.80, r3= 4.70, r4= 5.20,
 igr1=2073,2074,2075,
 &end
#
# 109 LEU QD1 78 RADE H8 5.50 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1435, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr1=2073,2074,2075,
 &end
#
# 109 LEU QD1 79 RGUA H8 4.10 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1468, r1= 1.30, r2= 1.80, r3= 4.92, r4= 5.42,
 igr1=2073,2074,2075,
 &end
#
# 109 LEU QD2 78 RADE H1' 4.85 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1432, r1= 1.30, r2= 1.80, r3= 5.82, r4= 6.32,
 igr1=2077,2078,2079,
 &end
#
# 109 LEU QD2 78 RADE H2 4.77 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1444, r1= 1.30, r2= 1.80, r3= 5.73, r4= 6.23,
 igr1=2077,2078,2079,
 &end
#
# 109 LEU QD2 78 RADE H8 4.95 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1435, r1= 1.30, r2= 1.80, r3= 5.94, r4= 6.44,
 igr1=2077,2078,2079,
 &end
#
# 112 SER HB3 70 URA H5 4.90 
 &rst
  ixpk= 0, nxpk= 0, iat=2111,1177, r1= 1.30, r2= 1.80, r3= 4.90, r4= 5.40,  &end
#
# 112 SER HB3 71 RCYT H5 3.19 
 &rst
  ixpk= 0, nxpk= 0, iat=2111,1207, r1= 1.30, r2= 1.80, r3= 3.19, r4= 3.69,  &end
#
# 113 GLY HA3 69 RADE H2' 4.63 
 &rst
  ixpk= 0, nxpk= 0, iat=2120,1157, r1= 1.30, r2= 1.80, r3= 4.63, r4= 5.13,  &end
#
# 113 GLY HA3 70 URA H2' 5.00 
 &rst
  ixpk= 0, nxpk= 0, iat=2120,1187, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50,  &end
#
# 113 GLY HA3 71 RCYT H5 6.00 
 &rst
  ixpk= 0, nxpk= 0, iat=2120,1207, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,  &end
#
# 122 ALA HA 76 RGUA H1 7.00 
 &rst
  ixpk= 0, nxpk= 0, iat=2259,1374, r1= 1.30, r2= 1.80, r3= 7.00, r4= 7.50,  &end
#
# 122 ALA QB 76 RGUA H1 5.83 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1374, r1= 1.30, r2= 1.80, r3= 7.00, r4= 7.50,
 igr1=2261,2262,2263,
 &end
#
# 122 ALA QB 76 RGUA Q2 4.27 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.76, r4= 6.26,
 igr1=2261,2262,2263,
 igr2=1377,1378,
 &end
#
# 124 LYS HA 76 RGUA H1 5.83 
 &rst
  ixpk= 0, nxpk= 0, iat=2283,1374, r1= 1.30, r2= 1.80, r3= 5.83, r4= 6.33,  &end
#
# 124 LYS HA 76 RGUA H1 5.93 
 &rst
  ixpk= 0, nxpk= 0, iat=2283,1374, r1= 1.30, r2= 1.80, r3= 5.93, r4= 6.43,  &end
#
# 124 LYS HA 76 RGUA Q2 4.74 
 &rst
  ixpk= 0, nxpk= 0, iat=2283,  -1, r1= 1.30, r2= 1.80, r3= 5.32, r4= 5.82,
 igr2=1377,1378,
 &end
#
# 124 LYS HB2 76 RGUA Q2 5.22 
 &rst
  ixpk= 0, nxpk= 0, iat=2285,  -1, r1= 1.30, r2= 1.80, r3= 5.86, r4= 6.36,
 igr2=1377,1378,
 &end
#
# 124 LYS HD2 76 RGUA H1' 5.70 
 &rst
  ixpk= 0, nxpk= 0, iat=2291,1365, r1= 1.30, r2= 1.80, r3= 5.70, r4= 6.20,  &end
#
# 124 LYS HD2 76 RGUA H2' 5.42 
 &rst
  ixpk= 0, nxpk= 0, iat=2291,1384, r1= 1.30, r2= 1.80, r3= 5.42, r4= 5.92,  &end
#
# 124 LYS HG2 76 RGUA H1' 5.50 
 &rst
  ixpk= 0, nxpk= 0, iat=2288,1365, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
# 124 LYS QE 76 RGUA H1' 5.50 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1365, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=2294,2295,
 &end
#
# 124 LYS QE 76 RGUA H2' 3.67 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1384, r1= 1.30, r2= 1.80, r3= 4.12, r4= 4.62,
 igr1=2294,2295,
 &end
#
# 124 LYS QE 76 RGUA H8 4.45 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1368, r1= 1.30, r2= 1.80, r3= 4.99, r4= 5.49,
 igr1=2294,2295,
 &end
#
# 125 ASP H 76 RGUA Q2 5.45 
 &rst
  ixpk= 0, nxpk= 0, iat=2303,  -1, r1= 1.30, r2= 1.80, r3= 6.12, r4= 6.62,
 igr2=1377,1378,
 &end
#
# 126 VAL HA 76 RGUA H1 6.24 
 &rst
  ixpk= 0, nxpk= 0, iat=2317,1374, r1= 1.30, r2= 1.80, r3= 6.24, r4= 6.74,  &end
#
# 126 VAL HB 76 RGUA Q2 5.45 
 &rst
  ixpk= 0, nxpk= 0, iat=2319,  -1, r1= 1.30, r2= 1.80, r3= 6.12, r4= 6.62,
 igr2=1377,1378,
 &end
#
# 126 VAL QG2 76 RGUA Q2 5.15 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.94, r4= 7.44,
 igr1=2325,2326,2327,
 igr2=1377,1378,
 &end
#
# 127 ALA QB 76 RGUA H1 5.78 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1374, r1= 1.30, r2= 1.80, r3= 6.94, r4= 7.44,
 igr1=2335,2336,2337,
 &end
#
# 127 ALA QB 76 RGUA Q2 5.66 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.63, r4= 8.13,
 igr1=2335,2336,2337,
 igr2=1377,1378,
 &end
#
# 128 VAL HB 76 RGUA Q2 5.93 
 &rst
  ixpk= 0, nxpk= 0, iat=2345,  -1, r1= 1.30, r2= 1.80, r3= 6.66, r4= 7.16,
 igr2=1377,1378,
 &end
#
# 128 VAL H 76 RGUA Q2 6.12 
 &rst
  ixpk= 0, nxpk= 0, iat=2341,  -1, r1= 1.30, r2= 1.80, r3= 6.87, r4= 7.37,
 igr2=1377,1378,
 &end
#
# 128 VAL QG1 76 RGUA H1 5.93 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1374, r1= 1.30, r2= 1.80, r3= 7.12, r4= 7.62,
 igr1=2347,2348,2349,
 &end
#
# 128 VAL QG1 76 RGUA Q2 5.04 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.79, r4= 7.29,
 igr1=2347,2348,2349,
 igr2=1377,1378,
 &end
#
# 128 VAL QG2 76 RGUA H1' 5.06 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1365, r1= 1.30, r2= 1.80, r3= 6.08, r4= 6.58,
 igr1=2351,2352,2353,
 &end
#
# 128 VAL QG2 76 RGUA H1 6.24 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1374, r1= 1.30, r2= 1.80, r3= 7.49, r4= 7.99,
 igr1=2351,2352,2353,
 &end
#
# 129 HIS HD2 76 RGUA H1 7.00 
 &rst
  ixpk= 0, nxpk= 0, iat=2370,1374, r1= 1.30, r2= 1.80, r3= 7.00, r4= 7.50,  &end
#
# 129 HIS HE1 76 RGUA H1 6.24 
 &rst
  ixpk= 0, nxpk= 0, iat=2366,1374, r1= 1.30, r2= 1.80, r3= 6.24, r4= 6.74,  &end
#
# 133 ILE QD1 74 RADE H2' 4.32 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1316, r1= 1.30, r2= 1.80, r3= 5.19, r4= 5.69,
 igr1=2441,2442,2443,
 &end
#
# 87 MET HB2 163 RADE H3' 4.74 
 &rst
  ixpk= 0, nxpk= 0, iat=1717,3124, r1= 1.30, r2= 1.80, r3= 4.74, r4= 5.24,  &end
#
# 87 MET HB2 164 RADE H5' 5.50 
 &rst
  ixpk= 0, nxpk= 0, iat=1717,3135, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
# 87 MET HB2 164 RADE H5" 5.50 
 &rst
  ixpk= 0, nxpk= 0, iat=1717,3136, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
# 87 MET HB2 164 RADE H8 4.82 
 &rst
  ixpk= 0, nxpk= 0, iat=1717,3144, r1= 1.30, r2= 1.80, r3= 4.82, r4= 5.32,  &end
#
# 87 MET HB3 163 RADE H3' 4.94 
 &rst
  ixpk= 0, nxpk= 0, iat=1718,3124, r1= 1.30, r2= 1.80, r3= 4.94, r4= 5.44,  &end
#
# 87 MET HB3 164 RADE H4' 4.25 
 &rst
  ixpk= 0, nxpk= 0, iat=1718,3138, r1= 1.30, r2= 1.80, r3= 4.25, r4= 4.75,  &end
#
# 87 MET HB3 164 RADE H5' 4.37 
 &rst
  ixpk= 0, nxpk= 0, iat=1718,3135, r1= 1.30, r2= 1.80, r3= 4.37, r4= 4.87,  &end
#
# 87 MET HB3 164 RADE H5" 4.90 
 &rst
  ixpk= 0, nxpk= 0, iat=1718,3136, r1= 1.30, r2= 1.80, r3= 4.90, r4= 5.40,  &end
#
# 87 MET HB3 164 RADE H8 4.85 
 &rst
  ixpk= 0, nxpk= 0, iat=1718,3144, r1= 1.30, r2= 1.80, r3= 4.85, r4= 5.35,  &end
#
# 87 MET HG2 163 RADE H3' 4.94 
 &rst
  ixpk= 0, nxpk= 0, iat=1720,3124, r1= 1.30, r2= 1.80, r3= 4.94, r4= 5.44,  &end
#
# 87 MET HG2 164 RADE H4' 5.50 
 &rst
  ixpk= 0, nxpk= 0, iat=1720,3138, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
# 87 MET HG2 164 RADE H8 5.56 
 &rst
  ixpk= 0, nxpk= 0, iat=1720,3144, r1= 1.30, r2= 1.80, r3= 5.56, r4= 6.06,  &end
#
# 87 MET HG3 163 RADE H3' 4.99 
 &rst
  ixpk= 0, nxpk= 0, iat=1721,3124, r1= 1.30, r2= 1.80, r3= 4.99, r4= 5.49,  &end
#
# 87 MET HG3 164 RADE H8 5.50 
 &rst
  ixpk= 0, nxpk= 0, iat=1721,3144, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
# 87 MET QE 163 RADE H3' 5.20 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,3124, r1= 1.30, r2= 1.80, r3= 6.24, r4= 6.74,
 igr1=1724,1725,1726,
 &end
#
# 87 MET QE 164 RADE H1' 4.51 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,3141, r1= 1.30, r2= 1.80, r3= 5.42, r4= 5.92,
 igr1=1724,1725,1726,
 &end
#
# 87 MET QE 164 RADE H2' 5.00 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,3159, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,
 igr1=1724,1725,1726,
 &end
#
# 87 MET QE 164 RADE H3' 5.70 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,3157, r1= 1.30, r2= 1.80, r3= 6.85, r4= 7.35,
 igr1=1724,1725,1726,
 &end
#
# 87 MET QE 164 RADE H4' 4.50 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,3138, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr1=1724,1725,1726,
 &end
#
# 87 MET QE 164 RADE H5" 5.00 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,3136, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,
 igr1=1724,1725,1726,
 &end
#
# 87 MET QE 164 RADE H5' 5.00 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,3135, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,
 igr1=1724,1725,1726,
 &end
#
# 87 MET QE 164 RADE H8 4.36 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,3144, r1= 1.30, r2= 1.80, r3= 5.24, r4= 5.74,
 igr1=1724,1725,1726,
 &end
#
# 87 MET QG 164 RADE H1' 5.50 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,3141, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=1720,1721,
 &end
#
# 87 MET QG 164 RADE H8 3.71 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,3144, r1= 1.30, r2= 1.80, r3= 4.16, r4= 4.66,
 igr1=1720,1721,
 &end
#
# 88 LEU HB2 161 RGUA H1' 6.50 
 &rst
  ixpk= 0, nxpk= 0, iat=1734,3040, r1= 1.30, r2= 1.80, r3= 6.50, r4= 7.00,  &end
#
# 88 LEU HB2 162 RGUA H1' 5.35 
 &rst
  ixpk= 0, nxpk= 0, iat=1734,3074, r1= 1.30, r2= 1.80, r3= 5.35, r4= 5.85,  &end
#
# 88 LEU HB2 162 RGUA H8 4.76 
 &rst
  ixpk= 0, nxpk= 0, iat=1734,3077, r1= 1.30, r2= 1.80, r3= 4.76, r4= 5.26,  &end
#
# 88 LEU HB3 162 RGUA H1' 5.00 
 &rst
  ixpk= 0, nxpk= 0, iat=1735,3074, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50,  &end
#
# 88 LEU HG 162 RGUA H1' 5.03 
 &rst
  ixpk= 0, nxpk= 0, iat=1737,3074, r1= 1.30, r2= 1.80, r3= 5.03, r4= 5.53,  &end
#
# 88 LEU H 162 RGUA H1' 5.78 
 &rst
  ixpk= 0, nxpk= 0, iat=1730,3074, r1= 1.30, r2= 1.80, r3= 5.78, r4= 6.28,  &end
#
# 88 LEU QD1 161 RGUA H1' 5.19 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,3040, r1= 1.30, r2= 1.80, r3= 6.23, r4= 6.73,
 igr1=1739,1740,1741,
 &end
#
# 88 LEU QD1 162 RGUA H1' 6.00 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,3074, r1= 1.30, r2= 1.80, r3= 7.21, r4= 7.71,
 igr1=1739,1740,1741,
 &end
#
# 88 LEU QD1 162 RGUA H1 6.24 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,3083, r1= 1.30, r2= 1.80, r3= 7.49, r4= 7.99,
 igr1=1739,1740,1741,
 &end
#
# 88 LEU QD1 162 RGUA H8 5.00 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,3077, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,
 igr1=1739,1740,1741,
 &end
#
# 88 LEU QD2 161 RGUA H1' 4.25 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,3040, r1= 1.30, r2= 1.80, r3= 5.10, r4= 5.60,
 igr1=1743,1744,1745,
 &end
#
# 88 LEU QD2 161 RGUA H2' 4.89 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,3059, r1= 1.30, r2= 1.80, r3= 5.87, r4= 6.37,
 igr1=1743,1744,1745,
 &end
#
# 88 LEU QD2 161 RGUA H3' 5.20 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,3057, r1= 1.30, r2= 1.80, r3= 6.24, r4= 6.74,
 igr1=1743,1744,1745,
 &end
#
# 88 LEU QD2 161 RGUA H8 4.45 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,3043, r1= 1.30, r2= 1.80, r3= 5.34, r4= 5.84,
 igr1=1743,1744,1745,
 &end
#
# 88 LEU QD2 162 RGUA H1' 4.55 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,3074, r1= 1.30, r2= 1.80, r3= 5.46, r4= 5.96,
 igr1=1743,1744,1745,
 &end
#
# 88 LEU QD2 162 RGUA H2' 4.89 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,3093, r1= 1.30, r2= 1.80, r3= 5.87, r4= 6.37,
 igr1=1743,1744,1745,
 &end
#
# 88 LEU QD2 162 RGUA H3' 5.50 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,3091, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr1=1743,1744,1745,
 &end
#
# 88 LEU QD2 162 RGUA H4' 5.20 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,3071, r1= 1.30, r2= 1.80, r3= 6.24, r4= 6.74,
 igr1=1743,1744,1745,
 &end
#
# 88 LEU QD2 162 RGUA H5' 5.42 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,3068, r1= 1.30, r2= 1.80, r3= 6.51, r4= 7.01,
 igr1=1743,1744,1745,
 &end
#
# 88 LEU QD2 162 RGUA H5" 5.42 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,3069, r1= 1.30, r2= 1.80, r3= 6.51, r4= 7.01,
 igr1=1743,1744,1745,
 &end
#
# 88 LEU QD2 162 RGUA H8 4.21 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,3077, r1= 1.30, r2= 1.80, r3= 5.06, r4= 5.56,
 igr1=1743,1744,1745,
 &end
#
# 88 LEU QD2 163 RADE H8 5.35 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,3111, r1= 1.30, r2= 1.80, r3= 6.43, r4= 6.93,
 igr1=1743,1744,1745,
 &end
#
# 89 ILE HB 165 RGUA H8 4.59 
 &rst
  ixpk= 0, nxpk= 0, iat=1753,3177, r1= 1.30, r2= 1.80, r3= 4.59, r4= 5.09,  &end
#
# 89 ILE H 163 RADE H8 6.12 
 &rst
  ixpk= 0, nxpk= 0, iat=1749,3111, r1= 1.30, r2= 1.80, r3= 6.12, r4= 6.62,  &end
#
# 89 ILE QD1 163 RADE H1' 4.60 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,3108, r1= 1.30, r2= 1.80, r3= 5.52, r4= 6.02,
 igr1=1762,1763,1764,
 &end
#
# 89 ILE QD1 163 RADE H2' 4.09 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,3126, r1= 1.30, r2= 1.80, r3= 4.91, r4= 5.41,
 igr1=1762,1763,1764,
 &end
#
# 89 ILE QD1 163 RADE H3' 3.95 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,3124, r1= 1.30, r2= 1.80, r3= 4.74, r4= 5.24,
 igr1=1762,1763,1764,
 &end
#
# 89 ILE QD1 163 RADE H4' 5.50 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,3105, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr1=1762,1763,1764,
 &end
#
# 89 ILE QD1 163 RADE H8 4.02 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,3111, r1= 1.30, r2= 1.80, r3= 4.83, r4= 5.33,
 igr1=1762,1763,1764,
 &end
#
# 89 ILE QD1 164 RADE H1' 4.00 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,3141, r1= 1.30, r2= 1.80, r3= 4.80, r4= 5.30,
 igr1=1762,1763,1764,
 &end
#
# 89 ILE QD1 164 RADE H3' 4.20 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,3157, r1= 1.30, r2= 1.80, r3= 5.04, r4= 5.54,
 igr1=1762,1763,1764,
 &end
#
# 89 ILE QD1 164 RADE H4' 3.79 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,3138, r1= 1.30, r2= 1.80, r3= 4.55, r4= 5.05,
 igr1=1762,1763,1764,
 &end
#
# 89 ILE QD1 164 RADE H5' 3.61 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,3135, r1= 1.30, r2= 1.80, r3= 4.34, r4= 4.84,
 igr1=1762,1763,1764,
 &end
#
# 89 ILE QD1 164 RADE H5" 3.61 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,3136, r1= 1.30, r2= 1.80, r3= 4.34, r4= 4.84,
 igr1=1762,1763,1764,
 &end
#
# 89 ILE QD1 164 RADE H8 4.70 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,3144, r1= 1.30, r2= 1.80, r3= 5.64, r4= 6.14,
 igr1=1762,1763,1764,
 &end
#
# 89 ILE QD1 165 RGUA H1' 4.50 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,3174, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr1=1762,1763,1764,
 &end
#
# 89 ILE QD1 165 RGUA H5" 3.35 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,3169, r1= 1.30, r2= 1.80, r3= 4.02, r4= 4.52,
 igr1=1762,1763,1764,
 &end
#
# 89 ILE QD1 165 RGUA H8 3.97 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,3177, r1= 1.30, r2= 1.80, r3= 4.77, r4= 5.27,
 igr1=1762,1763,1764,
 &end
#
# 89 ILE QG2 160 RADE H2 5.50 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,3019, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr1=1755,1756,1757,
 &end
#
# 89 ILE QG2 163 RADE H8 5.50 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,3111, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr1=1755,1756,1757,
 &end
#
# 89 ILE QG2 164 RADE H1' 5.50 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,3141, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr1=1755,1756,1757,
 &end
#
# 89 ILE QG2 164 RADE H4' 4.00 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,3138, r1= 1.30, r2= 1.80, r3= 4.80, r4= 5.30,
 igr1=1755,1756,1757,
 &end
#
# 89 ILE QG2 165 RGUA H5" 5.50 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,3169, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr1=1755,1756,1757,
 &end
#
# 89 ILE QG2 165 RGUA H8 3.17 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,3177, r1= 1.30, r2= 1.80, r3= 3.81, r4= 4.31,
 igr1=1755,1756,1757,
 &end
#
# 90 LEU HB2 160 RADE H2 5.50 
 &rst
  ixpk= 0, nxpk= 0, iat=1772,3019, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
# 90 LEU HB3 160 RADE H2 5.56 
 &rst
  ixpk= 0, nxpk= 0, iat=1773,3019, r1= 1.30, r2= 1.80, r3= 5.56, r4= 6.06,  &end
#
# 90 LEU HG 160 RADE H2 4.85 
 &rst
  ixpk= 0, nxpk= 0, iat=1775,3019, r1= 1.30, r2= 1.80, r3= 4.85, r4= 5.35,  &end
#
# 90 LEU HG 161 RGUA H1' 6.00 
 &rst
  ixpk= 0, nxpk= 0, iat=1775,3040, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,  &end
#
# 90 LEU QD1 160 RADE H2 4.85 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,3019, r1= 1.30, r2= 1.80, r3= 5.82, r4= 6.32,
 igr1=1777,1778,1779,
 &end
#
# 90 LEU QD2 160 RADE H2 4.30 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,3019, r1= 1.30, r2= 1.80, r3= 5.16, r4= 5.66,
 igr1=1781,1782,1783,
 &end
#
# 90 LEU QD2 161 RGUA H1' 4.96 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,3040, r1= 1.30, r2= 1.80, r3= 5.96, r4= 6.46,
 igr1=1781,1782,1783,
 &end
#
# 90 LEU QD2 161 RGUA H8 4.85 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,3043, r1= 1.30, r2= 1.80, r3= 5.82, r4= 6.32,
 igr1=1781,1782,1783,
 &end
#
# 91 THR QG2 158 RGUA H1 6.24 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,2951, r1= 1.30, r2= 1.80, r3= 7.49, r4= 7.99,
 igr1=1793,1794,1795,
 &end
#
# 91 THR QG2 160 RADE H2 5.50 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,3019, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr1=1793,1794,1795,
 &end
#
# 91 THR QG2 165 RGUA H1 5.56 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,3183, r1= 1.30, r2= 1.80, r3= 6.68, r4= 7.18,
 igr1=1793,1794,1795,
 &end
#
# 21 THR QG2 164 RADE H1' 5.50 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,3141, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr1= 328, 329, 330,
 &end
#
# 21 THR QG2 164 RADE H2 4.51 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,3153, r1= 1.30, r2= 1.80, r3= 5.42, r4= 5.92,
 igr1= 328, 329, 330,
 &end
#
# 21 THR QG2 164 RADE H8 6.00 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,3144, r1= 1.30, r2= 1.80, r3= 7.21, r4= 7.71,
 igr1= 328, 329, 330,
 &end
#
# 23 LEU HA 164 RADE H2 4.57 
 &rst
  ixpk= 0, nxpk= 0, iat= 357,3153, r1= 1.30, r2= 1.80, r3= 4.57, r4= 5.07,  &end
#
# 23 LEU HB2 164 RADE H1' 4.45 
 &rst
  ixpk= 0, nxpk= 0, iat= 359,3141, r1= 1.30, r2= 1.80, r3= 4.45, r4= 4.95,  &end
#
# 23 LEU HB2 164 RADE H2 5.00 
 &rst
  ixpk= 0, nxpk= 0, iat= 359,3153, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50,  &end
#
# 23 LEU HG 164 RADE H1' 5.00 
 &rst
  ixpk= 0, nxpk= 0, iat= 362,3141, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50,  &end
#
# 23 LEU QD1 164 RADE H1' 4.00 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,3141, r1= 1.30, r2= 1.80, r3= 4.80, r4= 5.30,
 igr1= 364, 365, 366,
 &end
#
# 23 LEU QD1 164 RADE H2' 5.50 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,3159, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr1= 364, 365, 366,
 &end
#
# 23 LEU QD1 164 RADE H2 4.95 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,3153, r1= 1.30, r2= 1.80, r3= 5.94, r4= 6.44,
 igr1= 364, 365, 366,
 &end
#
# 23 LEU QD1 164 RADE H4' 3.91 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,3138, r1= 1.30, r2= 1.80, r3= 4.70, r4= 5.20,
 igr1= 364, 365, 366,
 &end
#
# 23 LEU QD1 164 RADE H8 5.50 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,3144, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr1= 364, 365, 366,
 &end
#
# 23 LEU QD1 165 RGUA H8 4.10 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,3177, r1= 1.30, r2= 1.80, r3= 4.92, r4= 5.42,
 igr1= 364, 365, 366,
 &end
#
# 23 LEU QD2 164 RADE H1' 4.85 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,3141, r1= 1.30, r2= 1.80, r3= 5.82, r4= 6.32,
 igr1= 368, 369, 370,
 &end
#
# 23 LEU QD2 164 RADE H2 4.77 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,3153, r1= 1.30, r2= 1.80, r3= 5.73, r4= 6.23,
 igr1= 368, 369, 370,
 &end
#
# 23 LEU QD2 164 RADE H8 4.95 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,3144, r1= 1.30, r2= 1.80, r3= 5.94, r4= 6.44,
 igr1= 368, 369, 370,
 &end
#
# 26 SER HB3 156 URA H5 4.90 
 &rst
  ixpk= 0, nxpk= 0, iat= 402,2886, r1= 1.30, r2= 1.80, r3= 4.90, r4= 5.40,  &end
#
# 26 SER HB3 157 RCYT H5 3.19 
 &rst
  ixpk= 0, nxpk= 0, iat= 402,2916, r1= 1.30, r2= 1.80, r3= 3.19, r4= 3.69,  &end
#
# 27 GLY HA3 155 RADE H2' 4.63 
 &rst
  ixpk= 0, nxpk= 0, iat= 411,2866, r1= 1.30, r2= 1.80, r3= 4.63, r4= 5.13,  &end
#
# 27 GLY HA3 156 URA H2' 5.00 
 &rst
  ixpk= 0, nxpk= 0, iat= 411,2896, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50,  &end
#
# 27 GLY HA3 157 RCYT H5 6.00 
 &rst
  ixpk= 0, nxpk= 0, iat= 411,2916, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,  &end
#
# 36 ALA HA 162 RGUA H1 7.00 
 &rst
  ixpk= 0, nxpk= 0, iat= 550,3083, r1= 1.30, r2= 1.80, r3= 7.00, r4= 7.50,  &end
#
# 36 ALA QB 162 RGUA H1 5.83 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,3083, r1= 1.30, r2= 1.80, r3= 7.00, r4= 7.50,
 igr1= 552, 553, 554,
 &end
#
# 36 ALA QB 162 RGUA Q2 4.27 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.76, r4= 6.26,
 igr1= 552, 553, 554,
 igr2=3086,3087,
 &end
#
# 38 LYS HA 162 RGUA H1 5.83 
 &rst
  ixpk= 0, nxpk= 0, iat= 574,3083, r1= 1.30, r2= 1.80, r3= 5.83, r4= 6.33,  &end
#
# 38 LYS HA 162 RGUA H1 5.93 
 &rst
  ixpk= 0, nxpk= 0, iat= 574,3083, r1= 1.30, r2= 1.80, r3= 5.93, r4= 6.43,  &end
#
# 38 LYS HA 162 RGUA Q2 4.74 
 &rst
  ixpk= 0, nxpk= 0, iat= 574,  -1, r1= 1.30, r2= 1.80, r3= 5.32, r4= 5.82,
 igr2=3086,3087,
 &end
#
# 38 LYS HB2 162 RGUA Q2 5.22 
 &rst
  ixpk= 0, nxpk= 0, iat= 576,  -1, r1= 1.30, r2= 1.80, r3= 5.86, r4= 6.36,
 igr2=3086,3087,
 &end
#
# 38 LYS HD2 162 RGUA H1' 5.70 
 &rst
  ixpk= 0, nxpk= 0, iat= 582,3074, r1= 1.30, r2= 1.80, r3= 5.70, r4= 6.20,  &end
#
# 38 LYS HD2 162 RGUA H2' 5.42 
 &rst
  ixpk= 0, nxpk= 0, iat= 582,3093, r1= 1.30, r2= 1.80, r3= 5.42, r4= 5.92,  &end
#
# 38 LYS HG2 162 RGUA H1' 5.50 
 &rst
  ixpk= 0, nxpk= 0, iat= 579,3074, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
# 38 LYS QE 162 RGUA H1' 5.50 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,3074, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 585, 586,
 &end
#
# 38 LYS QE 162 RGUA H2' 3.67 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,3093, r1= 1.30, r2= 1.80, r3= 4.12, r4= 4.62,
 igr1= 585, 586,
 &end
#
# 38 LYS QE 162 RGUA H8 4.45 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,3077, r1= 1.30, r2= 1.80, r3= 4.99, r4= 5.49,
 igr1= 585, 586,
 &end
#
# 39 ASP H 162 RGUA Q2 5.45 
 &rst
  ixpk= 0, nxpk= 0, iat= 594,  -1, r1= 1.30, r2= 1.80, r3= 6.12, r4= 6.62,
 igr2=3086,3087,
 &end
#
# 40 VAL HA 162 RGUA H1 6.24 
 &rst
  ixpk= 0, nxpk= 0, iat= 608,3083, r1= 1.30, r2= 1.80, r3= 6.24, r4= 6.74,  &end
#
# 40 VAL HB 162 RGUA Q2 5.45 
 &rst
  ixpk= 0, nxpk= 0, iat= 610,  -1, r1= 1.30, r2= 1.80, r3= 6.12, r4= 6.62,
 igr2=3086,3087,
 &end
#
# 40 VAL QG2 162 RGUA Q2 5.15 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.94, r4= 7.44,
 igr1= 616, 617, 618,
 igr2=3086,3087,
 &end
#
# 41 ALA QB 162 RGUA H1 5.78 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,3083, r1= 1.30, r2= 1.80, r3= 6.94, r4= 7.44,
 igr1= 626, 627, 628,
 &end
#
# 41 ALA QB 162 RGUA Q2 5.66 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.63, r4= 8.13,
 igr1= 626, 627, 628,
 igr2=3086,3087,
 &end
#
# 42 VAL HB 162 RGUA Q2 5.93 
 &rst
  ixpk= 0, nxpk= 0, iat= 636,  -1, r1= 1.30, r2= 1.80, r3= 6.66, r4= 7.16,
 igr2=3086,3087,
 &end
#
# 42 VAL H 162 RGUA Q2 6.12 
 &rst
  ixpk= 0, nxpk= 0, iat= 632,  -1, r1= 1.30, r2= 1.80, r3= 6.87, r4= 7.37,
 igr2=3086,3087,
 &end
#
# 42 VAL QG1 162 RGUA H1 5.93 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,3083, r1= 1.30, r2= 1.80, r3= 7.12, r4= 7.62,
 igr1= 638, 639, 640,
 &end
#
# 42 VAL QG1 162 RGUA Q2 5.04 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.79, r4= 7.29,
 igr1= 638, 639, 640,
 igr2=3086,3087,
 &end
#
# 42 VAL QG2 162 RGUA H1' 5.06 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,3074, r1= 1.30, r2= 1.80, r3= 6.08, r4= 6.58,
 igr1= 642, 643, 644,
 &end
#
# 42 VAL QG2 162 RGUA H1 6.24 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,3083, r1= 1.30, r2= 1.80, r3= 7.49, r4= 7.99,
 igr1= 642, 643, 644,
 &end
#
# 43 HIS HD2 162 RGUA H1 7.00 
 &rst
  ixpk= 0, nxpk= 0, iat= 661,3083, r1= 1.30, r2= 1.80, r3= 7.00, r4= 7.50,  &end
#
# 43 HIS HE1 162 RGUA H1 6.24 
 &rst
  ixpk= 0, nxpk= 0, iat= 657,3083, r1= 1.30, r2= 1.80, r3= 6.24, r4= 6.74,  &end
#
# 47 ILE QD1 160 RADE H2' 4.32 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,3025, r1= 1.30, r2= 1.80, r3= 5.19, r4= 5.69,
 igr1= 732, 733, 734,
 &end
#
# 1 MET HA 1 MET HG2 4.99 
 &rst
  ixpk= 0, nxpk= 0, iat=   6,  11, r1= 1.30, r2= 1.80, r3= 4.99, r4= 5.49,  &end
#
# 1 MET HA 1 MET HG3 4.68 
 &rst
  ixpk= 0, nxpk= 0, iat=   6,  12, r1= 1.30, r2= 1.80, r3= 4.68, r4= 5.18,  &end
#
# 1 MET HA 2 LEU H 3.00 
 &rst
  ixpk= 0, nxpk= 0, iat=   6,  21, r1= 1.30, r2= 1.80, r3= 3.00, r4= 3.50,  &end
#
# 1 MET HA 3 ILE QD1 4.94 
 &rst
  ixpk= 0, nxpk= 0, iat=   6,  -1, r1= 1.30, r2= 1.80, r3= 5.93, r4= 6.43,
 igr2=  53,  54,  55,
 &end
#
# 1 MET HB2 2 LEU H 4.99 
 &rst
  ixpk= 0, nxpk= 0, iat=   8,  21, r1= 1.30, r2= 1.80, r3= 4.99, r4= 5.49,  &end
#
# 1 MET HB3 2 LEU H 4.86 
 &rst
  ixpk= 0, nxpk= 0, iat=   9,  21, r1= 1.30, r2= 1.80, r3= 4.86, r4= 5.36,  &end
#
# 1 MET HG2 3 ILE QD1 4.07 
 &rst
  ixpk= 0, nxpk= 0, iat=  11,  -1, r1= 1.30, r2= 1.80, r3= 4.89, r4= 5.39,
 igr2=  53,  54,  55,
 &end
#
# 1 MET HG3 2 LEU H 5.55 
 &rst
  ixpk= 0, nxpk= 0, iat=  12,  21, r1= 1.30, r2= 1.80, r3= 5.55, r4= 6.05,  &end
#
# 1 MET HG3 3 ILE QD1 4.10 
 &rst
  ixpk= 0, nxpk= 0, iat=  12,  -1, r1= 1.30, r2= 1.80, r3= 4.92, r4= 5.42,
 igr2=  53,  54,  55,
 &end
#
# 2 LEU HB2 2 LEU H 4.78 
 &rst
  ixpk= 0, nxpk= 0, iat=  25,  21, r1= 1.30, r2= 1.80, r3= 4.78, r4= 5.28,  &end
#
# 2 LEU HB3 2 LEU H 5.04 
 &rst
  ixpk= 0, nxpk= 0, iat=  26,  21, r1= 1.30, r2= 1.80, r3= 5.04, r4= 5.54,  &end
#
# 2 LEU HB3 3 ILE H 5.93 
 &rst
  ixpk= 0, nxpk= 0, iat=  26,  40, r1= 1.30, r2= 1.80, r3= 5.93, r4= 6.43,  &end
#
# 2 LEU H 3 ILE HA 5.93 
 &rst
  ixpk= 0, nxpk= 0, iat=  21,  42, r1= 1.30, r2= 1.80, r3= 5.93, r4= 6.43,  &end
#
# 2 LEU H 3 ILE H 5.50 
 &rst
  ixpk= 0, nxpk= 0, iat=  21,  40, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
# 2 LEU QD1 12 ILE QG2 4.78 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.89, r4= 7.39,
 igr1=  30,  31,  32,
 igr2= 193, 194, 195,
 &end
#
# 2 LEU QD1 2 LEU H 5.36 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  21, r1= 1.30, r2= 1.80, r3= 6.44, r4= 6.94,
 igr1=  30,  31,  32,
 &end
#
# 2 LEU QD1 4 LEU HG 6.00 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  66, r1= 1.30, r2= 1.80, r3= 7.21, r4= 7.71,
 igr1=  30,  31,  32,
 &end
#
# 2 LEU QD1 4 LEU QD1 4.36 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.29, r4= 6.79,
 igr1=  30,  31,  32,
 igr2=  68,  69,  70,
 &end
#
# 2 LEU QD1 4 LEU QD2 4.59 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.62, r4= 7.12,
 igr1=  30,  31,  32,
 igr2=  72,  73,  74,
 &end
#
# 2 LEU QD2 3 ILE HA 4.65 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  42, r1= 1.30, r2= 1.80, r3= 5.58, r4= 6.08,
 igr1=  34,  35,  36,
 &end
#
# 2 LEU QD2 3 ILE H 4.00 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  40, r1= 1.30, r2= 1.80, r3= 4.80, r4= 5.30,
 igr1=  34,  35,  36,
 &end
#
# 2 LEU QD2 4 LEU QD2 3.98 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.74, r4= 6.24,
 igr1=  34,  35,  36,
 igr2=  72,  73,  74,
 &end
#
# 3 ILE HA 4 LEU HB3 5.55 
 &rst
  ixpk= 0, nxpk= 0, iat=  42,  64, r1= 1.30, r2= 1.80, r3= 5.55, r4= 6.05,  &end
#
# 3 ILE HA 4 LEU H 3.50 
 &rst
  ixpk= 0, nxpk= 0, iat=  42,  59, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
# 4 LEU HB2 4 LEU H 5.55 
 &rst
  ixpk= 0, nxpk= 0, iat=  63,  59, r1= 1.30, r2= 1.80, r3= 5.55, r4= 6.05,  &end
#
# 4 LEU H 4 LEU QD2 5.29 
 &rst
  ixpk= 0, nxpk= 0, iat=  59,  -1, r1= 1.30, r2= 1.80, r3= 6.35, r4= 6.85,
 igr2=  72,  73,  74,
 &end
#
# 4 LEU QD1 12 ILE QD1 3.18 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.59, r4= 5.09,
 igr1=  68,  69,  70,
 igr2= 200, 201, 202,
 &end
#
# 4 LEU QD1 4 LEU H 6.12 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  59, r1= 1.30, r2= 1.80, r3= 7.35, r4= 7.85,
 igr1=  68,  69,  70,
 &end
#
# 4 LEU QD2 12 ILE QD1 4.40 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.35, r4= 6.85,
 igr1=  72,  73,  74,
 igr2= 200, 201, 202,
 &end
#
# 4 LEU QD2 12 ILE QG2 5.00 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.21, r4= 7.71,
 igr1=  72,  73,  74,
 igr2= 193, 194, 195,
 &end
#
# 4 LEU QD2 4 LEU QD1 3.77 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.44, r4= 5.94,
 igr1=  72,  73,  74,
 igr2=  68,  69,  70,
 &end
#
# 5 THR HA 6 ARG H 5.29 
 &rst
  ixpk= 0, nxpk= 0, iat=  80,  92, r1= 1.30, r2= 1.80, r3= 5.29, r4= 5.79,  &end
#
# 5 THR HB 5 THR H 6.12 
 &rst
  ixpk= 0, nxpk= 0, iat=  82,  78, r1= 1.30, r2= 1.80, r3= 6.12, r4= 6.62,  &end
#
# 5 THR QG2 5 THR HB 4.24 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  82, r1= 1.30, r2= 1.80, r3= 5.09, r4= 5.59,
 igr1=  84,  85,  86,
 &end
#
# 5 THR QG2 6 ARG H 4.15 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  92, r1= 1.30, r2= 1.80, r3= 4.98, r4= 5.48,
 igr1=  84,  85,  86,
 &end
#
# 6 ARG HA 6 ARG HE 6.12 
 &rst
  ixpk= 0, nxpk= 0, iat=  94, 105, r1= 1.30, r2= 1.80, r3= 6.12, r4= 6.62,  &end
#
# 6 ARG HA 7 LYS HB3 5.45 
 &rst
  ixpk= 0, nxpk= 0, iat=  94, 121, r1= 1.30, r2= 1.80, r3= 5.45, r4= 5.95,  &end
#
# 6 ARG HA 7 LYS H 3.00 
 &rst
  ixpk= 0, nxpk= 0, iat=  94, 116, r1= 1.30, r2= 1.80, r3= 3.00, r4= 3.50,  &end
#
# 6 ARG HB2 10 GLU HB2 5.29 
 &rst
  ixpk= 0, nxpk= 0, iat=  96, 165, r1= 1.30, r2= 1.80, r3= 5.29, r4= 5.79,  &end
#
# 6 ARG HB2 12 ILE HG12 5.15 
 &rst
  ixpk= 0, nxpk= 0, iat=  96, 197, r1= 1.30, r2= 1.80, r3= 5.15, r4= 5.65,  &end
#
# 6 ARG HB2 12 ILE HG13 5.36 
 &rst
  ixpk= 0, nxpk= 0, iat=  96, 198, r1= 1.30, r2= 1.80, r3= 5.36, r4= 5.86,  &end
#
# 6 ARG HB2 12 ILE QD1 4.86 
 &rst
  ixpk= 0, nxpk= 0, iat=  96,  -1, r1= 1.30, r2= 1.80, r3= 5.84, r4= 6.34,
 igr2= 200, 201, 202,
 &end
#
# 6 ARG HB2 22 ILE HG12 5.09 
 &rst
  ixpk= 0, nxpk= 0, iat=  96, 346, r1= 1.30, r2= 1.80, r3= 5.09, r4= 5.59,  &end
#
# 6 ARG HB2 6 ARG HE 6.35 
 &rst
  ixpk= 0, nxpk= 0, iat=  96, 105, r1= 1.30, r2= 1.80, r3= 6.35, r4= 6.85,  &end
#
# 6 ARG HB2 7 LYS H 5.78 
 &rst
  ixpk= 0, nxpk= 0, iat=  96, 116, r1= 1.30, r2= 1.80, r3= 5.78, r4= 6.28,  &end
#
# 6 ARG HD2 12 ILE HG12 4.94 
 &rst
  ixpk= 0, nxpk= 0, iat= 102, 197, r1= 1.30, r2= 1.80, r3= 4.94, r4= 5.44,  &end
#
# 6 ARG HD2 12 ILE HG13 5.29 
 &rst
  ixpk= 0, nxpk= 0, iat= 102, 198, r1= 1.30, r2= 1.80, r3= 5.29, r4= 5.79,  &end
#
# 6 ARG HD2 12 ILE QD1 5.22 
 &rst
  ixpk= 0, nxpk= 0, iat= 102,  -1, r1= 1.30, r2= 1.80, r3= 6.27, r4= 6.77,
 igr2= 200, 201, 202,
 &end
#
# 6 ARG HD2 12 ILE QG2 5.04 
 &rst
  ixpk= 0, nxpk= 0, iat= 102,  -1, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55,
 igr2= 193, 194, 195,
 &end
#
# 6 ARG HD3 12 ILE HG12 5.22 
 &rst
  ixpk= 0, nxpk= 0, iat= 103, 197, r1= 1.30, r2= 1.80, r3= 5.22, r4= 5.72,  &end
#
# 6 ARG HD3 12 ILE QD1 5.04 
 &rst
  ixpk= 0, nxpk= 0, iat= 103,  -1, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55,
 igr2= 200, 201, 202,
 &end
#
# 6 ARG HE 10 GLU HB2 5.50 
 &rst
  ixpk= 0, nxpk= 0, iat= 105, 165, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
# 6 ARG HE 10 GLU HB3 5.00 
 &rst
  ixpk= 0, nxpk= 0, iat= 105, 166, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50,  &end
#
# 6 ARG HE 10 GLU QG 5.00 
 &rst
  ixpk= 0, nxpk= 0, iat= 105,  -1, r1= 1.30, r2= 1.80, r3= 5.61, r4= 6.11,
 igr2= 168, 169,
 &end
#
# 6 ARG HE 11 SER H 5.00 
 &rst
  ixpk= 0, nxpk= 0, iat= 105, 176, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50,  &end
#
# 6 ARG HE 12 ILE HG12 5.66 
 &rst
  ixpk= 0, nxpk= 0, iat= 105, 197, r1= 1.30, r2= 1.80, r3= 5.66, r4= 6.16,  &end
#
# 6 ARG HE 12 ILE HG13 6.12 
 &rst
  ixpk= 0, nxpk= 0, iat= 105, 198, r1= 1.30, r2= 1.80, r3= 6.12, r4= 6.62,  &end
#
# 6 ARG HE 6 ARG HA 4.78 
 &rst
  ixpk= 0, nxpk= 0, iat= 105,  94, r1= 1.30, r2= 1.80, r3= 4.78, r4= 5.28,  &end
#
# 6 ARG HE 6 ARG HD2 5.93 
 &rst
  ixpk= 0, nxpk= 0, iat= 105, 102, r1= 1.30, r2= 1.80, r3= 5.93, r4= 6.43,  &end
#
# 6 ARG HE 7 LYS H 4.50 
 &rst
  ixpk= 0, nxpk= 0, iat= 105, 116, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
# 6 ARG QD 10 GLU HB2 4.50 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 165, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 102, 103,
 &end
#
# 6 ARG QD 10 GLU HB3 4.50 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 166, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 102, 103,
 &end
#
# 6 ARG QD 10 GLU QG 4.50 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1= 102, 103,
 igr2= 168, 169,
 &end
#
# 7 LYS HA 8 VAL HB 6.00 
 &rst
  ixpk= 0, nxpk= 0, iat= 118, 142, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,  &end
#
# 7 LYS HA 8 VAL H 3.00 
 &rst
  ixpk= 0, nxpk= 0, iat= 118, 138, r1= 1.30, r2= 1.80, r3= 3.00, r4= 3.50,  &end
#
# 7 LYS HA 8 VAL QG1 4.82 
 &rst
  ixpk= 0, nxpk= 0, iat= 118,  -1, r1= 1.30, r2= 1.80, r3= 5.79, r4= 6.29,
 igr2= 144, 145, 146,
 &end
#
# 7 LYS HA 8 VAL QG2 4.90 
 &rst
  ixpk= 0, nxpk= 0, iat= 118,  -1, r1= 1.30, r2= 1.80, r3= 5.88, r4= 6.38,
 igr2= 148, 149, 150,
 &end
#
# 7 LYS HB2 8 VAL H 5.22 
 &rst
  ixpk= 0, nxpk= 0, iat= 120, 138, r1= 1.30, r2= 1.80, r3= 5.22, r4= 5.72,  &end
#
# 7 LYS HB3 10 GLU QG 4.00 
 &rst
  ixpk= 0, nxpk= 0, iat= 121,  -1, r1= 1.30, r2= 1.80, r3= 4.49, r4= 4.99,
 igr2= 168, 169,
 &end
#
# 7 LYS HB3 8 VAL H 5.50 
 &rst
  ixpk= 0, nxpk= 0, iat= 121, 138, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
# 7 LYS HB3 8 VAL QG1 5.15 
 &rst
  ixpk= 0, nxpk= 0, iat= 121,  -1, r1= 1.30, r2= 1.80, r3= 6.18, r4= 6.68,
 igr2= 144, 145, 146,
 &end
#
# 7 LYS HD3 8 VAL H 5.04 
 &rst
  ixpk= 0, nxpk= 0, iat= 127, 138, r1= 1.30, r2= 1.80, r3= 5.04, r4= 5.54,  &end
#
# 7 LYS H 10 GLU HB2 4.50 
 &rst
  ixpk= 0, nxpk= 0, iat= 116, 165, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
# 7 LYS H 10 GLU HB2 5.00 
 &rst
  ixpk= 0, nxpk= 0, iat= 116, 165, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50,  &end
#
# 7 LYS H 10 GLU H 5.00 
 &rst
  ixpk= 0, nxpk= 0, iat= 116, 161, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50,  &end
#
# 7 LYS H 10 GLU QG 5.00 
 &rst
  ixpk= 0, nxpk= 0, iat= 116,  -1, r1= 1.30, r2= 1.80, r3= 5.61, r4= 6.11,
 igr2= 168, 169,
 &end
#
# 7 LYS H 12 ILE QD1 6.00 
 &rst
  ixpk= 0, nxpk= 0, iat= 116,  -1, r1= 1.30, r2= 1.80, r3= 7.21, r4= 7.71,
 igr2= 200, 201, 202,
 &end
#
# 7 LYS H 8 VAL H 5.66 
 &rst
  ixpk= 0, nxpk= 0, iat= 116, 138, r1= 1.30, r2= 1.80, r3= 5.66, r4= 6.16,  &end
#
# 7 LYS QE 7 LYS HA 5.66 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 118, r1= 1.30, r2= 1.80, r3= 6.35, r4= 6.85,
 igr1= 129, 130,
 &end
#
# 7 LYS QE 8 VAL QG2 4.86 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.55, r4= 7.05,
 igr1= 129, 130,
 igr2= 148, 149, 150,
 &end
#
# 7 LYS QG 8 VAL H 5.22 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 138, r1= 1.30, r2= 1.80, r3= 5.86, r4= 6.36,
 igr1= 123, 124,
 &end
#
# 8 VAL HA 10 GLU H 4.00 
 &rst
  ixpk= 0, nxpk= 0, iat= 140, 161, r1= 1.30, r2= 1.80, r3= 4.00, r4= 4.50,  &end
#
# 8 VAL HA 22 ILE HB 5.50 
 &rst
  ixpk= 0, nxpk= 0, iat= 140, 340, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
# 8 VAL HA 22 ILE H 5.00 
 &rst
  ixpk= 0, nxpk= 0, iat= 140, 336, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50,  &end
#
# 8 VAL HA 22 ILE QD1 6.00 
 &rst
  ixpk= 0, nxpk= 0, iat= 140,  -1, r1= 1.30, r2= 1.80, r3= 7.21, r4= 7.71,
 igr2= 349, 350, 351,
 &end
#
# 8 VAL HA 22 ILE QG2 3.50 
 &rst
  ixpk= 0, nxpk= 0, iat= 140,  -1, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
 igr2= 342, 343, 344,
 &end
#
# 8 VAL HA 23 LEU H 5.80 
 &rst
  ixpk= 0, nxpk= 0, iat= 140, 355, r1= 1.30, r2= 1.80, r3= 5.80, r4= 6.30,  &end
#
# 8 VAL HA 24 GLY HA3 5.00 
 &rst
  ixpk= 0, nxpk= 0, iat= 140, 377, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50,  &end
#
# 8 VAL HA 24 GLY HA2 6.00 
 &rst
  ixpk= 0, nxpk= 0, iat= 140, 376, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,  &end
#
# 8 VAL HA 24 GLY H 5.50 
 &rst
  ixpk= 0, nxpk= 0, iat= 140, 374, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
# 8 VAL HA 25 VAL QG1 4.49 
 &rst
  ixpk= 0, nxpk= 0, iat= 140,  -1, r1= 1.30, r2= 1.80, r3= 5.39, r4= 5.89,
 igr2= 387, 388, 389,
 &end
#
# 8 VAL HA 9 GLY H 3.00 
 &rst
  ixpk= 0, nxpk= 0, iat= 140, 154, r1= 1.30, r2= 1.80, r3= 3.00, r4= 3.50,  &end
#
# 8 VAL HB 22 ILE QG2 4.50 
 &rst
  ixpk= 0, nxpk= 0, iat= 142,  -1, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr2= 342, 343, 344,
 &end
#
# 8 VAL HB 24 GLY H 5.55 
 &rst
  ixpk= 0, nxpk= 0, iat= 142, 374, r1= 1.30, r2= 1.80, r3= 5.55, r4= 6.05,  &end
#
# 8 VAL HB 25 VAL H 4.94 
 &rst
  ixpk= 0, nxpk= 0, iat= 142, 381, r1= 1.30, r2= 1.80, r3= 4.94, r4= 5.44,  &end
#
# 8 VAL HB 25 VAL QG1 5.50 
 &rst
  ixpk= 0, nxpk= 0, iat= 142,  -1, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr2= 387, 388, 389,
 &end
#
# 8 VAL HB 9 GLY HA3 4.82 
 &rst
  ixpk= 0, nxpk= 0, iat= 142, 157, r1= 1.30, r2= 1.80, r3= 4.82, r4= 5.32,  &end
#
# 8 VAL HB 9 GLY H 6.00 
 &rst
  ixpk= 0, nxpk= 0, iat= 142, 154, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,  &end
#
# 8 VAL H 10 GLU H 5.50 
 &rst
  ixpk= 0, nxpk= 0, iat= 138, 161, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
# 8 VAL H 9 GLY H 5.50 
 &rst
  ixpk= 0, nxpk= 0, iat= 138, 154, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
# 8 VAL H 25 VAL QG2 5.80 
 &rst
  ixpk= 0, nxpk= 0, iat= 138,  -1, r1= 1.30, r2= 1.80, r3= 6.97, r4= 7.47,
 igr2= 391, 392, 393,
 &end
#
# 8 VAL QG1 24 GLY HA3 3.50 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 377, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
 igr1= 144, 145, 146,
 &end
#
# 8 VAL QG1 25 VAL H 4.50 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 381, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr1= 144, 145, 146,
 &end
#
# 8 VAL QG1 9 GLY H 3.83 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 154, r1= 1.30, r2= 1.80, r3= 4.60, r4= 5.10,
 igr1= 144, 145, 146,
 &end
#
# 8 VAL QG2 24 GLY HA3 4.00 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 377, r1= 1.30, r2= 1.80, r3= 4.80, r4= 5.30,
 igr1= 148, 149, 150,
 &end
#
# 8 VAL QG2 25 VAL H 4.00 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 381, r1= 1.30, r2= 1.80, r3= 4.80, r4= 5.30,
 igr1= 148, 149, 150,
 &end
#
# 8 VAL QG2 25 VAL QG1 4.00 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.77, r4= 6.27,
 igr1= 148, 149, 150,
 igr2= 387, 388, 389,
 &end
#
# 8 VAL QG2 9 GLY H 5.00 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 154, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,
 igr1= 148, 149, 150,
 &end
#
# 9 GLY HA3 10 GLU H 4.00 
 &rst
  ixpk= 0, nxpk= 0, iat= 157, 161, r1= 1.30, r2= 1.80, r3= 4.00, r4= 4.50,  &end
#
# 9 GLY HA2 10 GLU H 4.00 
 &rst
  ixpk= 0, nxpk= 0, iat= 156, 161, r1= 1.30, r2= 1.80, r3= 4.00, r4= 4.50,  &end
#
# 9 GLY HA3 10 GLU H 5.45 
 &rst
  ixpk= 0, nxpk= 0, iat= 157, 161, r1= 1.30, r2= 1.80, r3= 5.45, r4= 5.95,  &end
#
# 9 GLY HA3 21 THR QG2 5.50 
 &rst
  ixpk= 0, nxpk= 0, iat= 157,  -1, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr2= 328, 329, 330,
 &end
#
# 9 GLY HA3 22 ILE QG2 4.86 
 &rst
  ixpk= 0, nxpk= 0, iat= 157,  -1, r1= 1.30, r2= 1.80, r3= 5.84, r4= 6.34,
 igr2= 342, 343, 344,
 &end
#
# 9 GLY H 10 GLU H 3.50 
 &rst
  ixpk= 0, nxpk= 0, iat= 154, 161, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
# 9 GLY H 22 ILE HB 5.00 
 &rst
  ixpk= 0, nxpk= 0, iat= 154, 340, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50,  &end
#
# 9 GLY H 22 ILE HG12 5.36 
 &rst
  ixpk= 0, nxpk= 0, iat= 154, 346, r1= 1.30, r2= 1.80, r3= 5.36, r4= 5.86,  &end
#
# 9 GLY H 22 ILE H 5.50 
 &rst
  ixpk= 0, nxpk= 0, iat= 154, 336, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
# 9 GLY H 22 ILE QG2 4.00 
 &rst
  ixpk= 0, nxpk= 0, iat= 154,  -1, r1= 1.30, r2= 1.80, r3= 4.80, r4= 5.30,
 igr2= 342, 343, 344,
 &end
#
# 9 GLY H 24 GLY H 5.55 
 &rst
  ixpk= 0, nxpk= 0, iat= 154, 374, r1= 1.30, r2= 1.80, r3= 5.55, r4= 6.05,  &end
#
# 9 GLY H 22 ILE HG13 5.36 
 &rst
  ixpk= 0, nxpk= 0, iat= 154, 347, r1= 1.30, r2= 1.80, r3= 5.36, r4= 5.86,  &end
#
# 9 GLY H 22 ILE QD1 4.34 
 &rst
  ixpk= 0, nxpk= 0, iat= 154,  -1, r1= 1.30, r2= 1.80, r3= 5.21, r4= 5.71,
 igr2= 349, 350, 351,
 &end
#
# 10 GLU HA 11 SER H 3.50 
 &rst
  ixpk= 0, nxpk= 0, iat= 163, 176, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
# 10 GLU H 11 SER H 5.00 
 &rst
  ixpk= 0, nxpk= 0, iat= 161, 176, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50,  &end
#
# 10 GLU H 21 THR QG2 5.30 
 &rst
  ixpk= 0, nxpk= 0, iat= 161,  -1, r1= 1.30, r2= 1.80, r3= 6.36, r4= 6.86,
 igr2= 328, 329, 330,
 &end
#
# 10 GLU H 22 ILE HB 6.00 
 &rst
  ixpk= 0, nxpk= 0, iat= 161, 340, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,  &end
#
# 10 GLU H 22 ILE H 5.00 
 &rst
  ixpk= 0, nxpk= 0, iat= 161, 336, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50,  &end
#
# 10 GLU H 22 ILE QG2 5.50 
 &rst
  ixpk= 0, nxpk= 0, iat= 161,  -1, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr2= 342, 343, 344,
 &end
#
# 11 SER HA 12 ILE HB 5.66 
 &rst
  ixpk= 0, nxpk= 0, iat= 178, 191, r1= 1.30, r2= 1.80, r3= 5.66, r4= 6.16,  &end
#
# 11 SER HA 12 ILE H 3.50 
 &rst
  ixpk= 0, nxpk= 0, iat= 178, 187, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
# 11 SER HA 12 ILE QD1 5.15 
 &rst
  ixpk= 0, nxpk= 0, iat= 178,  -1, r1= 1.30, r2= 1.80, r3= 6.18, r4= 6.68,
 igr2= 200, 201, 202,
 &end
#
# 11 SER HA 12 ILE QG2 6.50 
 &rst
  ixpk= 0, nxpk= 0, iat= 178,  -1, r1= 1.30, r2= 1.80, r3= 7.81, r4= 8.31,
 igr2= 193, 194, 195,
 &end
#
# 11 SER HA 20 ILE H 5.50 
 &rst
  ixpk= 0, nxpk= 0, iat= 178, 303, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
# 11 SER HA 21 THR HA 3.00 
 &rst
  ixpk= 0, nxpk= 0, iat= 178, 324, r1= 1.30, r2= 1.80, r3= 3.00, r4= 3.50,  &end
#
# 11 SER HA 21 THR HB 5.30 
 &rst
  ixpk= 0, nxpk= 0, iat= 178, 326, r1= 1.30, r2= 1.80, r3= 5.30, r4= 5.80,  &end
#
# 11 SER HA 21 THR H 5.50 
 &rst
  ixpk= 0, nxpk= 0, iat= 178, 322, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
# 11 SER HA 22 ILE H 4.50 
 &rst
  ixpk= 0, nxpk= 0, iat= 178, 336, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
# 11 SER HB2 12 ILE H 5.00 
 &rst
  ixpk= 0, nxpk= 0, iat= 180, 187, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50,  &end
#
# 11 SER HB2 12 ILE QG2 6.50 
 &rst
  ixpk= 0, nxpk= 0, iat= 180,  -1, r1= 1.30, r2= 1.80, r3= 7.81, r4= 8.31,
 igr2= 193, 194, 195,
 &end
#
# 11 SER HB3 12 ILE H 5.00 
 &rst
  ixpk= 0, nxpk= 0, iat= 181, 187, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50,  &end
#
# 11 SER HB3 12 ILE QG2 6.50 
 &rst
  ixpk= 0, nxpk= 0, iat= 181,  -1, r1= 1.30, r2= 1.80, r3= 7.81, r4= 8.31,
 igr2= 193, 194, 195,
 &end
#
# 11 SER HB3 19 THR QG2 4.00 
 &rst
  ixpk= 0, nxpk= 0, iat= 181,  -1, r1= 1.30, r2= 1.80, r3= 4.80, r4= 5.30,
 igr2= 295, 296, 297,
 &end
#
# 11 SER H 12 ILE H 5.50 
 &rst
  ixpk= 0, nxpk= 0, iat= 176, 187, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
# 11 SER QB 21 THR HA 5.00 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 324, r1= 1.30, r2= 1.80, r3= 5.61, r4= 6.11,
 igr1= 180, 181,
 &end
#
# 12 ILE HA 12 ILE HB 5.09 
 &rst
  ixpk= 0, nxpk= 0, iat= 189, 191, r1= 1.30, r2= 1.80, r3= 5.09, r4= 5.59,  &end
#
# 12 ILE HA 12 ILE HG13 5.29 
 &rst
  ixpk= 0, nxpk= 0, iat= 189, 198, r1= 1.30, r2= 1.80, r3= 5.29, r4= 5.79,  &end
#
# 12 ILE HA 12 ILE QD1 4.26 
 &rst
  ixpk= 0, nxpk= 0, iat= 189,  -1, r1= 1.30, r2= 1.80, r3= 5.12, r4= 5.62,
 igr2= 200, 201, 202,
 &end
#
# 12 ILE HA 13 ASN H 3.00 
 &rst
  ixpk= 0, nxpk= 0, iat= 189, 206, r1= 1.30, r2= 1.80, r3= 3.00, r4= 3.50,  &end
#
# 12 ILE HB 13 ASN H 4.53 
 &rst
  ixpk= 0, nxpk= 0, iat= 191, 206, r1= 1.30, r2= 1.80, r3= 4.53, r4= 5.03,  &end
#
# 12 ILE HB 20 ILE HA 5.55 
 &rst
  ixpk= 0, nxpk= 0, iat= 191, 305, r1= 1.30, r2= 1.80, r3= 5.55, r4= 6.05,  &end
#
# 12 ILE HB 20 ILE HB 4.42 
 &rst
  ixpk= 0, nxpk= 0, iat= 191, 307, r1= 1.30, r2= 1.80, r3= 4.42, r4= 4.92,  &end
#
# 12 ILE HB 20 ILE H 5.00 
 &rst
  ixpk= 0, nxpk= 0, iat= 191, 303, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50,  &end
#
# 12 ILE H 19 THR HA 5.00 
 &rst
  ixpk= 0, nxpk= 0, iat= 187, 291, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50,  &end
#
# 12 ILE H 20 ILE HB 5.00 
 &rst
  ixpk= 0, nxpk= 0, iat= 187, 307, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50,  &end
#
# 12 ILE H 20 ILE H 3.50 
 &rst
  ixpk= 0, nxpk= 0, iat= 187, 303, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
# 12 ILE H 22 ILE H 5.50 
 &rst
  ixpk= 0, nxpk= 0, iat= 187, 336, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
# 12 ILE H 19 THR HA 5.15 
 &rst
  ixpk= 0, nxpk= 0, iat= 187, 291, r1= 1.30, r2= 1.80, r3= 5.15, r4= 5.65,  &end
#
# 12 ILE QD1 13 ASN H 4.39 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 206, r1= 1.30, r2= 1.80, r3= 5.27, r4= 5.77,
 igr1= 200, 201, 202,
 &end
#
# 12 ILE QG2 13 ASN HA 4.59 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 208, r1= 1.30, r2= 1.80, r3= 5.51, r4= 6.01,
 igr1= 193, 194, 195,
 &end
#
# 12 ILE QG2 13 ASN HB2 4.68 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 210, r1= 1.30, r2= 1.80, r3= 5.62, r4= 6.12,
 igr1= 193, 194, 195,
 &end
#
# 12 ILE QG2 13 ASN H 3.50 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 206, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
 igr1= 193, 194, 195,
 &end
#
# 12 ILE QG2 14 ILE H 4.99 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 220, r1= 1.30, r2= 1.80, r3= 5.99, r4= 6.49,
 igr1= 193, 194, 195,
 &end
#
# 12 ILE QG2 20 ILE HB 4.14 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 307, r1= 1.30, r2= 1.80, r3= 4.97, r4= 5.47,
 igr1= 193, 194, 195,
 &end
#
# 12 ILE QG2 20 ILE HG13 4.00 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 314, r1= 1.30, r2= 1.80, r3= 4.80, r4= 5.30,
 igr1= 193, 194, 195,
 &end
#
# 12 ILE QG2 20 ILE H 4.71 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 303, r1= 1.30, r2= 1.80, r3= 5.66, r4= 6.16,
 igr1= 193, 194, 195,
 &end
#
# 13 ASN HA 14 ILE H 2.80 
 &rst
  ixpk= 0, nxpk= 0, iat= 208, 220, r1= 1.30, r2= 1.80, r3= 2.80, r4= 3.30,  &end
#
# 13 ASN HA 19 THR QG2 4.00 
 &rst
  ixpk= 0, nxpk= 0, iat= 208,  -1, r1= 1.30, r2= 1.80, r3= 4.80, r4= 5.30,
 igr2= 295, 296, 297,
 &end
#
# 13 ASN HA 20 ILE H 5.04 
 &rst
  ixpk= 0, nxpk= 0, iat= 208, 303, r1= 1.30, r2= 1.80, r3= 5.04, r4= 5.54,  &end
#
# 13 ASN HB2 14 ILE H 5.00 
 &rst
  ixpk= 0, nxpk= 0, iat= 210, 220, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50,  &end
#
# 13 ASN HB3 14 ILE H 4.00 
 &rst
  ixpk= 0, nxpk= 0, iat= 211, 220, r1= 1.30, r2= 1.80, r3= 4.00, r4= 4.50,  &end
#
# 13 ASN HB3 19 THR HA 5.36 
 &rst
  ixpk= 0, nxpk= 0, iat= 211, 291, r1= 1.30, r2= 1.80, r3= 5.36, r4= 5.86,  &end
#
# 13 ASN HD21 14 ILE H 5.00 
 &rst
  ixpk= 0, nxpk= 0, iat= 216, 220, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50,  &end
#
# 13 ASN HD21 19 THR HA 5.50 
 &rst
  ixpk= 0, nxpk= 0, iat= 216, 291, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
# 13 ASN HD21 19 THR QG2 3.50 
 &rst
  ixpk= 0, nxpk= 0, iat= 216,  -1, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
 igr2= 295, 296, 297,
 &end
#
# 13 ASN HD21 20 ILE H 6.00 
 &rst
  ixpk= 0, nxpk= 0, iat= 216, 303, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,  &end
#
# 13 ASN HD22 19 THR HA 5.66 
 &rst
  ixpk= 0, nxpk= 0, iat= 215, 291, r1= 1.30, r2= 1.80, r3= 5.66, r4= 6.16,  &end
#
# 13 ASN HD22 19 THR QG2 3.50 
 &rst
  ixpk= 0, nxpk= 0, iat= 215,  -1, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
 igr2= 295, 296, 297,
 &end
#
# 13 ASN H 14 ILE H 5.00 
 &rst
  ixpk= 0, nxpk= 0, iat= 206, 220, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50,  &end
#
# 13 ASN H 20 ILE HG13 6.00 
 &rst
  ixpk= 0, nxpk= 0, iat= 206, 314, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,  &end
#
# 14 ILE HB 18 ILE HB 4.68 
 &rst
  ixpk= 0, nxpk= 0, iat= 224, 274, r1= 1.30, r2= 1.80, r3= 4.68, r4= 5.18,  &end
#
# 14 ILE HB 18 ILE QD1 3.20 
 &rst
  ixpk= 0, nxpk= 0, iat= 224,  -1, r1= 1.30, r2= 1.80, r3= 3.84, r4= 4.34,
 igr2= 283, 284, 285,
 &end
#
# 14 ILE HG12 18 ILE HB 5.50 
 &rst
  ixpk= 0, nxpk= 0, iat= 230, 274, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
# 14 ILE HG13 19 THR HA 4.78 
 &rst
  ixpk= 0, nxpk= 0, iat= 231, 291, r1= 1.30, r2= 1.80, r3= 4.78, r4= 5.28,  &end
#
# 14 ILE H 15 GLY H 5.00 
 &rst
  ixpk= 0, nxpk= 0, iat= 220, 239, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50,  &end
#
# 14 ILE H 18 ILE HB 5.00 
 &rst
  ixpk= 0, nxpk= 0, iat= 220, 274, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50,  &end
#
# 14 ILE H 18 ILE HB 5.50 
 &rst
  ixpk= 0, nxpk= 0, iat= 220, 274, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
# 14 ILE H 18 ILE H 4.50 
 &rst
  ixpk= 0, nxpk= 0, iat= 220, 270, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
# 14 ILE H 18 ILE QD1 5.50 
 &rst
  ixpk= 0, nxpk= 0, iat= 220,  -1, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr2= 283, 284, 285,
 &end
#
# 14 ILE H 18 ILE QG2 4.50 
 &rst
  ixpk= 0, nxpk= 0, iat= 220,  -1, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr2= 276, 277, 278,
 &end
#
# 14 ILE H 19 THR HA 4.00 
 &rst
  ixpk= 0, nxpk= 0, iat= 220, 291, r1= 1.30, r2= 1.80, r3= 4.00, r4= 4.50,  &end
#
# 14 ILE H 20 ILE H 5.00 
 &rst
  ixpk= 0, nxpk= 0, iat= 220, 303, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50,  &end
#
# 14 ILE QG2 15 GLY HA3 4.30 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 242, r1= 1.30, r2= 1.80, r3= 5.16, r4= 5.66,
 igr1= 226, 227, 228,
 &end
#
# 14 ILE QG2 15 GLY H 3.84 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 239, r1= 1.30, r2= 1.80, r3= 4.61, r4= 5.11,
 igr1= 226, 227, 228,
 &end
#
# 15 GLY HA3 16 ASP H 5.00 
 &rst
  ixpk= 0, nxpk= 0, iat= 242, 246, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50,  &end
#
# 15 GLY HA3 17 ASP H 5.00 
 &rst
  ixpk= 0, nxpk= 0, iat= 242, 258, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50,  &end
#
# 15 GLY HA3 18 ILE H 5.00 
 &rst
  ixpk= 0, nxpk= 0, iat= 242, 270, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50,  &end
#
# 15 GLY HA2 16 ASP H 5.00 
 &rst
  ixpk= 0, nxpk= 0, iat= 241, 246, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50,  &end
#
# 15 GLY HA2 17 ASP H 5.50 
 &rst
  ixpk= 0, nxpk= 0, iat= 241, 258, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
# 15 GLY HA2 18 ILE QD1 5.00 
 &rst
  ixpk= 0, nxpk= 0, iat= 241,  -1, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,
 igr2= 283, 284, 285,
 &end
#
# 16 ASP HA 17 ASP H 5.15 
 &rst
  ixpk= 0, nxpk= 0, iat= 248, 258, r1= 1.30, r2= 1.80, r3= 5.15, r4= 5.65,  &end
#
# 16 ASP HA 18 ILE H 5.36 
 &rst
  ixpk= 0, nxpk= 0, iat= 248, 270, r1= 1.30, r2= 1.80, r3= 5.36, r4= 5.86,  &end
#
# 16 ASP HB2 17 ASP H 5.50 
 &rst
  ixpk= 0, nxpk= 0, iat= 250, 258, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
# 16 ASP HB3 17 ASP H 5.50 
 &rst
  ixpk= 0, nxpk= 0, iat= 251, 258, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
# 16 ASP H 17 ASP H 5.00 
 &rst
  ixpk= 0, nxpk= 0, iat= 246, 258, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50,  &end
#
# 17 ASP HA 18 ILE H 5.00 
 &rst
  ixpk= 0, nxpk= 0, iat= 260, 270, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50,  &end
#
# 17 ASP HA 18 ILE QD1 4.47 
 &rst
  ixpk= 0, nxpk= 0, iat= 260,  -1, r1= 1.30, r2= 1.80, r3= 5.37, r4= 5.87,
 igr2= 283, 284, 285,
 &end
#
# 17 ASP HA 37 PRO HD3 5.29 
 &rst
  ixpk= 0, nxpk= 0, iat= 260, 560, r1= 1.30, r2= 1.80, r3= 5.29, r4= 5.79,  &end
#
# 17 ASP HA 37 PRO HG2 5.50 
 &rst
  ixpk= 0, nxpk= 0, iat= 260, 562, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
# 17 ASP HA 37 PRO HG3 4.59 
 &rst
  ixpk= 0, nxpk= 0, iat= 260, 563, r1= 1.30, r2= 1.80, r3= 4.59, r4= 5.09,  &end
#
# 17 ASP HB2 18 ILE HA 6.00 
 &rst
  ixpk= 0, nxpk= 0, iat= 262, 272, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,  &end
#
# 17 ASP HB2 18 ILE H 5.00 
 &rst
  ixpk= 0, nxpk= 0, iat= 262, 270, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50,  &end
#
# 17 ASP HB2 18 ILE QD1 4.33 
 &rst
  ixpk= 0, nxpk= 0, iat= 262,  -1, r1= 1.30, r2= 1.80, r3= 5.20, r4= 5.70,
 igr2= 283, 284, 285,
 &end
#
# 17 ASP HB2 36 ALA HA 5.30 
 &rst
  ixpk= 0, nxpk= 0, iat= 262, 550, r1= 1.30, r2= 1.80, r3= 5.30, r4= 5.80,  &end
#
# 17 ASP HB2 36 ALA QB 6.30 
 &rst
  ixpk= 0, nxpk= 0, iat= 262,  -1, r1= 1.30, r2= 1.80, r3= 7.57, r4= 8.07,
 igr2= 552, 553, 554,
 &end
#
# 17 ASP HB2 37 PRO HD2 4.68 
 &rst
  ixpk= 0, nxpk= 0, iat= 262, 559, r1= 1.30, r2= 1.80, r3= 4.68, r4= 5.18,  &end
#
# 17 ASP HB2 37 PRO HG2 4.36 
 &rst
  ixpk= 0, nxpk= 0, iat= 262, 562, r1= 1.30, r2= 1.80, r3= 4.36, r4= 4.86,  &end
#
# 17 ASP HB2 37 PRO HG3 4.20 
 &rst
  ixpk= 0, nxpk= 0, iat= 262, 563, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,  &end
#
# 17 ASP HB3 18 ILE HA 5.22 
 &rst
  ixpk= 0, nxpk= 0, iat= 263, 272, r1= 1.30, r2= 1.80, r3= 5.22, r4= 5.72,  &end
#
# 17 ASP HB3 18 ILE H 4.50 
 &rst
  ixpk= 0, nxpk= 0, iat= 263, 270, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
# 17 ASP HB3 18 ILE QD1 4.27 
 &rst
  ixpk= 0, nxpk= 0, iat= 263,  -1, r1= 1.30, r2= 1.80, r3= 5.13, r4= 5.63,
 igr2= 283, 284, 285,
 &end
#
# 17 ASP HB3 37 PRO HD2 4.54 
 &rst
  ixpk= 0, nxpk= 0, iat= 263, 559, r1= 1.30, r2= 1.80, r3= 4.54, r4= 5.04,  &end
#
# 17 ASP HB3 37 PRO HG2 4.27 
 &rst
  ixpk= 0, nxpk= 0, iat= 263, 562, r1= 1.30, r2= 1.80, r3= 4.27, r4= 4.77,  &end
#
# 17 ASP HB3 37 PRO HG3 4.14 
 &rst
  ixpk= 0, nxpk= 0, iat= 263, 563, r1= 1.30, r2= 1.80, r3= 4.14, r4= 4.64,  &end
#
# 17 ASP H 18 ILE H 3.00 
 &rst
  ixpk= 0, nxpk= 0, iat= 258, 270, r1= 1.30, r2= 1.80, r3= 3.00, r4= 3.50,  &end
#
# 17 ASP H 18 ILE QD1 6.00 
 &rst
  ixpk= 0, nxpk= 0, iat= 258,  -1, r1= 1.30, r2= 1.80, r3= 7.21, r4= 7.71,
 igr2= 283, 284, 285,
 &end
#
# 18 ILE HA 19 THR HB 5.09 
 &rst
  ixpk= 0, nxpk= 0, iat= 272, 293, r1= 1.30, r2= 1.80, r3= 5.09, r4= 5.59,  &end
#
# 18 ILE HA 19 THR H 3.00 
 &rst
  ixpk= 0, nxpk= 0, iat= 272, 289, r1= 1.30, r2= 1.80, r3= 3.00, r4= 3.50,  &end
#
# 18 ILE HA 36 ALA QB 4.54 
 &rst
  ixpk= 0, nxpk= 0, iat= 272,  -1, r1= 1.30, r2= 1.80, r3= 5.45, r4= 5.95,
 igr2= 552, 553, 554,
 &end
#
# 18 ILE HB 19 THR HA 5.36 
 &rst
  ixpk= 0, nxpk= 0, iat= 274, 291, r1= 1.30, r2= 1.80, r3= 5.36, r4= 5.86,  &end
#
# 18 ILE HB 19 THR H 4.99 
 &rst
  ixpk= 0, nxpk= 0, iat= 274, 289, r1= 1.30, r2= 1.80, r3= 4.99, r4= 5.49,  &end
#
# 18 ILE HB 36 ALA QB 4.99 
 &rst
  ixpk= 0, nxpk= 0, iat= 274,  -1, r1= 1.30, r2= 1.80, r3= 5.99, r4= 6.49,
 igr2= 552, 553, 554,
 &end
#
# 18 ILE HG12 19 THR H 5.66 
 &rst
  ixpk= 0, nxpk= 0, iat= 280, 289, r1= 1.30, r2= 1.80, r3= 5.66, r4= 6.16,  &end
#
# 18 ILE HG12 36 ALA HA 4.50 
 &rst
  ixpk= 0, nxpk= 0, iat= 280, 550, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
# 18 ILE HG12 36 ALA QB 5.00 
 &rst
  ixpk= 0, nxpk= 0, iat= 280,  -1, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,
 igr2= 552, 553, 554,
 &end
#
# 18 ILE H 19 THR H 5.00 
 &rst
  ixpk= 0, nxpk= 0, iat= 270, 289, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50,  &end
#
# 18 ILE H 36 ALA QB 5.36 
 &rst
  ixpk= 0, nxpk= 0, iat= 270,  -1, r1= 1.30, r2= 1.80, r3= 6.44, r4= 6.94,
 igr2= 552, 553, 554,
 &end
#
# 18 ILE QD1 19 THR H 5.00 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 289, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,
 igr1= 283, 284, 285,
 &end
#
# 18 ILE QD1 36 ALA HA 5.00 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 550, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,
 igr1= 283, 284, 285,
 &end
#
# 18 ILE QD1 37 PRO HD2 5.50 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 559, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr1= 283, 284, 285,
 &end
#
# 18 ILE QD1 37 PRO HD3 5.50 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 560, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr1= 283, 284, 285,
 &end
#
# 18 ILE QG1 37 PRO HD2 5.50 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 559, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 280, 281,
 &end
#
# 18 ILE QG2 19 THR H 3.66 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 289, r1= 1.30, r2= 1.80, r3= 4.40, r4= 4.90,
 igr1= 276, 277, 278,
 &end
#
# 18 ILE QG2 35 ASN H 5.50 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 534, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr1= 276, 277, 278,
 &end
#
# 18 ILE QG2 36 ALA HA 4.00 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 550, r1= 1.30, r2= 1.80, r3= 4.80, r4= 5.30,
 igr1= 276, 277, 278,
 &end
#
# 18 ILE QG2 36 ALA QB 3.29 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.75, r4= 5.25,
 igr1= 276, 277, 278,
 igr2= 552, 553, 554,
 &end
#
# 18 ILE QG2 37 PRO HD2 5.00 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 559, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,
 igr1= 276, 277, 278,
 &end
#
# 19 THR HA 20 ILE HB 5.15 
 &rst
  ixpk= 0, nxpk= 0, iat= 291, 307, r1= 1.30, r2= 1.80, r3= 5.15, r4= 5.65,  &end
#
# 19 THR HA 20 ILE H 4.00 
 &rst
  ixpk= 0, nxpk= 0, iat= 291, 303, r1= 1.30, r2= 1.80, r3= 4.00, r4= 4.50,  &end
#
# 19 THR HB 20 ILE H 4.00 
 &rst
  ixpk= 0, nxpk= 0, iat= 293, 303, r1= 1.30, r2= 1.80, r3= 4.00, r4= 4.50,  &end
#
# 19 THR HB 35 ASN HB2 4.13 
 &rst
  ixpk= 0, nxpk= 0, iat= 293, 538, r1= 1.30, r2= 1.80, r3= 4.13, r4= 4.63,  &end
#
# 19 THR HB 35 ASN HB3 4.01 
 &rst
  ixpk= 0, nxpk= 0, iat= 293, 539, r1= 1.30, r2= 1.80, r3= 4.01, r4= 4.51,  &end
#
# 19 THR HB 35 ASN H 5.93 
 &rst
  ixpk= 0, nxpk= 0, iat= 293, 534, r1= 1.30, r2= 1.80, r3= 5.93, r4= 6.43,  &end
#
# 19 THR H 20 ILE HA 5.50 
 &rst
  ixpk= 0, nxpk= 0, iat= 289, 305, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
# 19 THR H 35 ASN HB2 4.50 
 &rst
  ixpk= 0, nxpk= 0, iat= 289, 538, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
# 19 THR H 35 ASN HB3 4.50 
 &rst
  ixpk= 0, nxpk= 0, iat= 289, 539, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
# 19 THR H 36 ALA HA 6.00 
 &rst
  ixpk= 0, nxpk= 0, iat= 289, 550, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,  &end
#
# 19 THR QG2 20 ILE H 3.00 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 303, r1= 1.30, r2= 1.80, r3= 3.60, r4= 4.10,
 igr1= 295, 296, 297,
 &end
#
# 19 THR QG2 35 ASN HB2 5.00 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 538, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,
 igr1= 295, 296, 297,
 &end
#
# 19 THR QG2 35 ASN HB3 4.20 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 539, r1= 1.30, r2= 1.80, r3= 5.04, r4= 5.54,
 igr1= 295, 296, 297,
 &end
#
# 20 ILE HA 20 ILE HB 5.50 
 &rst
  ixpk= 0, nxpk= 0, iat= 305, 307, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
# 20 ILE HA 20 ILE HG12 5.50 
 &rst
  ixpk= 0, nxpk= 0, iat= 305, 313, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
# 20 ILE HA 20 ILE HG13 5.50 
 &rst
  ixpk= 0, nxpk= 0, iat= 305, 314, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
# 20 ILE HA 20 ILE H 5.78 
 &rst
  ixpk= 0, nxpk= 0, iat= 305, 303, r1= 1.30, r2= 1.80, r3= 5.78, r4= 6.28,  &end
#
# 20 ILE HA 20 ILE QG2 2.50 
 &rst
  ixpk= 0, nxpk= 0, iat= 305,  -1, r1= 1.30, r2= 1.80, r3= 3.00, r4= 3.50,
 igr2= 309, 310, 311,
 &end
#
# 20 ILE HA 21 THR HB 5.00 
 &rst
  ixpk= 0, nxpk= 0, iat= 305, 326, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50,  &end
#
# 20 ILE HA 21 THR H 2.80 
 &rst
  ixpk= 0, nxpk= 0, iat= 305, 322, r1= 1.30, r2= 1.80, r3= 2.80, r4= 3.30,  &end
#
# 20 ILE HA 34 ILE HB 5.80 
 &rst
  ixpk= 0, nxpk= 0, iat= 305, 519, r1= 1.30, r2= 1.80, r3= 5.80, r4= 6.30,  &end
#
# 20 ILE HB 21 THR H 4.99 
 &rst
  ixpk= 0, nxpk= 0, iat= 307, 322, r1= 1.30, r2= 1.80, r3= 4.99, r4= 5.49,  &end
#
# 20 ILE HB 34 ILE HA 5.50 
 &rst
  ixpk= 0, nxpk= 0, iat= 307, 517, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
# 20 ILE HG12 21 THR H 5.04 
 &rst
  ixpk= 0, nxpk= 0, iat= 313, 322, r1= 1.30, r2= 1.80, r3= 5.04, r4= 5.54,  &end
#
# 20 ILE H 21 THR H 5.00 
 &rst
  ixpk= 0, nxpk= 0, iat= 303, 322, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50,  &end
#
# 20 ILE QD1 34 ILE HA 3.00 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 517, r1= 1.30, r2= 1.80, r3= 3.60, r4= 4.10,
 igr1= 316, 317, 318,
 &end
#
# 20 ILE QG2 21 THR H 3.85 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 322, r1= 1.30, r2= 1.80, r3= 4.62, r4= 5.12,
 igr1= 309, 310, 311,
 &end
#
# 20 ILE QG2 34 ILE HA 4.00 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 517, r1= 1.30, r2= 1.80, r3= 4.80, r4= 5.30,
 igr1= 309, 310, 311,
 &end
#
# 21 THR HA 22 ILE H 3.50 
 &rst
  ixpk= 0, nxpk= 0, iat= 324, 336, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
# 21 THR HA 22 ILE QG2 4.54 
 &rst
  ixpk= 0, nxpk= 0, iat= 324,  -1, r1= 1.30, r2= 1.80, r3= 5.45, r4= 5.95,
 igr2= 342, 343, 344,
 &end
#
# 21 THR HB 21 THR H 4.86 
 &rst
  ixpk= 0, nxpk= 0, iat= 326, 322, r1= 1.30, r2= 1.80, r3= 4.86, r4= 5.36,  &end
#
# 21 THR HB 22 ILE HA 5.45 
 &rst
  ixpk= 0, nxpk= 0, iat= 326, 338, r1= 1.30, r2= 1.80, r3= 5.45, r4= 5.95,  &end
#
# 21 THR HB 23 LEU QD1 4.90 
 &rst
  ixpk= 0, nxpk= 0, iat= 326,  -1, r1= 1.30, r2= 1.80, r3= 5.88, r4= 6.38,
 igr2= 364, 365, 366,
 &end
#
# 21 THR HB 23 LEU QD2 4.00 
 &rst
  ixpk= 0, nxpk= 0, iat= 326,  -1, r1= 1.30, r2= 1.80, r3= 4.80, r4= 5.30,
 igr2= 368, 369, 370,
 &end
#
# 21 THR HB 33 GLY H 5.00 
 &rst
  ixpk= 0, nxpk= 0, iat= 326, 508, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50,  &end
#
# 21 THR H 22 ILE H 5.00 
 &rst
  ixpk= 0, nxpk= 0, iat= 322, 336, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50,  &end
#
# 21 THR H 32 ILE QG2 4.38 
 &rst
  ixpk= 0, nxpk= 0, iat= 322,  -1, r1= 1.30, r2= 1.80, r3= 5.26, r4= 5.76,
 igr2= 495, 496, 497,
 &end
#
# 21 THR H 33 GLY HA2 5.36 
 &rst
  ixpk= 0, nxpk= 0, iat= 322, 510, r1= 1.30, r2= 1.80, r3= 5.36, r4= 5.86,  &end
#
# 21 THR H 33 GLY H 4.00 
 &rst
  ixpk= 0, nxpk= 0, iat= 322, 508, r1= 1.30, r2= 1.80, r3= 4.00, r4= 4.50,  &end
#
# 21 THR H 35 ASN H 5.78 
 &rst
  ixpk= 0, nxpk= 0, iat= 322, 534, r1= 1.30, r2= 1.80, r3= 5.78, r4= 6.28,  &end
#
# 21 THR QG2 21 THR H 4.38 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 322, r1= 1.30, r2= 1.80, r3= 5.26, r4= 5.76,
 igr1= 328, 329, 330,
 &end
#
# 21 THR QG2 23 LEU H 5.20 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 355, r1= 1.30, r2= 1.80, r3= 6.24, r4= 6.74,
 igr1= 328, 329, 330,
 &end
#
# 21 THR QG2 23 LEU QD2 2.40 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 3.46, r4= 3.96,
 igr1= 328, 329, 330,
 igr2= 368, 369, 370,
 &end
#
# 22 ILE HA 23 LEU HB2 5.50 
 &rst
  ixpk= 0, nxpk= 0, iat= 338, 359, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
# 22 ILE HA 23 LEU H 3.00 
 &rst
  ixpk= 0, nxpk= 0, iat= 338, 355, r1= 1.30, r2= 1.80, r3= 3.00, r4= 3.50,  &end
#
# 22 ILE HA 24 GLY H 5.50 
 &rst
  ixpk= 0, nxpk= 0, iat= 338, 374, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
# 22 ILE HA 30 VAL QG1 4.13 
 &rst
  ixpk= 0, nxpk= 0, iat= 338,  -1, r1= 1.30, r2= 1.80, r3= 4.96, r4= 5.46,
 igr2= 455, 456, 457,
 &end
#
# 22 ILE HA 31 ARG HB3 6.00 
 &rst
  ixpk= 0, nxpk= 0, iat= 338, 470, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,  &end
#
# 22 ILE HA 32 ILE HA 5.00 
 &rst
  ixpk= 0, nxpk= 0, iat= 338, 491, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50,  &end
#
# 22 ILE HA 32 ILE HG12 5.80 
 &rst
  ixpk= 0, nxpk= 0, iat= 338, 499, r1= 1.30, r2= 1.80, r3= 5.80, r4= 6.30,  &end
#
# 22 ILE HA 32 ILE HG13 5.80 
 &rst
  ixpk= 0, nxpk= 0, iat= 338, 500, r1= 1.30, r2= 1.80, r3= 5.80, r4= 6.30,  &end
#
# 22 ILE HA 32 ILE QD1 4.50 
 &rst
  ixpk= 0, nxpk= 0, iat= 338,  -1, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr2= 502, 503, 504,
 &end
#
# 22 ILE HA 32 ILE QG2 5.00 
 &rst
  ixpk= 0, nxpk= 0, iat= 338,  -1, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,
 igr2= 495, 496, 497,
 &end
#
# 22 ILE HA 33 GLY H 5.00 
 &rst
  ixpk= 0, nxpk= 0, iat= 338, 508, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50,  &end
#
# 22 ILE HB 23 LEU H 5.50 
 &rst
  ixpk= 0, nxpk= 0, iat= 340, 355, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
# 22 ILE HB 30 VAL QG1 5.20 
 &rst
  ixpk= 0, nxpk= 0, iat= 340,  -1, r1= 1.30, r2= 1.80, r3= 6.24, r4= 6.74,
 igr2= 455, 456, 457,
 &end
#
# 22 ILE HB 32 ILE HA 5.50 
 &rst
  ixpk= 0, nxpk= 0, iat= 340, 491, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
# 22 ILE HB 32 ILE QD1 5.50 
 &rst
  ixpk= 0, nxpk= 0, iat= 340,  -1, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr2= 502, 503, 504,
 &end
#
# 22 ILE H 23 LEU H 5.50 
 &rst
  ixpk= 0, nxpk= 0, iat= 336, 355, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
# 22 ILE QD1 23 LEU QD2 4.78 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.89, r4= 7.39,
 igr1= 349, 350, 351,
 igr2= 368, 369, 370,
 &end
#
# 22 ILE QD1 24 GLY H 4.86 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 374, r1= 1.30, r2= 1.80, r3= 5.84, r4= 6.34,
 igr1= 349, 350, 351,
 &end
#
# 22 ILE QD1 31 ARG H 5.20 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 465, r1= 1.30, r2= 1.80, r3= 6.24, r4= 6.74,
 igr1= 349, 350, 351,
 &end
#
# 22 ILE QD1 32 ILE HA 3.50 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 491, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
 igr1= 349, 350, 351,
 &end
#
# 22 ILE QG2 23 LEU H 5.20 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 355, r1= 1.30, r2= 1.80, r3= 6.24, r4= 6.74,
 igr1= 342, 343, 344,
 &end
#
# 22 ILE QG2 24 GLY H 4.70 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 374, r1= 1.30, r2= 1.80, r3= 5.64, r4= 6.14,
 igr1= 342, 343, 344,
 &end
#
# 23 LEU HG 33 GLY H 5.45 
 &rst
  ixpk= 0, nxpk= 0, iat= 362, 508, r1= 1.30, r2= 1.80, r3= 5.45, r4= 5.95,  &end
#
# 23 LEU H 23 LEU HB2 5.22 
 &rst
  ixpk= 0, nxpk= 0, iat= 355, 359, r1= 1.30, r2= 1.80, r3= 5.22, r4= 5.72,  &end
#
# 23 LEU H 23 LEU HB3 5.22 
 &rst
  ixpk= 0, nxpk= 0, iat= 355, 360, r1= 1.30, r2= 1.80, r3= 5.22, r4= 5.72,  &end
#
# 23 LEU H 24 GLY H 3.50 
 &rst
  ixpk= 0, nxpk= 0, iat= 355, 374, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
# 23 LEU H 31 ARG H 5.09 
 &rst
  ixpk= 0, nxpk= 0, iat= 355, 465, r1= 1.30, r2= 1.80, r3= 5.09, r4= 5.59,  &end
#
# 23 LEU H 33 GLY H 4.50 
 &rst
  ixpk= 0, nxpk= 0, iat= 355, 508, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
# 23 LEU H 23 LEU QD2 4.94 
 &rst
  ixpk= 0, nxpk= 0, iat= 355,  -1, r1= 1.30, r2= 1.80, r3= 5.93, r4= 6.43,
 igr2= 368, 369, 370,
 &end
#
# 23 LEU QD1 31 ARG HB2 4.65 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 469, r1= 1.30, r2= 1.80, r3= 5.58, r4= 6.08,
 igr1= 364, 365, 366,
 &end
#
# 23 LEU QD1 31 ARG HB3 4.49 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 470, r1= 1.30, r2= 1.80, r3= 5.39, r4= 5.89,
 igr1= 364, 365, 366,
 &end
#
# 23 LEU QD1 31 ARG HD2 5.15 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 475, r1= 1.30, r2= 1.80, r3= 6.18, r4= 6.68,
 igr1= 364, 365, 366,
 &end
#
# 23 LEU QD1 31 ARG HE 6.35 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 478, r1= 1.30, r2= 1.80, r3= 7.63, r4= 8.13,
 igr1= 364, 365, 366,
 &end
#
# 23 LEU QD1 33 GLY HA2 4.62 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 510, r1= 1.30, r2= 1.80, r3= 5.55, r4= 6.05,
 igr1= 364, 365, 366,
 &end
#
# 23 LEU QD1 33 GLY HA3 4.65 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 511, r1= 1.30, r2= 1.80, r3= 5.58, r4= 6.08,
 igr1= 364, 365, 366,
 &end
#
# 23 LEU QD1 33 GLY H 4.74 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 508, r1= 1.30, r2= 1.80, r3= 5.69, r4= 6.19,
 igr1= 364, 365, 366,
 &end
#
# 23 LEU QD1 34 ILE H 5.55 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 515, r1= 1.30, r2= 1.80, r3= 6.67, r4= 7.17,
 igr1= 364, 365, 366,
 &end
#
# 23 LEU QD2 24 GLY H 5.36 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 374, r1= 1.30, r2= 1.80, r3= 6.44, r4= 6.94,
 igr1= 368, 369, 370,
 &end
#
# 23 LEU QD2 33 GLY HA2 5.04 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 510, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55,
 igr1= 368, 369, 370,
 &end
#
# 23 LEU QD2 33 GLY HA3 5.15 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 511, r1= 1.30, r2= 1.80, r3= 6.18, r4= 6.68,
 igr1= 368, 369, 370,
 &end
#
# 23 LEU QD2 33 GLY H 5.04 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 508, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55,
 igr1= 368, 369, 370,
 &end
#
# 24 GLY HA2 31 ARG H 5.15 
 &rst
  ixpk= 0, nxpk= 0, iat= 376, 465, r1= 1.30, r2= 1.80, r3= 5.15, r4= 5.65,  &end
#
# 24 GLY HA3 25 VAL H 4.38 
 &rst
  ixpk= 0, nxpk= 0, iat= 377, 381, r1= 1.30, r2= 1.80, r3= 4.38, r4= 4.88,  &end
#
# 24 GLY HA3 31 ARG HB3 5.50 
 &rst
  ixpk= 0, nxpk= 0, iat= 377, 470, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
# 24 GLY HA3 31 ARG H 5.15 
 &rst
  ixpk= 0, nxpk= 0, iat= 377, 465, r1= 1.30, r2= 1.80, r3= 5.15, r4= 5.65,  &end
#
# 24 GLY H 25 VAL H 5.04 
 &rst
  ixpk= 0, nxpk= 0, iat= 374, 381, r1= 1.30, r2= 1.80, r3= 5.04, r4= 5.54,  &end
#
# 24 GLY H 25 VAL QG1 4.44 
 &rst
  ixpk= 0, nxpk= 0, iat= 374,  -1, r1= 1.30, r2= 1.80, r3= 5.33, r4= 5.83,
 igr2= 387, 388, 389,
 &end
#
# 24 GLY H 30 VAL QG1 4.24 
 &rst
  ixpk= 0, nxpk= 0, iat= 374,  -1, r1= 1.30, r2= 1.80, r3= 5.09, r4= 5.59,
 igr2= 455, 456, 457,
 &end
#
# 24 GLY H 31 ARG HD2 5.93 
 &rst
  ixpk= 0, nxpk= 0, iat= 374, 475, r1= 1.30, r2= 1.80, r3= 5.93, r4= 6.43,  &end
#
# 24 GLY H 31 ARG H 4.00 
 &rst
  ixpk= 0, nxpk= 0, iat= 374, 465, r1= 1.30, r2= 1.80, r3= 4.00, r4= 4.50,  &end
#
# 24 GLY H 30 VAL QG1 4.71 
 &rst
  ixpk= 0, nxpk= 0, iat= 374,  -1, r1= 1.30, r2= 1.80, r3= 5.66, r4= 6.16,
 igr2= 455, 456, 457,
 &end
#
# 25 VAL HA 26 SER H 2.80 
 &rst
  ixpk= 0, nxpk= 0, iat= 383, 397, r1= 1.30, r2= 1.80, r3= 2.80, r4= 3.30,  &end
#
# 25 VAL HB 26 SER H 4.49 
 &rst
  ixpk= 0, nxpk= 0, iat= 385, 397, r1= 1.30, r2= 1.80, r3= 4.49, r4= 4.99,  &end
#
# 25 VAL H 30 VAL QG1 5.50 
 &rst
  ixpk= 0, nxpk= 0, iat= 381,  -1, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr2= 455, 456, 457,
 &end
#
# 25 VAL H 30 VAL QG2 5.50 
 &rst
  ixpk= 0, nxpk= 0, iat= 381,  -1, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr2= 459, 460, 461,
 &end
#
# 25 VAL H 31 ARG H 5.50 
 &rst
  ixpk= 0, nxpk= 0, iat= 381, 465, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
# 25 VAL QG1 27 GLY H 5.00 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 408, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,
 igr1= 387, 388, 389,
 &end
#
# 25 VAL QG2 26 SER HB2 5.15 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 401, r1= 1.30, r2= 1.80, r3= 6.18, r4= 6.68,
 igr1= 391, 392, 393,
 &end
#
# 25 VAL QG2 26 SER HB3 5.29 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 402, r1= 1.30, r2= 1.80, r3= 6.35, r4= 6.85,
 igr1= 391, 392, 393,
 &end
#
# 25 VAL QG2 26 SER H 3.69 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 397, r1= 1.30, r2= 1.80, r3= 4.43, r4= 4.93,
 igr1= 391, 392, 393,
 &end
#
# 25 VAL QG2 27 GLY HA3 5.29 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 411, r1= 1.30, r2= 1.80, r3= 6.35, r4= 6.85,
 igr1= 391, 392, 393,
 &end
#
# 25 VAL QG2 27 GLY H 5.55 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 408, r1= 1.30, r2= 1.80, r3= 6.67, r4= 7.17,
 igr1= 391, 392, 393,
 &end
#
# 25 VAL QG2 28 GLN HE21 6.00 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 428, r1= 1.30, r2= 1.80, r3= 7.21, r4= 7.71,
 igr1= 391, 392, 393,
 &end
#
# 25 VAL QG2 28 GLN HE22 5.09 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 427, r1= 1.30, r2= 1.80, r3= 6.11, r4= 6.61,
 igr1= 391, 392, 393,
 &end
#
# 25 VAL QG2 28 GLN H 6.35 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 415, r1= 1.30, r2= 1.80, r3= 7.63, r4= 8.13,
 igr1= 391, 392, 393,
 &end
#
# 25 VAL QG2 29 GLN H 5.15 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 432, r1= 1.30, r2= 1.80, r3= 6.18, r4= 6.68,
 igr1= 391, 392, 393,
 &end
#
# 26 SER HA 27 GLY H 3.00 
 &rst
  ixpk= 0, nxpk= 0, iat= 399, 408, r1= 1.30, r2= 1.80, r3= 3.00, r4= 3.50,  &end
#
# 26 SER HB2 29 GLN HB2 6.00 
 &rst
  ixpk= 0, nxpk= 0, iat= 401, 436, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,  &end
#
# 26 SER HB2 29 GLN HB3 6.00 
 &rst
  ixpk= 0, nxpk= 0, iat= 401, 437, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,  &end
#
# 26 SER HB3 27 GLY H 5.50 
 &rst
  ixpk= 0, nxpk= 0, iat= 402, 408, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
# 26 SER HB3 29 GLN HB3 5.36 
 &rst
  ixpk= 0, nxpk= 0, iat= 402, 437, r1= 1.30, r2= 1.80, r3= 5.36, r4= 5.86,  &end
#
# 26 SER H 27 GLY H 5.50 
 &rst
  ixpk= 0, nxpk= 0, iat= 397, 408, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
# 26 SER H 29 GLN H 5.00 
 &rst
  ixpk= 0, nxpk= 0, iat= 397, 432, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50,  &end
#
# 27 GLY HA2 28 GLN H 4.30 
 &rst
  ixpk= 0, nxpk= 0, iat= 410, 415, r1= 1.30, r2= 1.80, r3= 4.30, r4= 4.80,  &end
#
# 27 GLY HA3 28 GLN HA 5.09 
 &rst
  ixpk= 0, nxpk= 0, iat= 411, 417, r1= 1.30, r2= 1.80, r3= 5.09, r4= 5.59,  &end
#
# 27 GLY HA3 28 GLN HB3 5.45 
 &rst
  ixpk= 0, nxpk= 0, iat= 411, 420, r1= 1.30, r2= 1.80, r3= 5.45, r4= 5.95,  &end
#
# 27 GLY HA3 28 GLN H 4.00 
 &rst
  ixpk= 0, nxpk= 0, iat= 411, 415, r1= 1.30, r2= 1.80, r3= 4.00, r4= 4.50,  &end
#
# 27 GLY HA3 29 GLN HG3 5.29 
 &rst
  ixpk= 0, nxpk= 0, iat= 411, 440, r1= 1.30, r2= 1.80, r3= 5.29, r4= 5.79,  &end
#
# 27 GLY HA3 29 GLN H 5.45 
 &rst
  ixpk= 0, nxpk= 0, iat= 411, 432, r1= 1.30, r2= 1.80, r3= 5.45, r4= 5.95,  &end
#
# 27 GLY H 29 GLN H 5.50 
 &rst
  ixpk= 0, nxpk= 0, iat= 408, 432, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
# 28 GLN HA 29 GLN H 3.80 
 &rst
  ixpk= 0, nxpk= 0, iat= 417, 432, r1= 1.30, r2= 1.80, r3= 3.80, r4= 4.30,  &end
#
# 28 GLN HB2 29 GLN H 5.55 
 &rst
  ixpk= 0, nxpk= 0, iat= 419, 432, r1= 1.30, r2= 1.80, r3= 5.55, r4= 6.05,  &end
#
# 28 GLN HB3 28 GLN HE21 5.09 
 &rst
  ixpk= 0, nxpk= 0, iat= 420, 428, r1= 1.30, r2= 1.80, r3= 5.09, r4= 5.59,  &end
#
# 28 GLN HB3 28 GLN HE22 5.29 
 &rst
  ixpk= 0, nxpk= 0, iat= 420, 427, r1= 1.30, r2= 1.80, r3= 5.29, r4= 5.79,  &end
#
# 28 GLN HB3 28 GLN H 5.93 
 &rst
  ixpk= 0, nxpk= 0, iat= 420, 415, r1= 1.30, r2= 1.80, r3= 5.93, r4= 6.43,  &end
#
# 28 GLN HB3 29 GLN H 4.86 
 &rst
  ixpk= 0, nxpk= 0, iat= 420, 432, r1= 1.30, r2= 1.80, r3= 4.86, r4= 5.36,  &end
#
# 28 GLN HE21 28 GLN HB3 5.45 
 &rst
  ixpk= 0, nxpk= 0, iat= 428, 420, r1= 1.30, r2= 1.80, r3= 5.45, r4= 5.95,  &end
#
# 28 GLN H 28 GLN HB3 5.04 
 &rst
  ixpk= 0, nxpk= 0, iat= 415, 420, r1= 1.30, r2= 1.80, r3= 5.04, r4= 5.54,  &end
#
# 28 GLN H 29 GLN HB3 5.45 
 &rst
  ixpk= 0, nxpk= 0, iat= 415, 437, r1= 1.30, r2= 1.80, r3= 5.45, r4= 5.95,  &end
#
# 28 GLN H 29 GLN H 3.00 
 &rst
  ixpk= 0, nxpk= 0, iat= 415, 432, r1= 1.30, r2= 1.80, r3= 3.00, r4= 3.50,  &end
#
# 28 GLN QG 28 GLN H 5.29 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 415, r1= 1.30, r2= 1.80, r3= 5.94, r4= 6.44,
 igr1= 422, 423,
 &end
#
# 28 GLN QG 29 GLN H 5.00 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 432, r1= 1.30, r2= 1.80, r3= 5.61, r4= 6.11,
 igr1= 422, 423,
 &end
#
# 29 GLN HA 30 VAL H 2.80 
 &rst
  ixpk= 0, nxpk= 0, iat= 434, 449, r1= 1.30, r2= 1.80, r3= 2.80, r4= 3.30,  &end
#
# 29 GLN HG2 30 VAL H 4.82 
 &rst
  ixpk= 0, nxpk= 0, iat= 439, 449, r1= 1.30, r2= 1.80, r3= 4.82, r4= 5.32,  &end
#
# 29 GLN HG3 30 VAL H 5.29 
 &rst
  ixpk= 0, nxpk= 0, iat= 440, 449, r1= 1.30, r2= 1.80, r3= 5.29, r4= 5.79,  &end
#
# 29 GLN H 29 GLN HB2 5.04 
 &rst
  ixpk= 0, nxpk= 0, iat= 432, 436, r1= 1.30, r2= 1.80, r3= 5.04, r4= 5.54,  &end
#
# 29 GLN H 29 GLN HG2 5.50 
 &rst
  ixpk= 0, nxpk= 0, iat= 432, 439, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
# 29 GLN H 30 VAL H 5.00 
 &rst
  ixpk= 0, nxpk= 0, iat= 432, 449, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50,  &end
#
# 30 VAL HB 31 ARG H 4.78 
 &rst
  ixpk= 0, nxpk= 0, iat= 453, 465, r1= 1.30, r2= 1.80, r3= 4.78, r4= 5.28,  &end
#
# 30 VAL H 31 ARG H 5.00 
 &rst
  ixpk= 0, nxpk= 0, iat= 449, 465, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50,  &end
#
# 30 VAL QG1 31 ARG H 3.70 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 465, r1= 1.30, r2= 1.80, r3= 4.44, r4= 4.94,
 igr1= 455, 456, 457,
 &end
#
# 30 VAL QG1 32 ILE H 6.00 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 489, r1= 1.30, r2= 1.80, r3= 7.21, r4= 7.71,
 igr1= 455, 456, 457,
 &end
#
# 30 VAL QG2 31 ARG H 4.50 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 465, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr1= 459, 460, 461,
 &end
#
# 31 ARG HA 32 ILE H 3.00 
 &rst
  ixpk= 0, nxpk= 0, iat= 467, 489, r1= 1.30, r2= 1.80, r3= 3.00, r4= 3.50,  &end
#
# 31 ARG HB3 32 ILE H 5.09 
 &rst
  ixpk= 0, nxpk= 0, iat= 470, 489, r1= 1.30, r2= 1.80, r3= 5.09, r4= 5.59,  &end
#
# 31 ARG HD2 32 ILE H 5.45 
 &rst
  ixpk= 0, nxpk= 0, iat= 475, 489, r1= 1.30, r2= 1.80, r3= 5.45, r4= 5.95,  &end
#
# 31 ARG HE 31 ARG HD2 5.36 
 &rst
  ixpk= 0, nxpk= 0, iat= 478, 475, r1= 1.30, r2= 1.80, r3= 5.36, r4= 5.86,  &end
#
# 31 ARG H 32 ILE HG12 4.94 
 &rst
  ixpk= 0, nxpk= 0, iat= 465, 499, r1= 1.30, r2= 1.80, r3= 4.94, r4= 5.44,  &end
#
# 31 ARG H 32 ILE H 5.00 
 &rst
  ixpk= 0, nxpk= 0, iat= 465, 489, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50,  &end
#
# 32 ILE HA 32 ILE QG2 3.00 
 &rst
  ixpk= 0, nxpk= 0, iat= 491,  -1, r1= 1.30, r2= 1.80, r3= 3.60, r4= 4.10,
 igr2= 495, 496, 497,
 &end
#
# 32 ILE HG12 33 GLY H 5.20 
 &rst
  ixpk= 0, nxpk= 0, iat= 499, 508, r1= 1.30, r2= 1.80, r3= 5.20, r4= 5.70,  &end
#
# 32 ILE H 33 GLY H 4.93 
 &rst
  ixpk= 0, nxpk= 0, iat= 489, 508, r1= 1.30, r2= 1.80, r3= 4.93, r4= 5.43,  &end
#
# 32 ILE QG2 33 GLY H 4.05 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 508, r1= 1.30, r2= 1.80, r3= 4.86, r4= 5.36,
 igr1= 495, 496, 497,
 &end
#
# 33 GLY HA2 34 ILE H 4.00 
 &rst
  ixpk= 0, nxpk= 0, iat= 510, 515, r1= 1.30, r2= 1.80, r3= 4.00, r4= 4.50,  &end
#
# 33 GLY HA2 34 ILE QD1 5.04 
 &rst
  ixpk= 0, nxpk= 0, iat= 510,  -1, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55,
 igr2= 528, 529, 530,
 &end
#
# 33 GLY HA3 34 ILE HG12 5.50 
 &rst
  ixpk= 0, nxpk= 0, iat= 511, 525, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
# 33 GLY HA3 34 ILE HG13 5.36 
 &rst
  ixpk= 0, nxpk= 0, iat= 511, 526, r1= 1.30, r2= 1.80, r3= 5.36, r4= 5.86,  &end
#
# 33 GLY HA3 34 ILE H 5.09 
 &rst
  ixpk= 0, nxpk= 0, iat= 511, 515, r1= 1.30, r2= 1.80, r3= 5.09, r4= 5.59,  &end
#
# 34 ILE HA 35 ASN HA 4.86 
 &rst
  ixpk= 0, nxpk= 0, iat= 517, 536, r1= 1.30, r2= 1.80, r3= 4.86, r4= 5.36,  &end
#
# 34 ILE HA 35 ASN HB2 4.56 
 &rst
  ixpk= 0, nxpk= 0, iat= 517, 538, r1= 1.30, r2= 1.80, r3= 4.56, r4= 5.06,  &end
#
# 34 ILE HA 35 ASN HB3 4.42 
 &rst
  ixpk= 0, nxpk= 0, iat= 517, 539, r1= 1.30, r2= 1.80, r3= 4.42, r4= 4.92,  &end
#
# 34 ILE HA 35 ASN H 3.50 
 &rst
  ixpk= 0, nxpk= 0, iat= 517, 534, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
# 34 ILE HB 34 ILE H 5.15 
 &rst
  ixpk= 0, nxpk= 0, iat= 519, 515, r1= 1.30, r2= 1.80, r3= 5.15, r4= 5.65,  &end
#
# 34 ILE HB 35 ASN H 5.29 
 &rst
  ixpk= 0, nxpk= 0, iat= 519, 534, r1= 1.30, r2= 1.80, r3= 5.29, r4= 5.79,  &end
#
# 34 ILE HB 36 ALA H 5.15 
 &rst
  ixpk= 0, nxpk= 0, iat= 519, 548, r1= 1.30, r2= 1.80, r3= 5.15, r4= 5.65,  &end
#
# 34 ILE HB 42 VAL QG2 5.00 
 &rst
  ixpk= 0, nxpk= 0, iat= 519,  -1, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,
 igr2= 642, 643, 644,
 &end
#
# 34 ILE HG12 35 ASN H 4.90 
 &rst
  ixpk= 0, nxpk= 0, iat= 525, 534, r1= 1.30, r2= 1.80, r3= 4.90, r4= 5.40,  &end
#
# 34 ILE HG13 35 ASN H 4.90 
 &rst
  ixpk= 0, nxpk= 0, iat= 526, 534, r1= 1.30, r2= 1.80, r3= 4.90, r4= 5.40,  &end
#
# 34 ILE H 36 ALA H 5.93 
 &rst
  ixpk= 0, nxpk= 0, iat= 515, 548, r1= 1.30, r2= 1.80, r3= 5.93, r4= 6.43,  &end
#
# 34 ILE QD1 35 ASN H 6.00 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 534, r1= 1.30, r2= 1.80, r3= 7.21, r4= 7.71,
 igr1= 528, 529, 530,
 &end
#
# 34 ILE QD1 42 VAL HA 4.47 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 634, r1= 1.30, r2= 1.80, r3= 5.37, r4= 5.87,
 igr1= 528, 529, 530,
 &end
#
# 34 ILE QG2 35 ASN HA 4.23 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 536, r1= 1.30, r2= 1.80, r3= 5.08, r4= 5.58,
 igr1= 521, 522, 523,
 &end
#
# 34 ILE QG2 35 ASN HB2 5.50 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 538, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr1= 521, 522, 523,
 &end
#
# 34 ILE QG2 35 ASN HB3 5.50 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 539, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr1= 521, 522, 523,
 &end
#
# 34 ILE QG2 35 ASN H 3.93 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 534, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,
 igr1= 521, 522, 523,
 &end
#
# 35 ASN HA 36 ALA H 2.80 
 &rst
  ixpk= 0, nxpk= 0, iat= 536, 548, r1= 1.30, r2= 1.80, r3= 2.80, r4= 3.30,  &end
#
# 35 ASN HA 36 ALA QB 4.44 
 &rst
  ixpk= 0, nxpk= 0, iat= 536,  -1, r1= 1.30, r2= 1.80, r3= 5.33, r4= 5.83,
 igr2= 552, 553, 554,
 &end
#
# 35 ASN HB2 35 ASN HD22 4.74 
 &rst
  ixpk= 0, nxpk= 0, iat= 538, 543, r1= 1.30, r2= 1.80, r3= 4.74, r4= 5.24,  &end
#
# 35 ASN HB2 36 ALA H 4.50 
 &rst
  ixpk= 0, nxpk= 0, iat= 538, 548, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
# 35 ASN HB3 35 ASN HD22 4.82 
 &rst
  ixpk= 0, nxpk= 0, iat= 539, 543, r1= 1.30, r2= 1.80, r3= 4.82, r4= 5.32,  &end
#
# 35 ASN HB3 36 ALA H 4.50 
 &rst
  ixpk= 0, nxpk= 0, iat= 539, 548, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
# 35 ASN H 36 ALA H 4.68 
 &rst
  ixpk= 0, nxpk= 0, iat= 534, 548, r1= 1.30, r2= 1.80, r3= 4.68, r4= 5.18,  &end
#
# 35 ASN H 36 ALA QB 4.27 
 &rst
  ixpk= 0, nxpk= 0, iat= 534,  -1, r1= 1.30, r2= 1.80, r3= 5.13, r4= 5.63,
 igr2= 552, 553, 554,
 &end
#
# 35 ASN H 42 VAL QG1 4.90 
 &rst
  ixpk= 0, nxpk= 0, iat= 534,  -1, r1= 1.30, r2= 1.80, r3= 5.88, r4= 6.38,
 igr2= 638, 639, 640,
 &end
#
# 36 ALA HA 36 ALA QB 3.52 
 &rst
  ixpk= 0, nxpk= 0, iat= 550,  -1, r1= 1.30, r2= 1.80, r3= 4.23, r4= 4.73,
 igr2= 552, 553, 554,
 &end
#
# 36 ALA HA 37 PRO HB2 5.60 
 &rst
  ixpk= 0, nxpk= 0, iat= 550, 565, r1= 1.30, r2= 1.80, r3= 5.60, r4= 6.10,  &end
#
# 36 ALA HA 37 PRO HD2 4.00 
 &rst
  ixpk= 0, nxpk= 0, iat= 550, 559, r1= 1.30, r2= 1.80, r3= 4.00, r4= 4.50,  &end
#
# 36 ALA HA 37 PRO HD3 4.00 
 &rst
  ixpk= 0, nxpk= 0, iat= 550, 560, r1= 1.30, r2= 1.80, r3= 4.00, r4= 4.50,  &end
#
# 36 ALA HA 37 PRO HG2 4.86 
 &rst
  ixpk= 0, nxpk= 0, iat= 550, 562, r1= 1.30, r2= 1.80, r3= 4.86, r4= 5.36,  &end
#
# 36 ALA HA 37 PRO HG3 5.04 
 &rst
  ixpk= 0, nxpk= 0, iat= 550, 563, r1= 1.30, r2= 1.80, r3= 5.04, r4= 5.54,  &end
#
# 36 ALA HA 40 VAL QG1 5.50 
 &rst
  ixpk= 0, nxpk= 0, iat= 550,  -1, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr2= 612, 613, 614,
 &end
#
# 36 ALA H 37 PRO HA 5.50 
 &rst
  ixpk= 0, nxpk= 0, iat= 548, 568, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
# 36 ALA H 37 PRO HD2 5.00 
 &rst
  ixpk= 0, nxpk= 0, iat= 548, 559, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50,  &end
#
# 36 ALA H 37 PRO HD3 5.15 
 &rst
  ixpk= 0, nxpk= 0, iat= 548, 560, r1= 1.30, r2= 1.80, r3= 5.15, r4= 5.65,  &end
#
# 36 ALA QB 37 PRO HA 4.38 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 568, r1= 1.30, r2= 1.80, r3= 5.26, r4= 5.76,
 igr1= 552, 553, 554,
 &end
#
# 36 ALA QB 37 PRO HB2 4.86 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 565, r1= 1.30, r2= 1.80, r3= 5.84, r4= 6.34,
 igr1= 552, 553, 554,
 &end
#
# 36 ALA QB 37 PRO HD2 3.85 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 559, r1= 1.30, r2= 1.80, r3= 4.62, r4= 5.12,
 igr1= 552, 553, 554,
 &end
#
# 36 ALA QB 37 PRO HD3 3.96 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 560, r1= 1.30, r2= 1.80, r3= 4.76, r4= 5.26,
 igr1= 552, 553, 554,
 &end
#
# 36 ALA QB 37 PRO HG2 4.71 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 562, r1= 1.30, r2= 1.80, r3= 5.66, r4= 6.16,
 igr1= 552, 553, 554,
 &end
#
# 36 ALA QB 37 PRO HG3 4.62 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 563, r1= 1.30, r2= 1.80, r3= 5.55, r4= 6.05,
 igr1= 552, 553, 554,
 &end
#
# 36 ALA QB 38 LYS HA 5.22 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 574, r1= 1.30, r2= 1.80, r3= 6.27, r4= 6.77,
 igr1= 552, 553, 554,
 &end
#
# 36 ALA QB 39 ASP H 5.78 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 594, r1= 1.30, r2= 1.80, r3= 6.94, r4= 7.44,
 igr1= 552, 553, 554,
 &end
#
# 36 ALA QB 40 VAL HB 4.17 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 610, r1= 1.30, r2= 1.80, r3= 5.01, r4= 5.51,
 igr1= 552, 553, 554,
 &end
#
# 36 ALA QB 40 VAL H 4.86 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 606, r1= 1.30, r2= 1.80, r3= 5.84, r4= 6.34,
 igr1= 552, 553, 554,
 &end
#
# 36 ALA QB 40 VAL QG2 3.43 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.95, r4= 5.45,
 igr1= 552, 553, 554,
 igr2= 616, 617, 618,
 &end
#
# 36 ALA QB 42 VAL QG2 4.50 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.49, r4= 6.99,
 igr1= 552, 553, 554,
 igr2= 642, 643, 644,
 &end
#
# 37 PRO HA 38 LYS HD2 6.00 
 &rst
  ixpk= 0, nxpk= 0, iat= 568, 582, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,  &end
#
# 37 PRO HA 38 LYS HD3 5.60 
 &rst
  ixpk= 0, nxpk= 0, iat= 568, 583, r1= 1.30, r2= 1.80, r3= 5.60, r4= 6.10,  &end
#
# 37 PRO HA 38 LYS H 3.50 
 &rst
  ixpk= 0, nxpk= 0, iat= 568, 572, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
# 37 PRO HB2 38 LYS H 5.45 
 &rst
  ixpk= 0, nxpk= 0, iat= 565, 572, r1= 1.30, r2= 1.80, r3= 5.45, r4= 5.95,  &end
#
# 37 PRO HB2 40 VAL QG1 4.11 
 &rst
  ixpk= 0, nxpk= 0, iat= 565,  -1, r1= 1.30, r2= 1.80, r3= 4.94, r4= 5.44,
 igr2= 612, 613, 614,
 &end
#
# 37 PRO HD2 40 VAL H 5.00 
 &rst
  ixpk= 0, nxpk= 0, iat= 559, 606, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50,  &end
#
# 37 PRO HD2 40 VAL QG1 5.00 
 &rst
  ixpk= 0, nxpk= 0, iat= 559,  -1, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,
 igr2= 612, 613, 614,
 &end
#
# 37 PRO HD2 40 VAL QG2 6.00 
 &rst
  ixpk= 0, nxpk= 0, iat= 559,  -1, r1= 1.30, r2= 1.80, r3= 7.21, r4= 7.71,
 igr2= 616, 617, 618,
 &end
#
# 37 PRO HD3 39 ASP HB2 5.50 
 &rst
  ixpk= 0, nxpk= 0, iat= 560, 598, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
# 37 PRO HD3 39 ASP H 5.36 
 &rst
  ixpk= 0, nxpk= 0, iat= 560, 594, r1= 1.30, r2= 1.80, r3= 5.36, r4= 5.86,  &end
#
# 37 PRO HD3 40 VAL QG1 5.00 
 &rst
  ixpk= 0, nxpk= 0, iat= 560,  -1, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,
 igr2= 612, 613, 614,
 &end
#
# 37 PRO HG2 39 ASP H 5.22 
 &rst
  ixpk= 0, nxpk= 0, iat= 562, 594, r1= 1.30, r2= 1.80, r3= 5.22, r4= 5.72,  &end
#
# 37 PRO HG2 40 VAL QG1 4.20 
 &rst
  ixpk= 0, nxpk= 0, iat= 562,  -1, r1= 1.30, r2= 1.80, r3= 5.04, r4= 5.54,
 igr2= 612, 613, 614,
 &end
#
# 37 PRO HG2 40 VAL QG2 4.44 
 &rst
  ixpk= 0, nxpk= 0, iat= 562,  -1, r1= 1.30, r2= 1.80, r3= 5.33, r4= 5.83,
 igr2= 616, 617, 618,
 &end
#
# 37 PRO HG3 39 ASP HB2 4.90 
 &rst
  ixpk= 0, nxpk= 0, iat= 563, 598, r1= 1.30, r2= 1.80, r3= 4.90, r4= 5.40,  &end
#
# 37 PRO HG3 39 ASP HB3 4.49 
 &rst
  ixpk= 0, nxpk= 0, iat= 563, 599, r1= 1.30, r2= 1.80, r3= 4.49, r4= 4.99,  &end
#
# 37 PRO HG3 40 VAL QG1 4.50 
 &rst
  ixpk= 0, nxpk= 0, iat= 563,  -1, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr2= 612, 613, 614,
 &end
#
# 37 PRO HG3 40 VAL QG2 5.50 
 &rst
  ixpk= 0, nxpk= 0, iat= 563,  -1, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr2= 616, 617, 618,
 &end
#
# 38 LYS HA 39 ASP HB2 5.36 
 &rst
  ixpk= 0, nxpk= 0, iat= 574, 598, r1= 1.30, r2= 1.80, r3= 5.36, r4= 5.86,  &end
#
# 38 LYS HA 39 ASP H 4.00 
 &rst
  ixpk= 0, nxpk= 0, iat= 574, 594, r1= 1.30, r2= 1.80, r3= 4.00, r4= 4.50,  &end
#
# 38 LYS HA 40 VAL QG2 5.22 
 &rst
  ixpk= 0, nxpk= 0, iat= 574,  -1, r1= 1.30, r2= 1.80, r3= 6.27, r4= 6.77,
 igr2= 616, 617, 618,
 &end
#
# 38 LYS HB2 39 ASP HB2 6.00 
 &rst
  ixpk= 0, nxpk= 0, iat= 576, 598, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,  &end
#
# 38 LYS HD2 39 ASP H 6.00 
 &rst
  ixpk= 0, nxpk= 0, iat= 582, 594, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,  &end
#
# 38 LYS HD3 39 ASP H 6.00 
 &rst
  ixpk= 0, nxpk= 0, iat= 583, 594, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,  &end
#
# 38 LYS HG2 39 ASP H 5.20 
 &rst
  ixpk= 0, nxpk= 0, iat= 579, 594, r1= 1.30, r2= 1.80, r3= 5.20, r4= 5.70,  &end
#
# 38 LYS H 39 ASP H 5.00 
 &rst
  ixpk= 0, nxpk= 0, iat= 572, 594, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50,  &end
#
# 38 LYS H 38 LYS HD3 5.15 
 &rst
  ixpk= 0, nxpk= 0, iat= 572, 583, r1= 1.30, r2= 1.80, r3= 5.15, r4= 5.65,  &end
#
# 39 ASP HA 40 VAL H 3.50 
 &rst
  ixpk= 0, nxpk= 0, iat= 596, 606, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
# 39 ASP HB2 40 VAL H 4.50 
 &rst
  ixpk= 0, nxpk= 0, iat= 598, 606, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
# 39 ASP HB2 40 VAL QG1 4.00 
 &rst
  ixpk= 0, nxpk= 0, iat= 598,  -1, r1= 1.30, r2= 1.80, r3= 4.80, r4= 5.30,
 igr2= 612, 613, 614,
 &end
#
# 39 ASP HB2 40 VAL QG2 5.00 
 &rst
  ixpk= 0, nxpk= 0, iat= 598,  -1, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,
 igr2= 616, 617, 618,
 &end
#
# 39 ASP HB3 40 VAL H 5.00 
 &rst
  ixpk= 0, nxpk= 0, iat= 599, 606, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50,  &end
#
# 39 ASP HB3 40 VAL QG1 3.80 
 &rst
  ixpk= 0, nxpk= 0, iat= 599,  -1, r1= 1.30, r2= 1.80, r3= 4.56, r4= 5.06,
 igr2= 612, 613, 614,
 &end
#
# 39 ASP HB3 40 VAL QG2 4.70 
 &rst
  ixpk= 0, nxpk= 0, iat= 599,  -1, r1= 1.30, r2= 1.80, r3= 5.64, r4= 6.14,
 igr2= 616, 617, 618,
 &end
#
# 39 ASP H 40 VAL HA 5.70 
 &rst
  ixpk= 0, nxpk= 0, iat= 594, 608, r1= 1.30, r2= 1.80, r3= 5.70, r4= 6.20,  &end
#
# 39 ASP H 40 VAL H 3.50 
 &rst
  ixpk= 0, nxpk= 0, iat= 594, 606, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
# 39 ASP H 40 VAL QG1 4.00 
 &rst
  ixpk= 0, nxpk= 0, iat= 594,  -1, r1= 1.30, r2= 1.80, r3= 4.80, r4= 5.30,
 igr2= 612, 613, 614,
 &end
#
# 39 ASP H 40 VAL QG2 5.00 
 &rst
  ixpk= 0, nxpk= 0, iat= 594,  -1, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,
 igr2= 616, 617, 618,
 &end
#
# 39 ASP H 40 VAL QG2 4.78 
 &rst
  ixpk= 0, nxpk= 0, iat= 594,  -1, r1= 1.30, r2= 1.80, r3= 5.74, r4= 6.24,
 igr2= 616, 617, 618,
 &end
#
# 40 VAL HA 41 ALA HA 5.50 
 &rst
  ixpk= 0, nxpk= 0, iat= 608, 624, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
# 40 VAL HA 41 ALA H 2.80 
 &rst
  ixpk= 0, nxpk= 0, iat= 608, 622, r1= 1.30, r2= 1.80, r3= 2.80, r4= 3.30,  &end
#
# 40 VAL HA 41 ALA QB 4.05 
 &rst
  ixpk= 0, nxpk= 0, iat= 608,  -1, r1= 1.30, r2= 1.80, r3= 4.86, r4= 5.36,
 igr2= 626, 627, 628,
 &end
#
# 40 VAL HB 41 ALA H 5.00 
 &rst
  ixpk= 0, nxpk= 0, iat= 610, 622, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50,  &end
#
# 40 VAL HB 42 VAL QG1 5.50 
 &rst
  ixpk= 0, nxpk= 0, iat= 610,  -1, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr2= 638, 639, 640,
 &end
#
# 40 VAL H 41 ALA H 5.00 
 &rst
  ixpk= 0, nxpk= 0, iat= 606, 622, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50,  &end
#
# 40 VAL QG1 41 ALA H 4.31 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 622, r1= 1.30, r2= 1.80, r3= 5.18, r4= 5.68,
 igr1= 612, 613, 614,
 &end
#
# 40 VAL QG2 41 ALA HA 3.85 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 624, r1= 1.30, r2= 1.80, r3= 4.62, r4= 5.12,
 igr1= 616, 617, 618,
 &end
#
# 40 VAL QG2 41 ALA H 4.18 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 622, r1= 1.30, r2= 1.80, r3= 5.02, r4= 5.52,
 igr1= 616, 617, 618,
 &end
#
# 40 VAL QG2 41 ALA QB 5.00 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.21, r4= 7.71,
 igr1= 616, 617, 618,
 igr2= 626, 627, 628,
 &end
#
# 41 ALA HA 41 ALA QB 3.32 
 &rst
  ixpk= 0, nxpk= 0, iat= 624,  -1, r1= 1.30, r2= 1.80, r3= 3.99, r4= 4.49,
 igr2= 626, 627, 628,
 &end
#
# 41 ALA HA 42 VAL H 3.00 
 &rst
  ixpk= 0, nxpk= 0, iat= 624, 632, r1= 1.30, r2= 1.80, r3= 3.00, r4= 3.50,  &end
#
# 41 ALA HA 42 VAL QG1 5.00 
 &rst
  ixpk= 0, nxpk= 0, iat= 624,  -1, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,
 igr2= 638, 639, 640,
 &end
#
# 41 ALA H 42 VAL H 5.00 
 &rst
  ixpk= 0, nxpk= 0, iat= 622, 632, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50,  &end
#
# 41 ALA QB 42 VAL H 3.73 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 632, r1= 1.30, r2= 1.80, r3= 4.48, r4= 4.98,
 igr1= 626, 627, 628,
 &end
#
# 41 ALA QB 43 HIS HD2 4.15 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 661, r1= 1.30, r2= 1.80, r3= 4.98, r4= 5.48,
 igr1= 626, 627, 628,
 &end
#
# 41 ALA QB 43 HIS HE1 3.85 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 657, r1= 1.30, r2= 1.80, r3= 4.62, r4= 5.12,
 igr1= 626, 627, 628,
 &end
#
# 41 ALA QB 43 HIS H 4.90 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 648, r1= 1.30, r2= 1.80, r3= 5.88, r4= 6.38,
 igr1= 626, 627, 628,
 &end
#
# 41 ALA QB 48 TYR QD 5.00 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.74, r4= 7.24,
 igr1= 626, 627, 628,
 igr2= 746, 755,
 &end
#
# 41 ALA QB 48 TYR QE 4.51 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.08, r4= 6.58,
 igr1= 626, 627, 628,
 igr2= 748, 753,
 &end
#
# 42 VAL HA 43 HIS HB2 5.78 
 &rst
  ixpk= 0, nxpk= 0, iat= 634, 652, r1= 1.30, r2= 1.80, r3= 5.78, r4= 6.28,  &end
#
# 42 VAL HA 43 HIS H 3.50 
 &rst
  ixpk= 0, nxpk= 0, iat= 634, 648, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
# 42 VAL HB 43 HIS H 5.78 
 &rst
  ixpk= 0, nxpk= 0, iat= 636, 648, r1= 1.30, r2= 1.80, r3= 5.78, r4= 6.28,  &end
#
# 42 VAL H 43 HIS HD2 5.01 
 &rst
  ixpk= 0, nxpk= 0, iat= 632, 661, r1= 1.30, r2= 1.80, r3= 5.01, r4= 5.51,  &end
#
# 42 VAL H 43 HIS H 5.66 
 &rst
  ixpk= 0, nxpk= 0, iat= 632, 648, r1= 1.30, r2= 1.80, r3= 5.66, r4= 6.16,  &end
#
# 42 VAL QG1 43 HIS H 5.00 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 648, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,
 igr1= 638, 639, 640,
 &end
#
# 42 VAL QG2 43 HIS HA 4.30 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 650, r1= 1.30, r2= 1.80, r3= 5.16, r4= 5.66,
 igr1= 642, 643, 644,
 &end
#
# 42 VAL QG2 43 HIS H 4.36 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 648, r1= 1.30, r2= 1.80, r3= 5.24, r4= 5.74,
 igr1= 642, 643, 644,
 &end
#
# 43 HIS HB2 47 ILE HB 5.45 
 &rst
  ixpk= 0, nxpk= 0, iat= 652, 723, r1= 1.30, r2= 1.80, r3= 5.45, r4= 5.95,  &end
#
# 43 HIS HB2 47 ILE HG13 5.66 
 &rst
  ixpk= 0, nxpk= 0, iat= 652, 730, r1= 1.30, r2= 1.80, r3= 5.66, r4= 6.16,  &end
#
# 43 HIS HB2 47 ILE H 5.78 
 &rst
  ixpk= 0, nxpk= 0, iat= 652, 719, r1= 1.30, r2= 1.80, r3= 5.78, r4= 6.28,  &end
#
# 43 HIS HB2 47 ILE QD1 4.74 
 &rst
  ixpk= 0, nxpk= 0, iat= 652,  -1, r1= 1.30, r2= 1.80, r3= 5.69, r4= 6.19,
 igr2= 732, 733, 734,
 &end
#
# 43 HIS HB2 47 ILE QD1 5.29 
 &rst
  ixpk= 0, nxpk= 0, iat= 652,  -1, r1= 1.30, r2= 1.80, r3= 6.35, r4= 6.85,
 igr2= 732, 733, 734,
 &end
#
# 43 HIS HB2 47 ILE QG2 5.00 
 &rst
  ixpk= 0, nxpk= 0, iat= 652,  -1, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,
 igr2= 725, 726, 727,
 &end
#
# 43 HIS HB2 48 TYR HA 5.55 
 &rst
  ixpk= 0, nxpk= 0, iat= 652, 740, r1= 1.30, r2= 1.80, r3= 5.55, r4= 6.05,  &end
#
# 43 HIS HB2 48 TYR HB3 5.55 
 &rst
  ixpk= 0, nxpk= 0, iat= 652, 743, r1= 1.30, r2= 1.80, r3= 5.55, r4= 6.05,  &end
#
# 43 HIS HB2 48 TYR H 5.78 
 &rst
  ixpk= 0, nxpk= 0, iat= 652, 738, r1= 1.30, r2= 1.80, r3= 5.78, r4= 6.28,  &end
#
# 43 HIS HB2 48 TYR QD 5.29 
 &rst
  ixpk= 0, nxpk= 0, iat= 652,  -1, r1= 1.30, r2= 1.80, r3= 5.94, r4= 6.44,
 igr2= 746, 755,
 &end
#
# 43 HIS HB2 51 ILE QD1 5.55 
 &rst
  ixpk= 0, nxpk= 0, iat= 652,  -1, r1= 1.30, r2= 1.80, r3= 6.67, r4= 7.17,
 igr2= 813, 814, 815,
 &end
#
# 43 HIS HB3 51 ILE QD1 5.78 
 &rst
  ixpk= 0, nxpk= 0, iat= 653,  -1, r1= 1.30, r2= 1.80, r3= 6.94, r4= 7.44,
 igr2= 813, 814, 815,
 &end
#
# 43 HIS HD2 43 HIS HB3 4.37 
 &rst
  ixpk= 0, nxpk= 0, iat= 661, 653, r1= 1.30, r2= 1.80, r3= 4.37, r4= 4.87,  &end
#
# 43 HIS HD2 48 TYR HA 4.37 
 &rst
  ixpk= 0, nxpk= 0, iat= 661, 740, r1= 1.30, r2= 1.80, r3= 4.37, r4= 4.87,  &end
#
# 43 HIS HD2 51 ILE QD1 4.37 
 &rst
  ixpk= 0, nxpk= 0, iat= 661,  -1, r1= 1.30, r2= 1.80, r3= 5.25, r4= 5.75,
 igr2= 813, 814, 815,
 &end
#
# 43 HIS HD2 51 ILE QG2 4.51 
 &rst
  ixpk= 0, nxpk= 0, iat= 661,  -1, r1= 1.30, r2= 1.80, r3= 5.42, r4= 5.92,
 igr2= 806, 807, 808,
 &end
#
# 43 HIS HE1 51 ILE QD1 3.99 
 &rst
  ixpk= 0, nxpk= 0, iat= 657,  -1, r1= 1.30, r2= 1.80, r3= 4.79, r4= 5.29,
 igr2= 813, 814, 815,
 &end
#
# 43 HIS HE1 51 ILE QG2 5.50 
 &rst
  ixpk= 0, nxpk= 0, iat= 657,  -1, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr2= 806, 807, 808,
 &end
#
# 43 HIS H 44 ARG HA 5.55 
 &rst
  ixpk= 0, nxpk= 0, iat= 648, 667, r1= 1.30, r2= 1.80, r3= 5.55, r4= 6.05,  &end
#
# 44 ARG HA 45 GLU H 3.50 
 &rst
  ixpk= 0, nxpk= 0, iat= 667, 689, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
# 44 ARG HA 46 GLU H 5.78 
 &rst
  ixpk= 0, nxpk= 0, iat= 667, 704, r1= 1.30, r2= 1.80, r3= 5.78, r4= 6.28,  &end
#
# 45 GLU HA 48 TYR HA 5.55 
 &rst
  ixpk= 0, nxpk= 0, iat= 691, 740, r1= 1.30, r2= 1.80, r3= 5.55, r4= 6.05,  &end
#
# 45 GLU HA 48 TYR HB2 5.04 
 &rst
  ixpk= 0, nxpk= 0, iat= 691, 742, r1= 1.30, r2= 1.80, r3= 5.04, r4= 5.54,  &end
#
# 45 GLU HA 48 TYR HB3 4.99 
 &rst
  ixpk= 0, nxpk= 0, iat= 691, 743, r1= 1.30, r2= 1.80, r3= 4.99, r4= 5.49,  &end
#
# 45 GLU HA 48 TYR H 5.22 
 &rst
  ixpk= 0, nxpk= 0, iat= 691, 738, r1= 1.30, r2= 1.80, r3= 5.22, r4= 5.72,  &end
#
# 45 GLU HA 48 TYR QD 3.99 
 &rst
  ixpk= 0, nxpk= 0, iat= 691,  -1, r1= 1.30, r2= 1.80, r3= 4.48, r4= 4.98,
 igr2= 746, 755,
 &end
#
# 45 GLU HA 48 TYR QE 5.50 
 &rst
  ixpk= 0, nxpk= 0, iat= 691,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2= 748, 753,
 &end
#
# 45 GLU HG2 46 GLU H 4.78 
 &rst
  ixpk= 0, nxpk= 0, iat= 696, 704, r1= 1.30, r2= 1.80, r3= 4.78, r4= 5.28,  &end
#
# 45 GLU HG2 48 TYR HB2 5.09 
 &rst
  ixpk= 0, nxpk= 0, iat= 696, 742, r1= 1.30, r2= 1.80, r3= 5.09, r4= 5.59,  &end
#
# 45 GLU HG2 48 TYR H 6.00 
 &rst
  ixpk= 0, nxpk= 0, iat= 696, 738, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,  &end
#
# 45 GLU HG3 46 GLU H 5.50 
 &rst
  ixpk= 0, nxpk= 0, iat= 697, 704, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
# 45 GLU H 46 GLU H 5.00 
 &rst
  ixpk= 0, nxpk= 0, iat= 689, 704, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50,  &end
#
# 45 GLU H 48 TYR HB2 5.55 
 &rst
  ixpk= 0, nxpk= 0, iat= 689, 742, r1= 1.30, r2= 1.80, r3= 5.55, r4= 6.05,  &end
#
# 45 GLU QB 46 GLU H 5.50 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 704, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 693, 694,
 &end
#
# 45 GLU QB 48 TYR H 5.36 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 738, r1= 1.30, r2= 1.80, r3= 6.02, r4= 6.52,
 igr1= 693, 694,
 &end
#
# 46 GLU HA 47 ILE H 5.09 
 &rst
  ixpk= 0, nxpk= 0, iat= 706, 719, r1= 1.30, r2= 1.80, r3= 5.09, r4= 5.59,  &end
#
# 46 GLU HA 47 ILE QD1 4.99 
 &rst
  ixpk= 0, nxpk= 0, iat= 706,  -1, r1= 1.30, r2= 1.80, r3= 5.99, r4= 6.49,
 igr2= 732, 733, 734,
 &end
#
# 46 GLU HA 49 GLN HB2 5.00 
 &rst
  ixpk= 0, nxpk= 0, iat= 706, 763, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50,  &end
#
# 46 GLU HA 49 GLN HG2 5.50 
 &rst
  ixpk= 0, nxpk= 0, iat= 706, 766, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
# 46 GLU HA 49 GLN HG3 4.78 
 &rst
  ixpk= 0, nxpk= 0, iat= 706, 767, r1= 1.30, r2= 1.80, r3= 4.78, r4= 5.28,  &end
#
# 46 GLU HA 49 GLN H 5.09 
 &rst
  ixpk= 0, nxpk= 0, iat= 706, 759, r1= 1.30, r2= 1.80, r3= 5.09, r4= 5.59,  &end
#
# 46 GLU HB2 47 ILE H 5.00 
 &rst
  ixpk= 0, nxpk= 0, iat= 708, 719, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50,  &end
#
# 46 GLU HB2 47 ILE QD1 4.03 
 &rst
  ixpk= 0, nxpk= 0, iat= 708,  -1, r1= 1.30, r2= 1.80, r3= 4.84, r4= 5.34,
 igr2= 732, 733, 734,
 &end
#
# 46 GLU HB3 47 ILE H 5.50 
 &rst
  ixpk= 0, nxpk= 0, iat= 709, 719, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
# 46 GLU HB3 47 ILE QD1 5.00 
 &rst
  ixpk= 0, nxpk= 0, iat= 709,  -1, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,
 igr2= 732, 733, 734,
 &end
#
# 46 GLU HG2 47 ILE H 4.90 
 &rst
  ixpk= 0, nxpk= 0, iat= 711, 719, r1= 1.30, r2= 1.80, r3= 4.90, r4= 5.40,  &end
#
# 46 GLU HG2 47 ILE QD1 5.09 
 &rst
  ixpk= 0, nxpk= 0, iat= 711,  -1, r1= 1.30, r2= 1.80, r3= 6.11, r4= 6.61,
 igr2= 732, 733, 734,
 &end
#
# 46 GLU HG3 47 ILE QD1 4.65 
 &rst
  ixpk= 0, nxpk= 0, iat= 712,  -1, r1= 1.30, r2= 1.80, r3= 5.58, r4= 6.08,
 igr2= 732, 733, 734,
 &end
#
# 46 GLU H 47 ILE HB 5.00 
 &rst
  ixpk= 0, nxpk= 0, iat= 704, 723, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50,  &end
#
# 46 GLU H 47 ILE H 4.50 
 &rst
  ixpk= 0, nxpk= 0, iat= 704, 719, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
# 46 GLU H 47 ILE QD1 5.36 
 &rst
  ixpk= 0, nxpk= 0, iat= 704,  -1, r1= 1.30, r2= 1.80, r3= 6.44, r4= 6.94,
 igr2= 732, 733, 734,
 &end
#
# 46 GLU H 48 TYR H 5.50 
 &rst
  ixpk= 0, nxpk= 0, iat= 704, 738, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
# 47 ILE HA 48 TYR HB2 6.00 
 &rst
  ixpk= 0, nxpk= 0, iat= 721, 742, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,  &end
#
# 47 ILE HA 48 TYR H 5.66 
 &rst
  ixpk= 0, nxpk= 0, iat= 721, 738, r1= 1.30, r2= 1.80, r3= 5.66, r4= 6.16,  &end
#
# 47 ILE HA 50 ARG HB2 4.94 
 &rst
  ixpk= 0, nxpk= 0, iat= 721, 780, r1= 1.30, r2= 1.80, r3= 4.94, r4= 5.44,  &end
#
# 47 ILE HA 50 ARG HD2 5.55 
 &rst
  ixpk= 0, nxpk= 0, iat= 721, 786, r1= 1.30, r2= 1.80, r3= 5.55, r4= 6.05,  &end
#
# 47 ILE HA 50 ARG HD3 4.71 
 &rst
  ixpk= 0, nxpk= 0, iat= 721, 787, r1= 1.30, r2= 1.80, r3= 4.71, r4= 5.21,  &end
#
# 47 ILE HB 48 TYR HB2 5.36 
 &rst
  ixpk= 0, nxpk= 0, iat= 723, 742, r1= 1.30, r2= 1.80, r3= 5.36, r4= 5.86,  &end
#
# 47 ILE HB 48 TYR H 4.00 
 &rst
  ixpk= 0, nxpk= 0, iat= 723, 738, r1= 1.30, r2= 1.80, r3= 4.00, r4= 4.50,  &end
#
# 47 ILE HB 50 ARG H 6.00 
 &rst
  ixpk= 0, nxpk= 0, iat= 723, 776, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,  &end
#
# 47 ILE H 48 TYR HB2 5.36 
 &rst
  ixpk= 0, nxpk= 0, iat= 719, 742, r1= 1.30, r2= 1.80, r3= 5.36, r4= 5.86,  &end
#
# 47 ILE H 48 TYR HB3 5.45 
 &rst
  ixpk= 0, nxpk= 0, iat= 719, 743, r1= 1.30, r2= 1.80, r3= 5.45, r4= 5.95,  &end
#
# 47 ILE H 48 TYR H 3.50 
 &rst
  ixpk= 0, nxpk= 0, iat= 719, 738, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
# 47 ILE H 49 GLN H 6.12 
 &rst
  ixpk= 0, nxpk= 0, iat= 719, 759, r1= 1.30, r2= 1.80, r3= 6.12, r4= 6.62,  &end
#
# 47 ILE H 51 ILE QD1 5.66 
 &rst
  ixpk= 0, nxpk= 0, iat= 719,  -1, r1= 1.30, r2= 1.80, r3= 6.80, r4= 7.30,
 igr2= 813, 814, 815,
 &end
#
# 47 ILE QD1 48 TYR H 5.09 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 738, r1= 1.30, r2= 1.80, r3= 6.11, r4= 6.61,
 igr1= 732, 733, 734,
 &end
#
# 47 ILE QD1 49 GLN H 5.45 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 759, r1= 1.30, r2= 1.80, r3= 6.55, r4= 7.05,
 igr1= 732, 733, 734,
 &end
#
# 47 ILE QD1 50 ARG HD2 4.70 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 786, r1= 1.30, r2= 1.80, r3= 5.64, r4= 6.14,
 igr1= 732, 733, 734,
 &end
#
# 47 ILE QD1 50 ARG HD3 4.33 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 787, r1= 1.30, r2= 1.80, r3= 5.20, r4= 5.70,
 igr1= 732, 733, 734,
 &end
#
# 47 ILE QG2 50 ARG HB2 4.27 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 780, r1= 1.30, r2= 1.80, r3= 5.13, r4= 5.63,
 igr1= 725, 726, 727,
 &end
#
# 47 ILE QG2 50 ARG H 4.94 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 776, r1= 1.30, r2= 1.80, r3= 5.93, r4= 6.43,
 igr1= 725, 726, 727,
 &end
#
# 48 TYR HA 49 GLN H 5.36 
 &rst
  ixpk= 0, nxpk= 0, iat= 740, 759, r1= 1.30, r2= 1.80, r3= 5.36, r4= 5.86,  &end
#
# 48 TYR HA 50 ARG H 5.09 
 &rst
  ixpk= 0, nxpk= 0, iat= 740, 776, r1= 1.30, r2= 1.80, r3= 5.09, r4= 5.59,  &end
#
# 48 TYR HA 51 ILE HB 3.35 
 &rst
  ixpk= 0, nxpk= 0, iat= 740, 804, r1= 1.30, r2= 1.80, r3= 3.35, r4= 3.85,  &end
#
# 48 TYR HA 51 ILE HG12 5.04 
 &rst
  ixpk= 0, nxpk= 0, iat= 740, 810, r1= 1.30, r2= 1.80, r3= 5.04, r4= 5.54,  &end
#
# 48 TYR HA 51 ILE H 4.31 
 &rst
  ixpk= 0, nxpk= 0, iat= 740, 800, r1= 1.30, r2= 1.80, r3= 4.31, r4= 4.81,  &end
#
# 48 TYR HA 51 ILE QD1 4.54 
 &rst
  ixpk= 0, nxpk= 0, iat= 740,  -1, r1= 1.30, r2= 1.80, r3= 5.45, r4= 5.95,
 igr2= 813, 814, 815,
 &end
#
# 48 TYR HA 51 ILE QG2 5.50 
 &rst
  ixpk= 0, nxpk= 0, iat= 740,  -1, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr2= 806, 807, 808,
 &end
#
# 48 TYR HB2 49 GLN HG3 4.94 
 &rst
  ixpk= 0, nxpk= 0, iat= 742, 767, r1= 1.30, r2= 1.80, r3= 4.94, r4= 5.44,  &end
#
# 48 TYR HB2 49 GLN H 5.00 
 &rst
  ixpk= 0, nxpk= 0, iat= 742, 759, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50,  &end
#
# 48 TYR HB3 49 GLN H 5.29 
 &rst
  ixpk= 0, nxpk= 0, iat= 743, 759, r1= 1.30, r2= 1.80, r3= 5.29, r4= 5.79,  &end
#
# 48 TYR HB3 51 ILE QD1 5.55 
 &rst
  ixpk= 0, nxpk= 0, iat= 743,  -1, r1= 1.30, r2= 1.80, r3= 6.67, r4= 7.17,
 igr2= 813, 814, 815,
 &end
#
# 48 TYR HB3 52 GLN HG2 6.00 
 &rst
  ixpk= 0, nxpk= 0, iat= 743, 826, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,  &end
#
# 48 TYR H 48 TYR HA 5.09 
 &rst
  ixpk= 0, nxpk= 0, iat= 738, 740, r1= 1.30, r2= 1.80, r3= 5.09, r4= 5.59,  &end
#
# 48 TYR H 49 GLN HG3 5.15 
 &rst
  ixpk= 0, nxpk= 0, iat= 738, 767, r1= 1.30, r2= 1.80, r3= 5.15, r4= 5.65,  &end
#
# 48 TYR H 49 GLN H 4.00 
 &rst
  ixpk= 0, nxpk= 0, iat= 738, 759, r1= 1.30, r2= 1.80, r3= 4.00, r4= 4.50,  &end
#
# 48 TYR H 50 ARG H 5.55 
 &rst
  ixpk= 0, nxpk= 0, iat= 738, 776, r1= 1.30, r2= 1.80, r3= 5.55, r4= 6.05,  &end
#
# 48 TYR H 51 ILE HB 5.93 
 &rst
  ixpk= 0, nxpk= 0, iat= 738, 804, r1= 1.30, r2= 1.80, r3= 5.93, r4= 6.43,  &end
#
# 48 TYR H 51 ILE QD1 5.78 
 &rst
  ixpk= 0, nxpk= 0, iat= 738,  -1, r1= 1.30, r2= 1.80, r3= 6.94, r4= 7.44,
 igr2= 813, 814, 815,
 &end
#
# 48 TYR QD 49 GLN HA 4.12 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 761, r1= 1.30, r2= 1.80, r3= 4.62, r4= 5.12,
 igr1= 746, 755,
 &end
#
# 48 TYR QD 49 GLN HG2 4.59 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 766, r1= 1.30, r2= 1.80, r3= 5.15, r4= 5.65,
 igr1= 746, 755,
 &end
#
# 48 TYR QD 49 GLN HG3 4.12 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 767, r1= 1.30, r2= 1.80, r3= 4.62, r4= 5.12,
 igr1= 746, 755,
 &end
#
# 48 TYR QD 51 ILE HB 4.85 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 804, r1= 1.30, r2= 1.80, r3= 5.44, r4= 5.94,
 igr1= 746, 755,
 &end
#
# 48 TYR QD 51 ILE QD1 4.46 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.01, r4= 6.51,
 igr1= 746, 755,
 igr2= 813, 814, 815,
 &end
#
# 48 TYR QD 51 ILE QG2 4.29 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.78, r4= 6.28,
 igr1= 746, 755,
 igr2= 806, 807, 808,
 &end
#
# 48 TYR QD 52 GLN HB3 5.70 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 824, r1= 1.30, r2= 1.80, r3= 6.40, r4= 6.90,
 igr1= 746, 755,
 &end
#
# 48 TYR QD 52 GLN HE22 5.15 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 831, r1= 1.30, r2= 1.80, r3= 5.78, r4= 6.28,
 igr1= 746, 755,
 &end
#
# 48 TYR QD 52 GLN HG2 4.86 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 826, r1= 1.30, r2= 1.80, r3= 5.46, r4= 5.96,
 igr1= 746, 755,
 &end
#
# 48 TYR QE 48 TYR HA 5.09 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 740, r1= 1.30, r2= 1.80, r3= 5.71, r4= 6.21,
 igr1= 748, 753,
 &end
#
# 48 TYR QE 49 GLN HA 4.50 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 761, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 748, 753,
 &end
#
# 48 TYR QE 49 GLN HG3 5.00 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 767, r1= 1.30, r2= 1.80, r3= 5.61, r4= 6.11,
 igr1= 748, 753,
 &end
#
# 48 TYR QE 51 ILE HB 4.85 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 804, r1= 1.30, r2= 1.80, r3= 5.44, r4= 5.94,
 igr1= 748, 753,
 &end
#
# 48 TYR QE 51 ILE QD1 5.50 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1= 748, 753,
 igr2= 813, 814, 815,
 &end
#
# 48 TYR QE 51 ILE QG2 4.37 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.89, r4= 6.39,
 igr1= 748, 753,
 igr2= 806, 807, 808,
 &end
#
# 48 TYR QE 52 GLN HB2 5.04 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 823, r1= 1.30, r2= 1.80, r3= 5.66, r4= 6.16,
 igr1= 748, 753,
 &end
#
# 48 TYR QE 52 GLN HB3 4.41 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 824, r1= 1.30, r2= 1.80, r3= 4.95, r4= 5.45,
 igr1= 748, 753,
 &end
#
# 48 TYR QE 52 GLN HG2 4.00 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 826, r1= 1.30, r2= 1.80, r3= 4.49, r4= 4.99,
 igr1= 748, 753,
 &end
#
# 49 GLN HA 50 ARG H 4.59 
 &rst
  ixpk= 0, nxpk= 0, iat= 761, 776, r1= 1.30, r2= 1.80, r3= 4.59, r4= 5.09,  &end
#
# 49 GLN HA 53 ALA QB 4.86 
 &rst
  ixpk= 0, nxpk= 0, iat= 761,  -1, r1= 1.30, r2= 1.80, r3= 5.84, r4= 6.34,
 igr2= 840, 841, 842,
 &end
#
# 49 GLN HB2 50 ARG H 4.65 
 &rst
  ixpk= 0, nxpk= 0, iat= 763, 776, r1= 1.30, r2= 1.80, r3= 4.65, r4= 5.15,  &end
#
# 49 GLN HB2 51 ILE H 6.00 
 &rst
  ixpk= 0, nxpk= 0, iat= 763, 800, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,  &end
#
# 49 GLN H 50 ARG HA 5.45 
 &rst
  ixpk= 0, nxpk= 0, iat= 759, 778, r1= 1.30, r2= 1.80, r3= 5.45, r4= 5.95,  &end
#
# 49 GLN H 50 ARG HB2 5.29 
 &rst
  ixpk= 0, nxpk= 0, iat= 759, 780, r1= 1.30, r2= 1.80, r3= 5.29, r4= 5.79,  &end
#
# 49 GLN H 50 ARG H 3.50 
 &rst
  ixpk= 0, nxpk= 0, iat= 759, 776, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
# 49 GLN H 51 ILE H 6.66 
 &rst
  ixpk= 0, nxpk= 0, iat= 759, 800, r1= 1.30, r2= 1.80, r3= 6.66, r4= 7.16,  &end
#
# 49 GLN H 51 ILE QD1 5.93 
 &rst
  ixpk= 0, nxpk= 0, iat= 759,  -1, r1= 1.30, r2= 1.80, r3= 7.12, r4= 7.62,
 igr2= 813, 814, 815,
 &end
#
# 50 ARG HA 51 ILE H 4.68 
 &rst
  ixpk= 0, nxpk= 0, iat= 778, 800, r1= 1.30, r2= 1.80, r3= 4.68, r4= 5.18,  &end
#
# 50 ARG HA 53 ALA QB 4.00 
 &rst
  ixpk= 0, nxpk= 0, iat= 778,  -1, r1= 1.30, r2= 1.80, r3= 4.80, r4= 5.30,
 igr2= 840, 841, 842,
 &end
#
# 50 ARG HA 55 LEU QD1 5.00 
 &rst
  ixpk= 0, nxpk= 0, iat= 778,  -1, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,
 igr2= 862, 863, 864,
 &end
#
# 50 ARG HB2 51 ILE HG12 5.00 
 &rst
  ixpk= 0, nxpk= 0, iat= 780, 810, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50,  &end
#
# 50 ARG HB2 51 ILE H 5.00 
 &rst
  ixpk= 0, nxpk= 0, iat= 780, 800, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50,  &end
#
# 50 ARG HB2 51 ILE QD1 4.74 
 &rst
  ixpk= 0, nxpk= 0, iat= 780,  -1, r1= 1.30, r2= 1.80, r3= 5.69, r4= 6.19,
 igr2= 813, 814, 815,
 &end
#
# 50 ARG HB3 51 ILE H 5.09 
 &rst
  ixpk= 0, nxpk= 0, iat= 781, 800, r1= 1.30, r2= 1.80, r3= 5.09, r4= 5.59,  &end
#
# 50 ARG HD2 51 ILE H 5.36 
 &rst
  ixpk= 0, nxpk= 0, iat= 786, 800, r1= 1.30, r2= 1.80, r3= 5.36, r4= 5.86,  &end
#
# 50 ARG HD2 53 ALA QB 5.36 
 &rst
  ixpk= 0, nxpk= 0, iat= 786,  -1, r1= 1.30, r2= 1.80, r3= 6.44, r4= 6.94,
 igr2= 840, 841, 842,
 &end
#
# 50 ARG HD3 51 ILE H 5.55 
 &rst
  ixpk= 0, nxpk= 0, iat= 787, 800, r1= 1.30, r2= 1.80, r3= 5.55, r4= 6.05,  &end
#
# 50 ARG HD3 51 ILE QD1 5.55 
 &rst
  ixpk= 0, nxpk= 0, iat= 787,  -1, r1= 1.30, r2= 1.80, r3= 6.67, r4= 7.17,
 igr2= 813, 814, 815,
 &end
#
# 50 ARG H 51 ILE H 4.86 
 &rst
  ixpk= 0, nxpk= 0, iat= 776, 800, r1= 1.30, r2= 1.80, r3= 4.86, r4= 5.36,  &end
#
# 50 ARG H 51 ILE QD1 5.36 
 &rst
  ixpk= 0, nxpk= 0, iat= 776,  -1, r1= 1.30, r2= 1.80, r3= 6.44, r4= 6.94,
 igr2= 813, 814, 815,
 &end
#
# 50 ARG H 51 ILE QG2 5.50 
 &rst
  ixpk= 0, nxpk= 0, iat= 776,  -1, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr2= 806, 807, 808,
 &end
#
# 50 ARG H 52 GLN H 5.50 
 &rst
  ixpk= 0, nxpk= 0, iat= 776, 819, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
# 50 ARG H 51 ILE HB 5.78 
 &rst
  ixpk= 0, nxpk= 0, iat= 776, 804, r1= 1.30, r2= 1.80, r3= 5.78, r4= 6.28,  &end
#
# 50 ARG H 53 ALA QB 5.22 
 &rst
  ixpk= 0, nxpk= 0, iat= 776,  -1, r1= 1.30, r2= 1.80, r3= 6.27, r4= 6.77,
 igr2= 840, 841, 842,
 &end
#
# 50 ARG H 55 LEU QD1 5.93 
 &rst
  ixpk= 0, nxpk= 0, iat= 776,  -1, r1= 1.30, r2= 1.80, r3= 7.12, r4= 7.62,
 igr2= 862, 863, 864,
 &end
#
# 51 ILE HA 52 GLN HE21 5.45 
 &rst
  ixpk= 0, nxpk= 0, iat= 802, 832, r1= 1.30, r2= 1.80, r3= 5.45, r4= 5.95,  &end
#
# 51 ILE HA 52 GLN H 4.00 
 &rst
  ixpk= 0, nxpk= 0, iat= 802, 819, r1= 1.30, r2= 1.80, r3= 4.00, r4= 4.50,  &end
#
# 51 ILE HA 53 ALA H 5.00 
 &rst
  ixpk= 0, nxpk= 0, iat= 802, 836, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50,  &end
#
# 51 ILE HA 55 LEU HG 5.22 
 &rst
  ixpk= 0, nxpk= 0, iat= 802, 860, r1= 1.30, r2= 1.80, r3= 5.22, r4= 5.72,  &end
#
# 51 ILE HA 55 LEU QD1 5.22 
 &rst
  ixpk= 0, nxpk= 0, iat= 802,  -1, r1= 1.30, r2= 1.80, r3= 6.27, r4= 6.77,
 igr2= 862, 863, 864,
 &end
#
# 51 ILE HB 52 GLN HA 5.09 
 &rst
  ixpk= 0, nxpk= 0, iat= 804, 821, r1= 1.30, r2= 1.80, r3= 5.09, r4= 5.59,  &end
#
# 51 ILE HB 52 GLN HE21 4.00 
 &rst
  ixpk= 0, nxpk= 0, iat= 804, 832, r1= 1.30, r2= 1.80, r3= 4.00, r4= 4.50,  &end
#
# 51 ILE HB 52 GLN HE22 4.50 
 &rst
  ixpk= 0, nxpk= 0, iat= 804, 831, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
# 51 ILE HB 52 GLN HG3 5.50 
 &rst
  ixpk= 0, nxpk= 0, iat= 804, 827, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
# 51 ILE HB 52 GLN H 4.00 
 &rst
  ixpk= 0, nxpk= 0, iat= 804, 819, r1= 1.30, r2= 1.80, r3= 4.00, r4= 4.50,  &end
#
# 51 ILE HG12 52 GLN H 5.20 
 &rst
  ixpk= 0, nxpk= 0, iat= 810, 819, r1= 1.30, r2= 1.80, r3= 5.20, r4= 5.70,  &end
#
# 51 ILE H 55 LEU QD1 5.09 
 &rst
  ixpk= 0, nxpk= 0, iat= 800,  -1, r1= 1.30, r2= 1.80, r3= 6.11, r4= 6.61,
 igr2= 862, 863, 864,
 &end
#
# 51 ILE QD1 52 GLN HE22 5.66 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 831, r1= 1.30, r2= 1.80, r3= 6.80, r4= 7.30,
 igr1= 813, 814, 815,
 &end
#
# 51 ILE QD1 52 GLN H 4.50 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 819, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr1= 813, 814, 815,
 &end
#
# 51 ILE QD1 56 THR HA 5.45 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 874, r1= 1.30, r2= 1.80, r3= 6.55, r4= 7.05,
 igr1= 813, 814, 815,
 &end
#
# 51 ILE QD1 56 THR QG2 4.38 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.32, r4= 6.82,
 igr1= 813, 814, 815,
 igr2= 878, 879, 880,
 &end
#
# 51 ILE QG2 52 GLN HA 3.90 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 821, r1= 1.30, r2= 1.80, r3= 4.68, r4= 5.18,
 igr1= 806, 807, 808,
 &end
#
# 51 ILE QG2 52 GLN HE21 4.29 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 832, r1= 1.30, r2= 1.80, r3= 5.15, r4= 5.65,
 igr1= 806, 807, 808,
 &end
#
# 51 ILE QG2 52 GLN HE22 4.94 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 831, r1= 1.30, r2= 1.80, r3= 5.93, r4= 6.43,
 igr1= 806, 807, 808,
 &end
#
# 51 ILE QG2 52 GLN HG3 5.00 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 827, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,
 igr1= 806, 807, 808,
 &end
#
# 51 ILE QG2 52 GLN H 4.00 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 819, r1= 1.30, r2= 1.80, r3= 4.80, r4= 5.30,
 igr1= 806, 807, 808,
 &end
#
# 52 GLN HA 52 GLN H 4.15 
 &rst
  ixpk= 0, nxpk= 0, iat= 821, 819, r1= 1.30, r2= 1.80, r3= 4.15, r4= 4.65,  &end
#
# 52 GLN HA 53 ALA H 4.59 
 &rst
  ixpk= 0, nxpk= 0, iat= 821, 836, r1= 1.30, r2= 1.80, r3= 4.59, r4= 5.09,  &end
#
# 52 GLN HA 55 LEU QD1 5.50 
 &rst
  ixpk= 0, nxpk= 0, iat= 821,  -1, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr2= 862, 863, 864,
 &end
#
# 52 GLN HA 55 LEU HG 5.50 
 &rst
  ixpk= 0, nxpk= 0, iat= 821, 860, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
# 52 GLN HB2 53 ALA H 5.45 
 &rst
  ixpk= 0, nxpk= 0, iat= 823, 836, r1= 1.30, r2= 1.80, r3= 5.45, r4= 5.95,  &end
#
# 52 GLN HB2 54 GLY H 5.66 
 &rst
  ixpk= 0, nxpk= 0, iat= 823, 846, r1= 1.30, r2= 1.80, r3= 5.66, r4= 6.16,  &end
#
# 52 GLN HB3 53 ALA H 5.66 
 &rst
  ixpk= 0, nxpk= 0, iat= 824, 836, r1= 1.30, r2= 1.80, r3= 5.66, r4= 6.16,  &end
#
# 52 GLN HE21 55 LEU QD1 5.50 
 &rst
  ixpk= 0, nxpk= 0, iat= 832,  -1, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr2= 862, 863, 864,
 &end
#
# 52 GLN HE22 55 LEU QD1 5.50 
 &rst
  ixpk= 0, nxpk= 0, iat= 831,  -1, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr2= 862, 863, 864,
 &end
#
# 52 GLN HG2 53 ALA H 5.50 
 &rst
  ixpk= 0, nxpk= 0, iat= 826, 836, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
# 52 GLN H 53 ALA HA 5.22 
 &rst
  ixpk= 0, nxpk= 0, iat= 819, 838, r1= 1.30, r2= 1.80, r3= 5.22, r4= 5.72,  &end
#
# 52 GLN H 53 ALA H 4.50 
 &rst
  ixpk= 0, nxpk= 0, iat= 819, 836, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
# 52 GLN H 53 ALA QB 4.38 
 &rst
  ixpk= 0, nxpk= 0, iat= 819,  -1, r1= 1.30, r2= 1.80, r3= 5.26, r4= 5.76,
 igr2= 840, 841, 842,
 &end
#
# 52 GLN H 54 GLY H 5.66 
 &rst
  ixpk= 0, nxpk= 0, iat= 819, 846, r1= 1.30, r2= 1.80, r3= 5.66, r4= 6.16,  &end
#
# 53 ALA HA 54 GLY H 4.56 
 &rst
  ixpk= 0, nxpk= 0, iat= 838, 846, r1= 1.30, r2= 1.80, r3= 4.56, r4= 5.06,  &end
#
# 53 ALA HA 54 GLY HA3 5.50 
 &rst
  ixpk= 0, nxpk= 0, iat= 838, 849, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
# 53 ALA HA 55 LEU HG 6.00 
 &rst
  ixpk= 0, nxpk= 0, iat= 838, 860, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,  &end
#
# 53 ALA HA 55 LEU QD1 6.00 
 &rst
  ixpk= 0, nxpk= 0, iat= 838,  -1, r1= 1.30, r2= 1.80, r3= 7.21, r4= 7.71,
 igr2= 862, 863, 864,
 &end
#
# 53 ALA H 55 LEU QD1 5.93 
 &rst
  ixpk= 0, nxpk= 0, iat= 836,  -1, r1= 1.30, r2= 1.80, r3= 7.12, r4= 7.62,
 igr2= 862, 863, 864,
 &end
#
# 53 ALA QB 54 GLY HA3 4.24 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 849, r1= 1.30, r2= 1.80, r3= 5.09, r4= 5.59,
 igr1= 840, 841, 842,
 &end
#
# 53 ALA QB 54 GLY H 4.65 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 846, r1= 1.30, r2= 1.80, r3= 5.58, r4= 6.08,
 igr1= 840, 841, 842,
 &end
#
# 53 ALA QB 55 LEU QD1 5.00 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.21, r4= 7.71,
 igr1= 840, 841, 842,
 igr2= 862, 863, 864,
 &end
#
# 54 GLY HA2 55 LEU QD2 4.80 
 &rst
  ixpk= 0, nxpk= 0, iat= 848,  -1, r1= 1.30, r2= 1.80, r3= 5.76, r4= 6.26,
 igr2= 866, 867, 868,
 &end
#
# 54 GLY HA3 55 LEU QD2 4.47 
 &rst
  ixpk= 0, nxpk= 0, iat= 849,  -1, r1= 1.30, r2= 1.80, r3= 5.37, r4= 5.87,
 igr2= 866, 867, 868,
 &end
#
# 54 GLY H 55 LEU HG 5.29 
 &rst
  ixpk= 0, nxpk= 0, iat= 846, 860, r1= 1.30, r2= 1.80, r3= 5.29, r4= 5.79,  &end
#
# 54 GLY H 55 LEU QD1 5.66 
 &rst
  ixpk= 0, nxpk= 0, iat= 846,  -1, r1= 1.30, r2= 1.80, r3= 6.80, r4= 7.30,
 igr2= 862, 863, 864,
 &end
#
# 55 LEU HB2 56 THR HA 4.65 
 &rst
  ixpk= 0, nxpk= 0, iat= 857, 874, r1= 1.30, r2= 1.80, r3= 4.65, r4= 5.15,  &end
#
# 55 LEU HB2 56 THR H 5.93 
 &rst
  ixpk= 0, nxpk= 0, iat= 857, 872, r1= 1.30, r2= 1.80, r3= 5.93, r4= 6.43,  &end
#
# 55 LEU H 56 THR QG2 6.12 
 &rst
  ixpk= 0, nxpk= 0, iat= 853,  -1, r1= 1.30, r2= 1.80, r3= 7.35, r4= 7.85,
 igr2= 878, 879, 880,
 &end
#
# 55 LEU H 56 THR HA 5.78 
 &rst
  ixpk= 0, nxpk= 0, iat= 853, 874, r1= 1.30, r2= 1.80, r3= 5.78, r4= 6.28,  &end
#
# 55 LEU H 56 THR H 5.87 
 &rst
  ixpk= 0, nxpk= 0, iat= 853, 872, r1= 1.30, r2= 1.80, r3= 5.87, r4= 6.37,  &end
#
# 55 LEU QD1 56 THR H 6.12 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 872, r1= 1.30, r2= 1.80, r3= 7.35, r4= 7.85,
 igr1= 862, 863, 864,
 &end
#
# 55 LEU QD2 58 PRO HA 5.04 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 906, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55,
 igr1= 866, 867, 868,
 &end
#
# 56 THR HA 57 ALA H 4.90 
 &rst
  ixpk= 0, nxpk= 0, iat= 874, 886, r1= 1.30, r2= 1.80, r3= 4.90, r4= 5.40,  &end
#
# 56 THR HA 58 PRO HD3 5.04 
 &rst
  ixpk= 0, nxpk= 0, iat= 874, 898, r1= 1.30, r2= 1.80, r3= 5.04, r4= 5.54,  &end
#
# 56 THR HB 57 ALA H 5.29 
 &rst
  ixpk= 0, nxpk= 0, iat= 876, 886, r1= 1.30, r2= 1.80, r3= 5.29, r4= 5.79,  &end
#
# 56 THR QG2 57 ALA H 5.78 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 886, r1= 1.30, r2= 1.80, r3= 6.94, r4= 7.44,
 igr1= 878, 879, 880,
 &end
#
# 57 ALA HA 58 PRO HD2 5.00 
 &rst
  ixpk= 0, nxpk= 0, iat= 888, 897, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50,  &end
#
# 57 ALA QB 58 PRO HA 4.86 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 906, r1= 1.30, r2= 1.80, r3= 5.84, r4= 6.34,
 igr1= 890, 891, 892,
 &end
#
# 57 ALA QB 58 PRO HD2 4.03 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 897, r1= 1.30, r2= 1.80, r3= 4.84, r4= 5.34,
 igr1= 890, 891, 892,
 &end
#
# 57 ALA QB 58 PRO HD3 4.03 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 898, r1= 1.30, r2= 1.80, r3= 4.84, r4= 5.34,
 igr1= 890, 891, 892,
 &end
#
# 58 PRO HA 59 ASP HB2 4.54 
 &rst
  ixpk= 0, nxpk= 0, iat= 906, 914, r1= 1.30, r2= 1.80, r3= 4.54, r4= 5.04,  &end
#
# 58 PRO HA 59 ASP H 4.18 
 &rst
  ixpk= 0, nxpk= 0, iat= 906, 910, r1= 1.30, r2= 1.80, r3= 4.18, r4= 4.68,  &end
#
# 58 PRO HB2 59 ASP H 5.55 
 &rst
  ixpk= 0, nxpk= 0, iat= 903, 910, r1= 1.30, r2= 1.80, r3= 5.55, r4= 6.05,  &end
#
# 58 PRO HB3 59 ASP HB2 4.59 
 &rst
  ixpk= 0, nxpk= 0, iat= 904, 914, r1= 1.30, r2= 1.80, r3= 4.59, r4= 5.09,  &end
#
# 58 PRO HB3 59 ASP HB3 4.51 
 &rst
  ixpk= 0, nxpk= 0, iat= 904, 915, r1= 1.30, r2= 1.80, r3= 4.51, r4= 5.01,  &end
#
# 58 PRO HB3 59 ASP H 4.82 
 &rst
  ixpk= 0, nxpk= 0, iat= 904, 910, r1= 1.30, r2= 1.80, r3= 4.82, r4= 5.32,  &end
#
# 59 ASP HB2 60 LYS HG3 4.86 
 &rst
  ixpk= 0, nxpk= 0, iat= 914, 930, r1= 1.30, r2= 1.80, r3= 4.86, r4= 5.36,  &end
#
# 59 ASP HB2 60 LYS QD 4.99 
 &rst
  ixpk= 0, nxpk= 0, iat= 914,  -1, r1= 1.30, r2= 1.80, r3= 5.60, r4= 6.10,
 igr2= 932, 933,
 &end
#
# 60 LYS QE 63 THR HB 4.56 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 987, r1= 1.30, r2= 1.80, r3= 5.12, r4= 5.62,
 igr1= 935, 936,
 &end
#
# 60 LYS QE 63 THR QG2 4.40 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.93, r4= 6.43,
 igr1= 935, 936,
 igr2= 989, 990, 991,
 &end
#
# 62 GLU HA 63 THR H 4.94 
 &rst
  ixpk= 0, nxpk= 0, iat= 970, 983, r1= 1.30, r2= 1.80, r3= 4.94, r4= 5.44,  &end
#
# 62 GLU HG2 63 THR HB 5.09 
 &rst
  ixpk= 0, nxpk= 0, iat= 975, 987, r1= 1.30, r2= 1.80, r3= 5.09, r4= 5.59,  &end
#
# 63 THR HA 64 PRO HD2 2.97 
 &rst
  ixpk= 0, nxpk= 0, iat= 985, 998, r1= 1.30, r2= 1.80, r3= 2.97, r4= 3.47,  &end
#
# 63 THR HA 64 PRO HD3 2.96 
 &rst
  ixpk= 0, nxpk= 0, iat= 985, 999, r1= 1.30, r2= 1.80, r3= 2.96, r4= 3.46,  &end
#
# 63 THR HB 64 PRO HD2 3.60 
 &rst
  ixpk= 0, nxpk= 0, iat= 987, 998, r1= 1.30, r2= 1.80, r3= 3.60, r4= 4.10,  &end
#
# 63 THR HB 64 PRO HD3 3.83 
 &rst
  ixpk= 0, nxpk= 0, iat= 987, 999, r1= 1.30, r2= 1.80, r3= 3.83, r4= 4.33,  &end
#
# 63 THR HB 64 PRO QG 5.20 
 &rst
  ixpk= 0, nxpk= 0, iat= 987,  -1, r1= 1.30, r2= 1.80, r3= 5.84, r4= 6.34,
 igr2=1001,1002,
 &end
#
# 63 THR QG2 64 PRO HA 5.50 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1007, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr1= 989, 990, 991,
 &end
#
# 63 THR QG2 64 PRO HD2 3.90 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 998, r1= 1.30, r2= 1.80, r3= 4.68, r4= 5.18,
 igr1= 989, 990, 991,
 &end
#
# 63 THR QG2 64 PRO HD3 4.24 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 999, r1= 1.30, r2= 1.80, r3= 5.09, r4= 5.59,
 igr1= 989, 990, 991,
 &end
#
# 63 THR QG2 64 PRO HD3 4.65 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 999, r1= 1.30, r2= 1.80, r3= 5.58, r4= 6.08,
 igr1= 989, 990, 991,
 &end
#
# 63 THR QG2 64 PRO QG 4.82 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.50, r4= 7.00,
 igr1= 989, 990, 991,
 igr2=1001,1002,
 &end
#
# 64 PRO HA 65 HIS HB3 5.50 
 &rst
  ixpk= 0, nxpk= 0, iat=1007,1016, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
# 64 PRO HD3 65 HIS HB3 6.00 
 &rst
  ixpk= 0, nxpk= 0, iat= 999,1016, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,  &end
#
# 87 MET HA 87 MET HG2 4.99 
 &rst
  ixpk= 0, nxpk= 0, iat=1715,1720, r1= 1.30, r2= 1.80, r3= 4.99, r4= 5.49,  &end
#
# 87 MET HA 87 MET HG3 4.68 
 &rst
  ixpk= 0, nxpk= 0, iat=1715,1721, r1= 1.30, r2= 1.80, r3= 4.68, r4= 5.18,  &end
#
# 87 MET HA 88 LEU H 3.00 
 &rst
  ixpk= 0, nxpk= 0, iat=1715,1730, r1= 1.30, r2= 1.80, r3= 3.00, r4= 3.50,  &end
#
# 87 MET HA 89 ILE QD1 4.94 
 &rst
  ixpk= 0, nxpk= 0, iat=1715,  -1, r1= 1.30, r2= 1.80, r3= 5.93, r4= 6.43,
 igr2=1762,1763,1764,
 &end
#
# 87 MET HB2 88 LEU H 4.99 
 &rst
  ixpk= 0, nxpk= 0, iat=1717,1730, r1= 1.30, r2= 1.80, r3= 4.99, r4= 5.49,  &end
#
# 87 MET HB3 88 LEU H 4.86 
 &rst
  ixpk= 0, nxpk= 0, iat=1718,1730, r1= 1.30, r2= 1.80, r3= 4.86, r4= 5.36,  &end
#
# 87 MET HG2 89 ILE QD1 4.07 
 &rst
  ixpk= 0, nxpk= 0, iat=1720,  -1, r1= 1.30, r2= 1.80, r3= 4.89, r4= 5.39,
 igr2=1762,1763,1764,
 &end
#
# 87 MET HG3 88 LEU H 5.55 
 &rst
  ixpk= 0, nxpk= 0, iat=1721,1730, r1= 1.30, r2= 1.80, r3= 5.55, r4= 6.05,  &end
#
# 87 MET HG3 89 ILE QD1 4.10 
 &rst
  ixpk= 0, nxpk= 0, iat=1721,  -1, r1= 1.30, r2= 1.80, r3= 4.92, r4= 5.42,
 igr2=1762,1763,1764,
 &end
#
# 88 LEU HB2 88 LEU H 4.78 
 &rst
  ixpk= 0, nxpk= 0, iat=1734,1730, r1= 1.30, r2= 1.80, r3= 4.78, r4= 5.28,  &end
#
# 88 LEU HB3 88 LEU H 5.04 
 &rst
  ixpk= 0, nxpk= 0, iat=1735,1730, r1= 1.30, r2= 1.80, r3= 5.04, r4= 5.54,  &end
#
# 88 LEU HB3 89 ILE H 5.93 
 &rst
  ixpk= 0, nxpk= 0, iat=1735,1749, r1= 1.30, r2= 1.80, r3= 5.93, r4= 6.43,  &end
#
# 88 LEU H 89 ILE HA 5.93 
 &rst
  ixpk= 0, nxpk= 0, iat=1730,1751, r1= 1.30, r2= 1.80, r3= 5.93, r4= 6.43,  &end
#
# 88 LEU H 89 ILE H 5.50 
 &rst
  ixpk= 0, nxpk= 0, iat=1730,1749, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
# 88 LEU QD1 98 ILE QG2 4.78 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.89, r4= 7.39,
 igr1=1739,1740,1741,
 igr2=1902,1903,1904,
 &end
#
# 88 LEU QD1 88 LEU H 5.36 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1730, r1= 1.30, r2= 1.80, r3= 6.44, r4= 6.94,
 igr1=1739,1740,1741,
 &end
#
# 88 LEU QD1 90 LEU HG 6.00 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1775, r1= 1.30, r2= 1.80, r3= 7.21, r4= 7.71,
 igr1=1739,1740,1741,
 &end
#
# 88 LEU QD1 90 LEU QD1 4.36 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.29, r4= 6.79,
 igr1=1739,1740,1741,
 igr2=1777,1778,1779,
 &end
#
# 88 LEU QD1 90 LEU QD2 4.59 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.62, r4= 7.12,
 igr1=1739,1740,1741,
 igr2=1781,1782,1783,
 &end
#
# 88 LEU QD2 89 ILE HA 4.65 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1751, r1= 1.30, r2= 1.80, r3= 5.58, r4= 6.08,
 igr1=1743,1744,1745,
 &end
#
# 88 LEU QD2 89 ILE H 4.00 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1749, r1= 1.30, r2= 1.80, r3= 4.80, r4= 5.30,
 igr1=1743,1744,1745,
 &end
#
# 88 LEU QD2 90 LEU QD2 3.98 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.74, r4= 6.24,
 igr1=1743,1744,1745,
 igr2=1781,1782,1783,
 &end
#
# 89 ILE HA 90 LEU HB3 5.55 
 &rst
  ixpk= 0, nxpk= 0, iat=1751,1773, r1= 1.30, r2= 1.80, r3= 5.55, r4= 6.05,  &end
#
# 89 ILE HA 90 LEU H 3.50 
 &rst
  ixpk= 0, nxpk= 0, iat=1751,1768, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
# 90 LEU HB2 90 LEU H 5.55 
 &rst
  ixpk= 0, nxpk= 0, iat=1772,1768, r1= 1.30, r2= 1.80, r3= 5.55, r4= 6.05,  &end
#
# 90 LEU H 90 LEU QD2 5.29 
 &rst
  ixpk= 0, nxpk= 0, iat=1768,  -1, r1= 1.30, r2= 1.80, r3= 6.35, r4= 6.85,
 igr2=1781,1782,1783,
 &end
#
# 90 LEU QD1 98 ILE QD1 3.18 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.59, r4= 5.09,
 igr1=1777,1778,1779,
 igr2=1909,1910,1911,
 &end
#
# 90 LEU QD1 90 LEU H 6.12 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1768, r1= 1.30, r2= 1.80, r3= 7.35, r4= 7.85,
 igr1=1777,1778,1779,
 &end
#
# 90 LEU QD2 98 ILE QD1 4.40 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.35, r4= 6.85,
 igr1=1781,1782,1783,
 igr2=1909,1910,1911,
 &end
#
# 90 LEU QD2 98 ILE QG2 5.00 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.21, r4= 7.71,
 igr1=1781,1782,1783,
 igr2=1902,1903,1904,
 &end
#
# 90 LEU QD2 90 LEU QD1 3.77 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.44, r4= 5.94,
 igr1=1781,1782,1783,
 igr2=1777,1778,1779,
 &end
#
# 91 THR HA 92 ARG H 5.29 
 &rst
  ixpk= 0, nxpk= 0, iat=1789,1801, r1= 1.30, r2= 1.80, r3= 5.29, r4= 5.79,  &end
#
# 91 THR HB 91 THR H 6.12 
 &rst
  ixpk= 0, nxpk= 0, iat=1791,1787, r1= 1.30, r2= 1.80, r3= 6.12, r4= 6.62,  &end
#
# 91 THR QG2 91 THR HB 4.24 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1791, r1= 1.30, r2= 1.80, r3= 5.09, r4= 5.59,
 igr1=1793,1794,1795,
 &end
#
# 91 THR QG2 92 ARG H 4.15 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1801, r1= 1.30, r2= 1.80, r3= 4.98, r4= 5.48,
 igr1=1793,1794,1795,
 &end
#
# 92 ARG HA 92 ARG HE 6.12 
 &rst
  ixpk= 0, nxpk= 0, iat=1803,1814, r1= 1.30, r2= 1.80, r3= 6.12, r4= 6.62,  &end
#
# 92 ARG HA 93 LYS HB3 5.45 
 &rst
  ixpk= 0, nxpk= 0, iat=1803,1830, r1= 1.30, r2= 1.80, r3= 5.45, r4= 5.95,  &end
#
# 92 ARG HA 93 LYS H 3.00 
 &rst
  ixpk= 0, nxpk= 0, iat=1803,1825, r1= 1.30, r2= 1.80, r3= 3.00, r4= 3.50,  &end
#
# 92 ARG HB2 96 GLU HB2 5.29 
 &rst
  ixpk= 0, nxpk= 0, iat=1805,1874, r1= 1.30, r2= 1.80, r3= 5.29, r4= 5.79,  &end
#
# 92 ARG HB2 98 ILE HG12 5.15 
 &rst
  ixpk= 0, nxpk= 0, iat=1805,1906, r1= 1.30, r2= 1.80, r3= 5.15, r4= 5.65,  &end
#
# 92 ARG HB2 98 ILE HG13 5.36 
 &rst
  ixpk= 0, nxpk= 0, iat=1805,1907, r1= 1.30, r2= 1.80, r3= 5.36, r4= 5.86,  &end
#
# 92 ARG HB2 98 ILE QD1 4.86 
 &rst
  ixpk= 0, nxpk= 0, iat=1805,  -1, r1= 1.30, r2= 1.80, r3= 5.84, r4= 6.34,
 igr2=1909,1910,1911,
 &end
#
# 92 ARG HB2 108 ILE HG12 5.09 
 &rst
  ixpk= 0, nxpk= 0, iat=1805,2055, r1= 1.30, r2= 1.80, r3= 5.09, r4= 5.59,  &end
#
# 92 ARG HB2 92 ARG HE 6.35 
 &rst
  ixpk= 0, nxpk= 0, iat=1805,1814, r1= 1.30, r2= 1.80, r3= 6.35, r4= 6.85,  &end
#
# 92 ARG HB2 93 LYS H 5.78 
 &rst
  ixpk= 0, nxpk= 0, iat=1805,1825, r1= 1.30, r2= 1.80, r3= 5.78, r4= 6.28,  &end
#
# 92 ARG HD2 98 ILE HG12 4.94 
 &rst
  ixpk= 0, nxpk= 0, iat=1811,1906, r1= 1.30, r2= 1.80, r3= 4.94, r4= 5.44,  &end
#
# 92 ARG HD2 98 ILE HG13 5.29 
 &rst
  ixpk= 0, nxpk= 0, iat=1811,1907, r1= 1.30, r2= 1.80, r3= 5.29, r4= 5.79,  &end
#
# 92 ARG HD2 98 ILE QD1 5.22 
 &rst
  ixpk= 0, nxpk= 0, iat=1811,  -1, r1= 1.30, r2= 1.80, r3= 6.27, r4= 6.77,
 igr2=1909,1910,1911,
 &end
#
# 92 ARG HD2 98 ILE QG2 5.04 
 &rst
  ixpk= 0, nxpk= 0, iat=1811,  -1, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55,
 igr2=1902,1903,1904,
 &end
#
# 92 ARG HD3 98 ILE HG12 5.22 
 &rst
  ixpk= 0, nxpk= 0, iat=1812,1906, r1= 1.30, r2= 1.80, r3= 5.22, r4= 5.72,  &end
#
# 92 ARG HD3 98 ILE QD1 5.04 
 &rst
  ixpk= 0, nxpk= 0, iat=1812,  -1, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55,
 igr2=1909,1910,1911,
 &end
#
# 92 ARG HE 96 GLU HB2 5.50 
 &rst
  ixpk= 0, nxpk= 0, iat=1814,1874, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
# 92 ARG HE 96 GLU HB3 5.00 
 &rst
  ixpk= 0, nxpk= 0, iat=1814,1875, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50,  &end
#
# 92 ARG HE 96 GLU QG 5.00 
 &rst
  ixpk= 0, nxpk= 0, iat=1814,  -1, r1= 1.30, r2= 1.80, r3= 5.61, r4= 6.11,
 igr2=1877,1878,
 &end
#
# 92 ARG HE 97 SER H 5.00 
 &rst
  ixpk= 0, nxpk= 0, iat=1814,1885, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50,  &end
#
# 92 ARG HE 98 ILE HG12 5.66 
 &rst
  ixpk= 0, nxpk= 0, iat=1814,1906, r1= 1.30, r2= 1.80, r3= 5.66, r4= 6.16,  &end
#
# 92 ARG HE 98 ILE HG13 6.12 
 &rst
  ixpk= 0, nxpk= 0, iat=1814,1907, r1= 1.30, r2= 1.80, r3= 6.12, r4= 6.62,  &end
#
# 92 ARG HE 92 ARG HA 4.78 
 &rst
  ixpk= 0, nxpk= 0, iat=1814,1803, r1= 1.30, r2= 1.80, r3= 4.78, r4= 5.28,  &end
#
# 92 ARG HE 92 ARG HD2 5.93 
 &rst
  ixpk= 0, nxpk= 0, iat=1814,1811, r1= 1.30, r2= 1.80, r3= 5.93, r4= 6.43,  &end
#
# 92 ARG HE 93 LYS H 4.50 
 &rst
  ixpk= 0, nxpk= 0, iat=1814,1825, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
# 92 ARG QD 96 GLU HB2 4.50 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1874, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1=1811,1812,
 &end
#
# 92 ARG QD 96 GLU HB3 4.50 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1875, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1=1811,1812,
 &end
#
# 92 ARG QD 96 GLU QG 4.50 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1=1811,1812,
 igr2=1877,1878,
 &end
#
# 93 LYS HA 94 VAL HB 6.00 
 &rst
  ixpk= 0, nxpk= 0, iat=1827,1851, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,  &end
#
# 93 LYS HA 94 VAL H 3.00 
 &rst
  ixpk= 0, nxpk= 0, iat=1827,1847, r1= 1.30, r2= 1.80, r3= 3.00, r4= 3.50,  &end
#
# 93 LYS HA 94 VAL QG1 4.82 
 &rst
  ixpk= 0, nxpk= 0, iat=1827,  -1, r1= 1.30, r2= 1.80, r3= 5.79, r4= 6.29,
 igr2=1853,1854,1855,
 &end
#
# 93 LYS HA 94 VAL QG2 4.90 
 &rst
  ixpk= 0, nxpk= 0, iat=1827,  -1, r1= 1.30, r2= 1.80, r3= 5.88, r4= 6.38,
 igr2=1857,1858,1859,
 &end
#
# 93 LYS HB2 94 VAL H 5.22 
 &rst
  ixpk= 0, nxpk= 0, iat=1829,1847, r1= 1.30, r2= 1.80, r3= 5.22, r4= 5.72,  &end
#
# 93 LYS HB3 96 GLU QG 4.00 
 &rst
  ixpk= 0, nxpk= 0, iat=1830,  -1, r1= 1.30, r2= 1.80, r3= 4.49, r4= 4.99,
 igr2=1877,1878,
 &end
#
# 93 LYS HB3 94 VAL H 5.50 
 &rst
  ixpk= 0, nxpk= 0, iat=1830,1847, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
# 93 LYS HB3 94 VAL QG1 5.15 
 &rst
  ixpk= 0, nxpk= 0, iat=1830,  -1, r1= 1.30, r2= 1.80, r3= 6.18, r4= 6.68,
 igr2=1853,1854,1855,
 &end
#
# 93 LYS HD3 94 VAL H 5.04 
 &rst
  ixpk= 0, nxpk= 0, iat=1836,1847, r1= 1.30, r2= 1.80, r3= 5.04, r4= 5.54,  &end
#
# 93 LYS H 96 GLU HB2 4.50 
 &rst
  ixpk= 0, nxpk= 0, iat=1825,1874, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
# 93 LYS H 96 GLU HB2 5.00 
 &rst
  ixpk= 0, nxpk= 0, iat=1825,1874, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50,  &end
#
# 93 LYS H 96 GLU H 5.00 
 &rst
  ixpk= 0, nxpk= 0, iat=1825,1870, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50,  &end
#
# 93 LYS H 96 GLU QG 5.00 
 &rst
  ixpk= 0, nxpk= 0, iat=1825,  -1, r1= 1.30, r2= 1.80, r3= 5.61, r4= 6.11,
 igr2=1877,1878,
 &end
#
# 93 LYS H 98 ILE QD1 6.00 
 &rst
  ixpk= 0, nxpk= 0, iat=1825,  -1, r1= 1.30, r2= 1.80, r3= 7.21, r4= 7.71,
 igr2=1909,1910,1911,
 &end
#
# 93 LYS H 94 VAL H 5.66 
 &rst
  ixpk= 0, nxpk= 0, iat=1825,1847, r1= 1.30, r2= 1.80, r3= 5.66, r4= 6.16,  &end
#
# 93 LYS QE 93 LYS HA 5.66 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1827, r1= 1.30, r2= 1.80, r3= 6.35, r4= 6.85,
 igr1=1838,1839,
 &end
#
# 93 LYS QE 94 VAL QG2 4.86 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.55, r4= 7.05,
 igr1=1838,1839,
 igr2=1857,1858,1859,
 &end
#
# 93 LYS QG 94 VAL H 5.22 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1847, r1= 1.30, r2= 1.80, r3= 5.86, r4= 6.36,
 igr1=1832,1833,
 &end
#
# 94 VAL HA 96 GLU H 4.00 
 &rst
  ixpk= 0, nxpk= 0, iat=1849,1870, r1= 1.30, r2= 1.80, r3= 4.00, r4= 4.50,  &end
#
# 94 VAL HA 108 ILE HB 5.50 
 &rst
  ixpk= 0, nxpk= 0, iat=1849,2049, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
# 94 VAL HA 108 ILE H 5.00 
 &rst
  ixpk= 0, nxpk= 0, iat=1849,2045, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50,  &end
#
# 94 VAL HA 108 ILE QD1 6.00 
 &rst
  ixpk= 0, nxpk= 0, iat=1849,  -1, r1= 1.30, r2= 1.80, r3= 7.21, r4= 7.71,
 igr2=2058,2059,2060,
 &end
#
# 94 VAL HA 108 ILE QG2 3.50 
 &rst
  ixpk= 0, nxpk= 0, iat=1849,  -1, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
 igr2=2051,2052,2053,
 &end
#
# 94 VAL HA 109 LEU H 5.80 
 &rst
  ixpk= 0, nxpk= 0, iat=1849,2064, r1= 1.30, r2= 1.80, r3= 5.80, r4= 6.30,  &end
#
# 94 VAL HA 110 GLY HA3 5.00 
 &rst
  ixpk= 0, nxpk= 0, iat=1849,2086, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50,  &end
#
# 94 VAL HA 110 GLY HA2 6.00 
 &rst
  ixpk= 0, nxpk= 0, iat=1849,2085, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,  &end
#
# 94 VAL HA 110 GLY H 5.50 
 &rst
  ixpk= 0, nxpk= 0, iat=1849,2083, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
# 94 VAL HA 111 VAL QG1 4.49 
 &rst
  ixpk= 0, nxpk= 0, iat=1849,  -1, r1= 1.30, r2= 1.80, r3= 5.39, r4= 5.89,
 igr2=2096,2097,2098,
 &end
#
# 94 VAL HA 95 GLY H 3.00 
 &rst
  ixpk= 0, nxpk= 0, iat=1849,1863, r1= 1.30, r2= 1.80, r3= 3.00, r4= 3.50,  &end
#
# 94 VAL HB 108 ILE QG2 4.50 
 &rst
  ixpk= 0, nxpk= 0, iat=1851,  -1, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr2=2051,2052,2053,
 &end
#
# 94 VAL HB 110 GLY H 5.55 
 &rst
  ixpk= 0, nxpk= 0, iat=1851,2083, r1= 1.30, r2= 1.80, r3= 5.55, r4= 6.05,  &end
#
# 94 VAL HB 111 VAL H 4.94 
 &rst
  ixpk= 0, nxpk= 0, iat=1851,2090, r1= 1.30, r2= 1.80, r3= 4.94, r4= 5.44,  &end
#
# 94 VAL HB 111 VAL QG1 5.50 
 &rst
  ixpk= 0, nxpk= 0, iat=1851,  -1, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr2=2096,2097,2098,
 &end
#
# 94 VAL HB 95 GLY HA3 4.82 
 &rst
  ixpk= 0, nxpk= 0, iat=1851,1866, r1= 1.30, r2= 1.80, r3= 4.82, r4= 5.32,  &end
#
# 94 VAL HB 95 GLY H 6.00 
 &rst
  ixpk= 0, nxpk= 0, iat=1851,1863, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,  &end
#
# 94 VAL H 96 GLU H 5.50 
 &rst
  ixpk= 0, nxpk= 0, iat=1847,1870, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
# 94 VAL H 95 GLY H 5.50 
 &rst
  ixpk= 0, nxpk= 0, iat=1847,1863, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
# 94 VAL H 111 VAL QG2 5.80 
 &rst
  ixpk= 0, nxpk= 0, iat=1847,  -1, r1= 1.30, r2= 1.80, r3= 6.97, r4= 7.47,
 igr2=2100,2101,2102,
 &end
#
# 94 VAL QG1 110 GLY HA3 3.50 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,2086, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
 igr1=1853,1854,1855,
 &end
#
# 94 VAL QG1 111 VAL H 4.50 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,2090, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr1=1853,1854,1855,
 &end
#
# 94 VAL QG1 95 GLY H 3.83 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1863, r1= 1.30, r2= 1.80, r3= 4.60, r4= 5.10,
 igr1=1853,1854,1855,
 &end
#
# 94 VAL QG2 110 GLY HA3 4.00 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,2086, r1= 1.30, r2= 1.80, r3= 4.80, r4= 5.30,
 igr1=1857,1858,1859,
 &end
#
# 94 VAL QG2 111 VAL H 4.00 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,2090, r1= 1.30, r2= 1.80, r3= 4.80, r4= 5.30,
 igr1=1857,1858,1859,
 &end
#
# 94 VAL QG2 111 VAL QG1 4.00 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.77, r4= 6.27,
 igr1=1857,1858,1859,
 igr2=2096,2097,2098,
 &end
#
# 94 VAL QG2 95 GLY H 5.00 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1863, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,
 igr1=1857,1858,1859,
 &end
#
# 95 GLY HA3 96 GLU H 4.00 
 &rst
  ixpk= 0, nxpk= 0, iat=1866,1870, r1= 1.30, r2= 1.80, r3= 4.00, r4= 4.50,  &end
#
# 95 GLY HA2 96 GLU H 4.00 
 &rst
  ixpk= 0, nxpk= 0, iat=1865,1870, r1= 1.30, r2= 1.80, r3= 4.00, r4= 4.50,  &end
#
# 95 GLY HA3 96 GLU H 5.45 
 &rst
  ixpk= 0, nxpk= 0, iat=1866,1870, r1= 1.30, r2= 1.80, r3= 5.45, r4= 5.95,  &end
#
# 95 GLY HA3 107 THR QG2 5.50 
 &rst
  ixpk= 0, nxpk= 0, iat=1866,  -1, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr2=2037,2038,2039,
 &end
#
# 95 GLY HA3 108 ILE QG2 4.86 
 &rst
  ixpk= 0, nxpk= 0, iat=1866,  -1, r1= 1.30, r2= 1.80, r3= 5.84, r4= 6.34,
 igr2=2051,2052,2053,
 &end
#
# 95 GLY H 96 GLU H 3.50 
 &rst
  ixpk= 0, nxpk= 0, iat=1863,1870, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
# 95 GLY H 108 ILE HB 5.00 
 &rst
  ixpk= 0, nxpk= 0, iat=1863,2049, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50,  &end
#
# 95 GLY H 108 ILE HG12 5.36 
 &rst
  ixpk= 0, nxpk= 0, iat=1863,2055, r1= 1.30, r2= 1.80, r3= 5.36, r4= 5.86,  &end
#
# 95 GLY H 108 ILE H 5.50 
 &rst
  ixpk= 0, nxpk= 0, iat=1863,2045, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
# 95 GLY H 108 ILE QG2 4.00 
 &rst
  ixpk= 0, nxpk= 0, iat=1863,  -1, r1= 1.30, r2= 1.80, r3= 4.80, r4= 5.30,
 igr2=2051,2052,2053,
 &end
#
# 95 GLY H 110 GLY H 5.55 
 &rst
  ixpk= 0, nxpk= 0, iat=1863,2083, r1= 1.30, r2= 1.80, r3= 5.55, r4= 6.05,  &end
#
# 95 GLY H 108 ILE HG13 5.36 
 &rst
  ixpk= 0, nxpk= 0, iat=1863,2056, r1= 1.30, r2= 1.80, r3= 5.36, r4= 5.86,  &end
#
# 95 GLY H 108 ILE QD1 4.34 
 &rst
  ixpk= 0, nxpk= 0, iat=1863,  -1, r1= 1.30, r2= 1.80, r3= 5.21, r4= 5.71,
 igr2=2058,2059,2060,
 &end
#
# 96 GLU HA 97 SER H 3.50 
 &rst
  ixpk= 0, nxpk= 0, iat=1872,1885, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
# 96 GLU H 97 SER H 5.00 
 &rst
  ixpk= 0, nxpk= 0, iat=1870,1885, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50,  &end
#
# 96 GLU H 107 THR QG2 5.30 
 &rst
  ixpk= 0, nxpk= 0, iat=1870,  -1, r1= 1.30, r2= 1.80, r3= 6.36, r4= 6.86,
 igr2=2037,2038,2039,
 &end
#
# 96 GLU H 108 ILE HB 6.00 
 &rst
  ixpk= 0, nxpk= 0, iat=1870,2049, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,  &end
#
# 96 GLU H 108 ILE H 5.00 
 &rst
  ixpk= 0, nxpk= 0, iat=1870,2045, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50,  &end
#
# 96 GLU H 108 ILE QG2 5.50 
 &rst
  ixpk= 0, nxpk= 0, iat=1870,  -1, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr2=2051,2052,2053,
 &end
#
# 97 SER HA 98 ILE HB 5.66 
 &rst
  ixpk= 0, nxpk= 0, iat=1887,1900, r1= 1.30, r2= 1.80, r3= 5.66, r4= 6.16,  &end
#
# 97 SER HA 98 ILE H 3.50 
 &rst
  ixpk= 0, nxpk= 0, iat=1887,1896, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
# 97 SER HA 98 ILE QD1 5.15 
 &rst
  ixpk= 0, nxpk= 0, iat=1887,  -1, r1= 1.30, r2= 1.80, r3= 6.18, r4= 6.68,
 igr2=1909,1910,1911,
 &end
#
# 97 SER HA 98 ILE QG2 6.50 
 &rst
  ixpk= 0, nxpk= 0, iat=1887,  -1, r1= 1.30, r2= 1.80, r3= 7.81, r4= 8.31,
 igr2=1902,1903,1904,
 &end
#
# 97 SER HA 106 ILE H 5.50 
 &rst
  ixpk= 0, nxpk= 0, iat=1887,2012, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
# 97 SER HA 107 THR HA 3.00 
 &rst
  ixpk= 0, nxpk= 0, iat=1887,2033, r1= 1.30, r2= 1.80, r3= 3.00, r4= 3.50,  &end
#
# 97 SER HA 107 THR HB 5.30 
 &rst
  ixpk= 0, nxpk= 0, iat=1887,2035, r1= 1.30, r2= 1.80, r3= 5.30, r4= 5.80,  &end
#
# 97 SER HA 107 THR H 5.50 
 &rst
  ixpk= 0, nxpk= 0, iat=1887,2031, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
# 97 SER HA 108 ILE H 4.50 
 &rst
  ixpk= 0, nxpk= 0, iat=1887,2045, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
# 97 SER HB2 98 ILE H 5.00 
 &rst
  ixpk= 0, nxpk= 0, iat=1889,1896, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50,  &end
#
# 97 SER HB2 98 ILE QG2 6.50 
 &rst
  ixpk= 0, nxpk= 0, iat=1889,  -1, r1= 1.30, r2= 1.80, r3= 7.81, r4= 8.31,
 igr2=1902,1903,1904,
 &end
#
# 97 SER HB3 98 ILE H 5.00 
 &rst
  ixpk= 0, nxpk= 0, iat=1890,1896, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50,  &end
#
# 97 SER HB3 98 ILE QG2 6.50 
 &rst
  ixpk= 0, nxpk= 0, iat=1890,  -1, r1= 1.30, r2= 1.80, r3= 7.81, r4= 8.31,
 igr2=1902,1903,1904,
 &end
#
# 97 SER HB3 105 THR QG2 4.00 
 &rst
  ixpk= 0, nxpk= 0, iat=1890,  -1, r1= 1.30, r2= 1.80, r3= 4.80, r4= 5.30,
 igr2=2004,2005,2006,
 &end
#
# 97 SER H 98 ILE H 5.50 
 &rst
  ixpk= 0, nxpk= 0, iat=1885,1896, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
# 97 SER QB 107 THR HA 5.00 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,2033, r1= 1.30, r2= 1.80, r3= 5.61, r4= 6.11,
 igr1=1889,1890,
 &end
#
# 98 ILE HA 98 ILE HB 5.09 
 &rst
  ixpk= 0, nxpk= 0, iat=1898,1900, r1= 1.30, r2= 1.80, r3= 5.09, r4= 5.59,  &end
#
# 98 ILE HA 98 ILE HG13 5.29 
 &rst
  ixpk= 0, nxpk= 0, iat=1898,1907, r1= 1.30, r2= 1.80, r3= 5.29, r4= 5.79,  &end
#
# 98 ILE HA 98 ILE QD1 4.26 
 &rst
  ixpk= 0, nxpk= 0, iat=1898,  -1, r1= 1.30, r2= 1.80, r3= 5.12, r4= 5.62,
 igr2=1909,1910,1911,
 &end
#
# 98 ILE HA 99 ASN H 3.00 
 &rst
  ixpk= 0, nxpk= 0, iat=1898,1915, r1= 1.30, r2= 1.80, r3= 3.00, r4= 3.50,  &end
#
# 98 ILE HB 99 ASN H 4.53 
 &rst
  ixpk= 0, nxpk= 0, iat=1900,1915, r1= 1.30, r2= 1.80, r3= 4.53, r4= 5.03,  &end
#
# 98 ILE HB 106 ILE HA 5.55 
 &rst
  ixpk= 0, nxpk= 0, iat=1900,2014, r1= 1.30, r2= 1.80, r3= 5.55, r4= 6.05,  &end
#
# 98 ILE HB 106 ILE HB 4.42 
 &rst
  ixpk= 0, nxpk= 0, iat=1900,2016, r1= 1.30, r2= 1.80, r3= 4.42, r4= 4.92,  &end
#
# 98 ILE HB 106 ILE H 5.00 
 &rst
  ixpk= 0, nxpk= 0, iat=1900,2012, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50,  &end
#
# 98 ILE H 105 THR HA 5.00 
 &rst
  ixpk= 0, nxpk= 0, iat=1896,2000, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50,  &end
#
# 98 ILE H 106 ILE HB 5.00 
 &rst
  ixpk= 0, nxpk= 0, iat=1896,2016, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50,  &end
#
# 98 ILE H 106 ILE H 3.50 
 &rst
  ixpk= 0, nxpk= 0, iat=1896,2012, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
# 98 ILE H 108 ILE H 5.50 
 &rst
  ixpk= 0, nxpk= 0, iat=1896,2045, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
# 98 ILE H 105 THR HA 5.15 
 &rst
  ixpk= 0, nxpk= 0, iat=1896,2000, r1= 1.30, r2= 1.80, r3= 5.15, r4= 5.65,  &end
#
# 98 ILE QD1 99 ASN H 4.39 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1915, r1= 1.30, r2= 1.80, r3= 5.27, r4= 5.77,
 igr1=1909,1910,1911,
 &end
#
# 98 ILE QG2 99 ASN HA 4.59 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1917, r1= 1.30, r2= 1.80, r3= 5.51, r4= 6.01,
 igr1=1902,1903,1904,
 &end
#
# 98 ILE QG2 99 ASN HB2 4.68 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1919, r1= 1.30, r2= 1.80, r3= 5.62, r4= 6.12,
 igr1=1902,1903,1904,
 &end
#
# 98 ILE QG2 99 ASN H 3.50 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1915, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
 igr1=1902,1903,1904,
 &end
#
# 98 ILE QG2 100 ILE H 4.99 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1929, r1= 1.30, r2= 1.80, r3= 5.99, r4= 6.49,
 igr1=1902,1903,1904,
 &end
#
# 98 ILE QG2 106 ILE HB 4.14 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,2016, r1= 1.30, r2= 1.80, r3= 4.97, r4= 5.47,
 igr1=1902,1903,1904,
 &end
#
# 98 ILE QG2 106 ILE HG13 4.00 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,2023, r1= 1.30, r2= 1.80, r3= 4.80, r4= 5.30,
 igr1=1902,1903,1904,
 &end
#
# 98 ILE QG2 106 ILE H 4.71 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,2012, r1= 1.30, r2= 1.80, r3= 5.66, r4= 6.16,
 igr1=1902,1903,1904,
 &end
#
# 99 ASN HA 100 ILE H 2.80 
 &rst
  ixpk= 0, nxpk= 0, iat=1917,1929, r1= 1.30, r2= 1.80, r3= 2.80, r4= 3.30,  &end
#
# 99 ASN HA 105 THR QG2 4.00 
 &rst
  ixpk= 0, nxpk= 0, iat=1917,  -1, r1= 1.30, r2= 1.80, r3= 4.80, r4= 5.30,
 igr2=2004,2005,2006,
 &end
#
# 99 ASN HA 106 ILE H 5.04 
 &rst
  ixpk= 0, nxpk= 0, iat=1917,2012, r1= 1.30, r2= 1.80, r3= 5.04, r4= 5.54,  &end
#
# 99 ASN HB2 100 ILE H 5.00 
 &rst
  ixpk= 0, nxpk= 0, iat=1919,1929, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50,  &end
#
# 99 ASN HB3 100 ILE H 4.00 
 &rst
  ixpk= 0, nxpk= 0, iat=1920,1929, r1= 1.30, r2= 1.80, r3= 4.00, r4= 4.50,  &end
#
# 99 ASN HB3 105 THR HA 5.36 
 &rst
  ixpk= 0, nxpk= 0, iat=1920,2000, r1= 1.30, r2= 1.80, r3= 5.36, r4= 5.86,  &end
#
# 99 ASN HD21 100 ILE H 5.00 
 &rst
  ixpk= 0, nxpk= 0, iat=1925,1929, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50,  &end
#
# 99 ASN HD21 105 THR HA 5.50 
 &rst
  ixpk= 0, nxpk= 0, iat=1925,2000, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
# 99 ASN HD21 105 THR QG2 3.50 
 &rst
  ixpk= 0, nxpk= 0, iat=1925,  -1, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
 igr2=2004,2005,2006,
 &end
#
# 99 ASN HD21 106 ILE H 6.00 
 &rst
  ixpk= 0, nxpk= 0, iat=1925,2012, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,  &end
#
# 99 ASN HD22 105 THR HA 5.66 
 &rst
  ixpk= 0, nxpk= 0, iat=1924,2000, r1= 1.30, r2= 1.80, r3= 5.66, r4= 6.16,  &end
#
# 99 ASN HD22 105 THR QG2 3.50 
 &rst
  ixpk= 0, nxpk= 0, iat=1924,  -1, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
 igr2=2004,2005,2006,
 &end
#
# 99 ASN H 100 ILE H 5.00 
 &rst
  ixpk= 0, nxpk= 0, iat=1915,1929, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50,  &end
#
# 99 ASN H 106 ILE HG13 6.00 
 &rst
  ixpk= 0, nxpk= 0, iat=1915,2023, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,  &end
#
# 100 ILE HB 104 ILE HB 4.68 
 &rst
  ixpk= 0, nxpk= 0, iat=1933,1983, r1= 1.30, r2= 1.80, r3= 4.68, r4= 5.18,  &end
#
# 100 ILE HB 104 ILE QD1 3.20 
 &rst
  ixpk= 0, nxpk= 0, iat=1933,  -1, r1= 1.30, r2= 1.80, r3= 3.84, r4= 4.34,
 igr2=1992,1993,1994,
 &end
#
# 100 ILE HG12 104 ILE HB 5.50 
 &rst
  ixpk= 0, nxpk= 0, iat=1939,1983, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
# 100 ILE HG13 105 THR HA 4.78 
 &rst
  ixpk= 0, nxpk= 0, iat=1940,2000, r1= 1.30, r2= 1.80, r3= 4.78, r4= 5.28,  &end
#
# 100 ILE H 101 GLY H 5.00 
 &rst
  ixpk= 0, nxpk= 0, iat=1929,1948, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50,  &end
#
# 100 ILE H 104 ILE HB 5.00 
 &rst
  ixpk= 0, nxpk= 0, iat=1929,1983, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50,  &end
#
# 100 ILE H 104 ILE HB 5.50 
 &rst
  ixpk= 0, nxpk= 0, iat=1929,1983, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
# 100 ILE H 104 ILE H 4.50 
 &rst
  ixpk= 0, nxpk= 0, iat=1929,1979, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
# 100 ILE H 104 ILE QD1 5.50 
 &rst
  ixpk= 0, nxpk= 0, iat=1929,  -1, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr2=1992,1993,1994,
 &end
#
# 100 ILE H 104 ILE QG2 4.50 
 &rst
  ixpk= 0, nxpk= 0, iat=1929,  -1, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr2=1985,1986,1987,
 &end
#
# 100 ILE H 105 THR HA 4.00 
 &rst
  ixpk= 0, nxpk= 0, iat=1929,2000, r1= 1.30, r2= 1.80, r3= 4.00, r4= 4.50,  &end
#
# 100 ILE H 106 ILE H 5.00 
 &rst
  ixpk= 0, nxpk= 0, iat=1929,2012, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50,  &end
#
# 100 ILE QG2 101 GLY HA3 4.30 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1951, r1= 1.30, r2= 1.80, r3= 5.16, r4= 5.66,
 igr1=1935,1936,1937,
 &end
#
# 100 ILE QG2 101 GLY H 3.84 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1948, r1= 1.30, r2= 1.80, r3= 4.61, r4= 5.11,
 igr1=1935,1936,1937,
 &end
#
# 101 GLY HA3 102 ASP H 5.00 
 &rst
  ixpk= 0, nxpk= 0, iat=1951,1955, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50,  &end
#
# 101 GLY HA3 103 ASP H 5.00 
 &rst
  ixpk= 0, nxpk= 0, iat=1951,1967, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50,  &end
#
# 101 GLY HA3 104 ILE H 5.00 
 &rst
  ixpk= 0, nxpk= 0, iat=1951,1979, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50,  &end
#
# 101 GLY HA2 102 ASP H 5.00 
 &rst
  ixpk= 0, nxpk= 0, iat=1950,1955, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50,  &end
#
# 101 GLY HA2 103 ASP H 5.50 
 &rst
  ixpk= 0, nxpk= 0, iat=1950,1967, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
# 101 GLY HA2 104 ILE QD1 5.00 
 &rst
  ixpk= 0, nxpk= 0, iat=1950,  -1, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,
 igr2=1992,1993,1994,
 &end
#
# 102 ASP HA 103 ASP H 5.15 
 &rst
  ixpk= 0, nxpk= 0, iat=1957,1967, r1= 1.30, r2= 1.80, r3= 5.15, r4= 5.65,  &end
#
# 102 ASP HA 104 ILE H 5.36 
 &rst
  ixpk= 0, nxpk= 0, iat=1957,1979, r1= 1.30, r2= 1.80, r3= 5.36, r4= 5.86,  &end
#
# 102 ASP HB2 103 ASP H 5.50 
 &rst
  ixpk= 0, nxpk= 0, iat=1959,1967, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
# 102 ASP HB3 103 ASP H 5.50 
 &rst
  ixpk= 0, nxpk= 0, iat=1960,1967, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
# 102 ASP H 103 ASP H 5.00 
 &rst
  ixpk= 0, nxpk= 0, iat=1955,1967, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50,  &end
#
# 103 ASP HA 104 ILE H 5.00 
 &rst
  ixpk= 0, nxpk= 0, iat=1969,1979, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50,  &end
#
# 103 ASP HA 104 ILE QD1 4.47 
 &rst
  ixpk= 0, nxpk= 0, iat=1969,  -1, r1= 1.30, r2= 1.80, r3= 5.37, r4= 5.87,
 igr2=1992,1993,1994,
 &end
#
# 103 ASP HA 123 PRO HD3 5.29 
 &rst
  ixpk= 0, nxpk= 0, iat=1969,2269, r1= 1.30, r2= 1.80, r3= 5.29, r4= 5.79,  &end
#
# 103 ASP HA 123 PRO HG2 5.50 
 &rst
  ixpk= 0, nxpk= 0, iat=1969,2271, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
# 103 ASP HA 123 PRO HG3 4.59 
 &rst
  ixpk= 0, nxpk= 0, iat=1969,2272, r1= 1.30, r2= 1.80, r3= 4.59, r4= 5.09,  &end
#
# 103 ASP HB2 104 ILE HA 6.00 
 &rst
  ixpk= 0, nxpk= 0, iat=1971,1981, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,  &end
#
# 103 ASP HB2 104 ILE H 5.00 
 &rst
  ixpk= 0, nxpk= 0, iat=1971,1979, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50,  &end
#
# 103 ASP HB2 104 ILE QD1 4.33 
 &rst
  ixpk= 0, nxpk= 0, iat=1971,  -1, r1= 1.30, r2= 1.80, r3= 5.20, r4= 5.70,
 igr2=1992,1993,1994,
 &end
#
# 103 ASP HB2 122 ALA HA 5.30 
 &rst
  ixpk= 0, nxpk= 0, iat=1971,2259, r1= 1.30, r2= 1.80, r3= 5.30, r4= 5.80,  &end
#
# 103 ASP HB2 122 ALA QB 6.30 
 &rst
  ixpk= 0, nxpk= 0, iat=1971,  -1, r1= 1.30, r2= 1.80, r3= 7.57, r4= 8.07,
 igr2=2261,2262,2263,
 &end
#
# 103 ASP HB2 123 PRO HD2 4.68 
 &rst
  ixpk= 0, nxpk= 0, iat=1971,2268, r1= 1.30, r2= 1.80, r3= 4.68, r4= 5.18,  &end
#
# 103 ASP HB2 123 PRO HG2 4.36 
 &rst
  ixpk= 0, nxpk= 0, iat=1971,2271, r1= 1.30, r2= 1.80, r3= 4.36, r4= 4.86,  &end
#
# 103 ASP HB2 123 PRO HG3 4.20 
 &rst
  ixpk= 0, nxpk= 0, iat=1971,2272, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,  &end
#
# 103 ASP HB3 104 ILE HA 5.22 
 &rst
  ixpk= 0, nxpk= 0, iat=1972,1981, r1= 1.30, r2= 1.80, r3= 5.22, r4= 5.72,  &end
#
# 103 ASP HB3 104 ILE H 4.50 
 &rst
  ixpk= 0, nxpk= 0, iat=1972,1979, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
# 103 ASP HB3 104 ILE QD1 4.27 
 &rst
  ixpk= 0, nxpk= 0, iat=1972,  -1, r1= 1.30, r2= 1.80, r3= 5.13, r4= 5.63,
 igr2=1992,1993,1994,
 &end
#
# 103 ASP HB3 123 PRO HD2 4.54 
 &rst
  ixpk= 0, nxpk= 0, iat=1972,2268, r1= 1.30, r2= 1.80, r3= 4.54, r4= 5.04,  &end
#
# 103 ASP HB3 123 PRO HG2 4.27 
 &rst
  ixpk= 0, nxpk= 0, iat=1972,2271, r1= 1.30, r2= 1.80, r3= 4.27, r4= 4.77,  &end
#
# 103 ASP HB3 123 PRO HG3 4.14 
 &rst
  ixpk= 0, nxpk= 0, iat=1972,2272, r1= 1.30, r2= 1.80, r3= 4.14, r4= 4.64,  &end
#
# 103 ASP H 104 ILE H 3.00 
 &rst
  ixpk= 0, nxpk= 0, iat=1967,1979, r1= 1.30, r2= 1.80, r3= 3.00, r4= 3.50,  &end
#
# 103 ASP H 104 ILE QD1 6.00 
 &rst
  ixpk= 0, nxpk= 0, iat=1967,  -1, r1= 1.30, r2= 1.80, r3= 7.21, r4= 7.71,
 igr2=1992,1993,1994,
 &end
#
# 104 ILE HA 105 THR HB 5.09 
 &rst
  ixpk= 0, nxpk= 0, iat=1981,2002, r1= 1.30, r2= 1.80, r3= 5.09, r4= 5.59,  &end
#
# 104 ILE HA 105 THR H 3.00 
 &rst
  ixpk= 0, nxpk= 0, iat=1981,1998, r1= 1.30, r2= 1.80, r3= 3.00, r4= 3.50,  &end
#
# 104 ILE HA 122 ALA QB 4.54 
 &rst
  ixpk= 0, nxpk= 0, iat=1981,  -1, r1= 1.30, r2= 1.80, r3= 5.45, r4= 5.95,
 igr2=2261,2262,2263,
 &end
#
# 104 ILE HB 105 THR HA 5.36 
 &rst
  ixpk= 0, nxpk= 0, iat=1983,2000, r1= 1.30, r2= 1.80, r3= 5.36, r4= 5.86,  &end
#
# 104 ILE HB 105 THR H 4.99 
 &rst
  ixpk= 0, nxpk= 0, iat=1983,1998, r1= 1.30, r2= 1.80, r3= 4.99, r4= 5.49,  &end
#
# 104 ILE HB 122 ALA QB 4.99 
 &rst
  ixpk= 0, nxpk= 0, iat=1983,  -1, r1= 1.30, r2= 1.80, r3= 5.99, r4= 6.49,
 igr2=2261,2262,2263,
 &end
#
# 104 ILE HG12 105 THR H 5.66 
 &rst
  ixpk= 0, nxpk= 0, iat=1989,1998, r1= 1.30, r2= 1.80, r3= 5.66, r4= 6.16,  &end
#
# 104 ILE HG12 122 ALA HA 4.50 
 &rst
  ixpk= 0, nxpk= 0, iat=1989,2259, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
# 104 ILE HG12 122 ALA QB 5.00 
 &rst
  ixpk= 0, nxpk= 0, iat=1989,  -1, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,
 igr2=2261,2262,2263,
 &end
#
# 104 ILE H 105 THR H 5.00 
 &rst
  ixpk= 0, nxpk= 0, iat=1979,1998, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50,  &end
#
# 104 ILE H 122 ALA QB 5.36 
 &rst
  ixpk= 0, nxpk= 0, iat=1979,  -1, r1= 1.30, r2= 1.80, r3= 6.44, r4= 6.94,
 igr2=2261,2262,2263,
 &end
#
# 104 ILE QD1 105 THR H 5.00 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1998, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,
 igr1=1992,1993,1994,
 &end
#
# 104 ILE QD1 122 ALA HA 5.00 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,2259, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,
 igr1=1992,1993,1994,
 &end
#
# 104 ILE QD1 123 PRO HD2 5.50 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,2268, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr1=1992,1993,1994,
 &end
#
# 104 ILE QD1 123 PRO HD3 5.50 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,2269, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr1=1992,1993,1994,
 &end
#
# 104 ILE QG1 123 PRO HD2 5.50 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,2268, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=1989,1990,
 &end
#
# 104 ILE QG2 105 THR H 3.66 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1998, r1= 1.30, r2= 1.80, r3= 4.40, r4= 4.90,
 igr1=1985,1986,1987,
 &end
#
# 104 ILE QG2 121 ASN H 5.50 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,2243, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr1=1985,1986,1987,
 &end
#
# 104 ILE QG2 122 ALA HA 4.00 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,2259, r1= 1.30, r2= 1.80, r3= 4.80, r4= 5.30,
 igr1=1985,1986,1987,
 &end
#
# 104 ILE QG2 122 ALA QB 3.29 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.75, r4= 5.25,
 igr1=1985,1986,1987,
 igr2=2261,2262,2263,
 &end
#
# 104 ILE QG2 123 PRO HD2 5.00 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,2268, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,
 igr1=1985,1986,1987,
 &end
#
# 105 THR HA 106 ILE HB 5.15 
 &rst
  ixpk= 0, nxpk= 0, iat=2000,2016, r1= 1.30, r2= 1.80, r3= 5.15, r4= 5.65,  &end
#
# 105 THR HA 106 ILE H 4.00 
 &rst
  ixpk= 0, nxpk= 0, iat=2000,2012, r1= 1.30, r2= 1.80, r3= 4.00, r4= 4.50,  &end
#
# 105 THR HB 106 ILE H 4.00 
 &rst
  ixpk= 0, nxpk= 0, iat=2002,2012, r1= 1.30, r2= 1.80, r3= 4.00, r4= 4.50,  &end
#
# 105 THR HB 121 ASN HB2 4.13 
 &rst
  ixpk= 0, nxpk= 0, iat=2002,2247, r1= 1.30, r2= 1.80, r3= 4.13, r4= 4.63,  &end
#
# 105 THR HB 121 ASN HB3 4.01 
 &rst
  ixpk= 0, nxpk= 0, iat=2002,2248, r1= 1.30, r2= 1.80, r3= 4.01, r4= 4.51,  &end
#
# 105 THR HB 121 ASN H 5.93 
 &rst
  ixpk= 0, nxpk= 0, iat=2002,2243, r1= 1.30, r2= 1.80, r3= 5.93, r4= 6.43,  &end
#
# 105 THR H 106 ILE HA 5.50 
 &rst
  ixpk= 0, nxpk= 0, iat=1998,2014, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
# 105 THR H 121 ASN HB2 4.50 
 &rst
  ixpk= 0, nxpk= 0, iat=1998,2247, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
# 105 THR H 121 ASN HB3 4.50 
 &rst
  ixpk= 0, nxpk= 0, iat=1998,2248, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
# 105 THR H 122 ALA HA 6.00 
 &rst
  ixpk= 0, nxpk= 0, iat=1998,2259, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,  &end
#
# 105 THR QG2 106 ILE H 3.00 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,2012, r1= 1.30, r2= 1.80, r3= 3.60, r4= 4.10,
 igr1=2004,2005,2006,
 &end
#
# 105 THR QG2 121 ASN HB2 5.00 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,2247, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,
 igr1=2004,2005,2006,
 &end
#
# 105 THR QG2 121 ASN HB3 4.20 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,2248, r1= 1.30, r2= 1.80, r3= 5.04, r4= 5.54,
 igr1=2004,2005,2006,
 &end
#
# 106 ILE HA 106 ILE HB 5.50 
 &rst
  ixpk= 0, nxpk= 0, iat=2014,2016, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
# 106 ILE HA 106 ILE HG12 5.50 
 &rst
  ixpk= 0, nxpk= 0, iat=2014,2022, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
# 106 ILE HA 106 ILE HG13 5.50 
 &rst
  ixpk= 0, nxpk= 0, iat=2014,2023, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
# 106 ILE HA 106 ILE H 5.78 
 &rst
  ixpk= 0, nxpk= 0, iat=2014,2012, r1= 1.30, r2= 1.80, r3= 5.78, r4= 6.28,  &end
#
# 106 ILE HA 106 ILE QG2 2.50 
 &rst
  ixpk= 0, nxpk= 0, iat=2014,  -1, r1= 1.30, r2= 1.80, r3= 3.00, r4= 3.50,
 igr2=2018,2019,2020,
 &end
#
# 106 ILE HA 107 THR HB 5.00 
 &rst
  ixpk= 0, nxpk= 0, iat=2014,2035, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50,  &end
#
# 106 ILE HA 107 THR H 2.80 
 &rst
  ixpk= 0, nxpk= 0, iat=2014,2031, r1= 1.30, r2= 1.80, r3= 2.80, r4= 3.30,  &end
#
# 106 ILE HA 120 ILE HB 5.80 
 &rst
  ixpk= 0, nxpk= 0, iat=2014,2228, r1= 1.30, r2= 1.80, r3= 5.80, r4= 6.30,  &end
#
# 106 ILE HB 107 THR H 4.99 
 &rst
  ixpk= 0, nxpk= 0, iat=2016,2031, r1= 1.30, r2= 1.80, r3= 4.99, r4= 5.49,  &end
#
# 106 ILE HB 120 ILE HA 5.50 
 &rst
  ixpk= 0, nxpk= 0, iat=2016,2226, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
# 106 ILE HG12 107 THR H 5.04 
 &rst
  ixpk= 0, nxpk= 0, iat=2022,2031, r1= 1.30, r2= 1.80, r3= 5.04, r4= 5.54,  &end
#
# 106 ILE H 107 THR H 5.00 
 &rst
  ixpk= 0, nxpk= 0, iat=2012,2031, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50,  &end
#
# 106 ILE QD1 120 ILE HA 3.00 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,2226, r1= 1.30, r2= 1.80, r3= 3.60, r4= 4.10,
 igr1=2025,2026,2027,
 &end
#
# 106 ILE QG2 107 THR H 3.85 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,2031, r1= 1.30, r2= 1.80, r3= 4.62, r4= 5.12,
 igr1=2018,2019,2020,
 &end
#
# 106 ILE QG2 120 ILE HA 4.00 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,2226, r1= 1.30, r2= 1.80, r3= 4.80, r4= 5.30,
 igr1=2018,2019,2020,
 &end
#
# 107 THR HA 108 ILE H 3.50 
 &rst
  ixpk= 0, nxpk= 0, iat=2033,2045, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
# 107 THR HA 108 ILE QG2 4.54 
 &rst
  ixpk= 0, nxpk= 0, iat=2033,  -1, r1= 1.30, r2= 1.80, r3= 5.45, r4= 5.95,
 igr2=2051,2052,2053,
 &end
#
# 107 THR HB 107 THR H 4.86 
 &rst
  ixpk= 0, nxpk= 0, iat=2035,2031, r1= 1.30, r2= 1.80, r3= 4.86, r4= 5.36,  &end
#
# 107 THR HB 108 ILE HA 5.45 
 &rst
  ixpk= 0, nxpk= 0, iat=2035,2047, r1= 1.30, r2= 1.80, r3= 5.45, r4= 5.95,  &end
#
# 107 THR HB 109 LEU QD1 4.90 
 &rst
  ixpk= 0, nxpk= 0, iat=2035,  -1, r1= 1.30, r2= 1.80, r3= 5.88, r4= 6.38,
 igr2=2073,2074,2075,
 &end
#
# 107 THR HB 109 LEU QD2 4.00 
 &rst
  ixpk= 0, nxpk= 0, iat=2035,  -1, r1= 1.30, r2= 1.80, r3= 4.80, r4= 5.30,
 igr2=2077,2078,2079,
 &end
#
# 107 THR HB 119 GLY H 5.00 
 &rst
  ixpk= 0, nxpk= 0, iat=2035,2217, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50,  &end
#
# 107 THR H 108 ILE H 5.00 
 &rst
  ixpk= 0, nxpk= 0, iat=2031,2045, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50,  &end
#
# 107 THR H 118 ILE QG2 4.38 
 &rst
  ixpk= 0, nxpk= 0, iat=2031,  -1, r1= 1.30, r2= 1.80, r3= 5.26, r4= 5.76,
 igr2=2204,2205,2206,
 &end
#
# 107 THR H 119 GLY HA2 5.36 
 &rst
  ixpk= 0, nxpk= 0, iat=2031,2219, r1= 1.30, r2= 1.80, r3= 5.36, r4= 5.86,  &end
#
# 107 THR H 119 GLY H 4.00 
 &rst
  ixpk= 0, nxpk= 0, iat=2031,2217, r1= 1.30, r2= 1.80, r3= 4.00, r4= 4.50,  &end
#
# 107 THR H 121 ASN H 5.78 
 &rst
  ixpk= 0, nxpk= 0, iat=2031,2243, r1= 1.30, r2= 1.80, r3= 5.78, r4= 6.28,  &end
#
# 107 THR QG2 107 THR H 4.38 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,2031, r1= 1.30, r2= 1.80, r3= 5.26, r4= 5.76,
 igr1=2037,2038,2039,
 &end
#
# 107 THR QG2 109 LEU H 5.20 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,2064, r1= 1.30, r2= 1.80, r3= 6.24, r4= 6.74,
 igr1=2037,2038,2039,
 &end
#
# 107 THR QG2 109 LEU QD2 2.40 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 3.46, r4= 3.96,
 igr1=2037,2038,2039,
 igr2=2077,2078,2079,
 &end
#
# 108 ILE HA 109 LEU HB2 5.50 
 &rst
  ixpk= 0, nxpk= 0, iat=2047,2068, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
# 108 ILE HA 109 LEU H 3.00 
 &rst
  ixpk= 0, nxpk= 0, iat=2047,2064, r1= 1.30, r2= 1.80, r3= 3.00, r4= 3.50,  &end
#
# 108 ILE HA 110 GLY H 5.50 
 &rst
  ixpk= 0, nxpk= 0, iat=2047,2083, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
# 108 ILE HA 116 VAL QG1 4.13 
 &rst
  ixpk= 0, nxpk= 0, iat=2047,  -1, r1= 1.30, r2= 1.80, r3= 4.96, r4= 5.46,
 igr2=2164,2165,2166,
 &end
#
# 108 ILE HA 117 ARG HB3 6.00 
 &rst
  ixpk= 0, nxpk= 0, iat=2047,2179, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,  &end
#
# 108 ILE HA 118 ILE HA 5.00 
 &rst
  ixpk= 0, nxpk= 0, iat=2047,2200, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50,  &end
#
# 108 ILE HA 118 ILE HG12 5.80 
 &rst
  ixpk= 0, nxpk= 0, iat=2047,2208, r1= 1.30, r2= 1.80, r3= 5.80, r4= 6.30,  &end
#
# 108 ILE HA 118 ILE HG13 5.80 
 &rst
  ixpk= 0, nxpk= 0, iat=2047,2209, r1= 1.30, r2= 1.80, r3= 5.80, r4= 6.30,  &end
#
# 108 ILE HA 118 ILE QD1 4.50 
 &rst
  ixpk= 0, nxpk= 0, iat=2047,  -1, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr2=2211,2212,2213,
 &end
#
# 108 ILE HA 118 ILE QG2 5.00 
 &rst
  ixpk= 0, nxpk= 0, iat=2047,  -1, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,
 igr2=2204,2205,2206,
 &end
#
# 108 ILE HA 119 GLY H 5.00 
 &rst
  ixpk= 0, nxpk= 0, iat=2047,2217, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50,  &end
#
# 108 ILE HB 109 LEU H 5.50 
 &rst
  ixpk= 0, nxpk= 0, iat=2049,2064, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
# 108 ILE HB 116 VAL QG1 5.20 
 &rst
  ixpk= 0, nxpk= 0, iat=2049,  -1, r1= 1.30, r2= 1.80, r3= 6.24, r4= 6.74,
 igr2=2164,2165,2166,
 &end
#
# 108 ILE HB 118 ILE HA 5.50 
 &rst
  ixpk= 0, nxpk= 0, iat=2049,2200, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
# 108 ILE HB 118 ILE QD1 5.50 
 &rst
  ixpk= 0, nxpk= 0, iat=2049,  -1, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr2=2211,2212,2213,
 &end
#
# 108 ILE H 109 LEU H 5.50 
 &rst
  ixpk= 0, nxpk= 0, iat=2045,2064, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
# 108 ILE QD1 109 LEU QD2 4.78 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.89, r4= 7.39,
 igr1=2058,2059,2060,
 igr2=2077,2078,2079,
 &end
#
# 108 ILE QD1 110 GLY H 4.86 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,2083, r1= 1.30, r2= 1.80, r3= 5.84, r4= 6.34,
 igr1=2058,2059,2060,
 &end
#
# 108 ILE QD1 117 ARG H 5.20 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,2174, r1= 1.30, r2= 1.80, r3= 6.24, r4= 6.74,
 igr1=2058,2059,2060,
 &end
#
# 108 ILE QD1 118 ILE HA 3.50 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,2200, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
 igr1=2058,2059,2060,
 &end
#
# 108 ILE QG2 109 LEU H 5.20 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,2064, r1= 1.30, r2= 1.80, r3= 6.24, r4= 6.74,
 igr1=2051,2052,2053,
 &end
#
# 108 ILE QG2 110 GLY H 4.70 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,2083, r1= 1.30, r2= 1.80, r3= 5.64, r4= 6.14,
 igr1=2051,2052,2053,
 &end
#
# 109 LEU HG 119 GLY H 5.45 
 &rst
  ixpk= 0, nxpk= 0, iat=2071,2217, r1= 1.30, r2= 1.80, r3= 5.45, r4= 5.95,  &end
#
# 109 LEU H 109 LEU HB2 5.22 
 &rst
  ixpk= 0, nxpk= 0, iat=2064,2068, r1= 1.30, r2= 1.80, r3= 5.22, r4= 5.72,  &end
#
# 109 LEU H 109 LEU HB3 5.22 
 &rst
  ixpk= 0, nxpk= 0, iat=2064,2069, r1= 1.30, r2= 1.80, r3= 5.22, r4= 5.72,  &end
#
# 109 LEU H 110 GLY H 3.50 
 &rst
  ixpk= 0, nxpk= 0, iat=2064,2083, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
# 109 LEU H 117 ARG H 5.09 
 &rst
  ixpk= 0, nxpk= 0, iat=2064,2174, r1= 1.30, r2= 1.80, r3= 5.09, r4= 5.59,  &end
#
# 109 LEU H 119 GLY H 4.50 
 &rst
  ixpk= 0, nxpk= 0, iat=2064,2217, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
# 109 LEU H 109 LEU QD2 4.94 
 &rst
  ixpk= 0, nxpk= 0, iat=2064,  -1, r1= 1.30, r2= 1.80, r3= 5.93, r4= 6.43,
 igr2=2077,2078,2079,
 &end
#
# 109 LEU QD1 117 ARG HB2 4.65 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,2178, r1= 1.30, r2= 1.80, r3= 5.58, r4= 6.08,
 igr1=2073,2074,2075,
 &end
#
# 109 LEU QD1 117 ARG HB3 4.49 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,2179, r1= 1.30, r2= 1.80, r3= 5.39, r4= 5.89,
 igr1=2073,2074,2075,
 &end
#
# 109 LEU QD1 117 ARG HD2 5.15 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,2184, r1= 1.30, r2= 1.80, r3= 6.18, r4= 6.68,
 igr1=2073,2074,2075,
 &end
#
# 109 LEU QD1 117 ARG HE 6.35 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,2187, r1= 1.30, r2= 1.80, r3= 7.63, r4= 8.13,
 igr1=2073,2074,2075,
 &end
#
# 109 LEU QD1 119 GLY HA2 4.62 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,2219, r1= 1.30, r2= 1.80, r3= 5.55, r4= 6.05,
 igr1=2073,2074,2075,
 &end
#
# 109 LEU QD1 119 GLY HA3 4.65 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,2220, r1= 1.30, r2= 1.80, r3= 5.58, r4= 6.08,
 igr1=2073,2074,2075,
 &end
#
# 109 LEU QD1 119 GLY H 4.74 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,2217, r1= 1.30, r2= 1.80, r3= 5.69, r4= 6.19,
 igr1=2073,2074,2075,
 &end
#
# 109 LEU QD1 120 ILE H 5.55 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,2224, r1= 1.30, r2= 1.80, r3= 6.67, r4= 7.17,
 igr1=2073,2074,2075,
 &end
#
# 109 LEU QD2 110 GLY H 5.36 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,2083, r1= 1.30, r2= 1.80, r3= 6.44, r4= 6.94,
 igr1=2077,2078,2079,
 &end
#
# 109 LEU QD2 119 GLY HA2 5.04 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,2219, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55,
 igr1=2077,2078,2079,
 &end
#
# 109 LEU QD2 119 GLY HA3 5.15 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,2220, r1= 1.30, r2= 1.80, r3= 6.18, r4= 6.68,
 igr1=2077,2078,2079,
 &end
#
# 109 LEU QD2 119 GLY H 5.04 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,2217, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55,
 igr1=2077,2078,2079,
 &end
#
# 110 GLY HA2 117 ARG H 5.15 
 &rst
  ixpk= 0, nxpk= 0, iat=2085,2174, r1= 1.30, r2= 1.80, r3= 5.15, r4= 5.65,  &end
#
# 110 GLY HA3 111 VAL H 4.38 
 &rst
  ixpk= 0, nxpk= 0, iat=2086,2090, r1= 1.30, r2= 1.80, r3= 4.38, r4= 4.88,  &end
#
# 110 GLY HA3 117 ARG HB3 5.50 
 &rst
  ixpk= 0, nxpk= 0, iat=2086,2179, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
# 110 GLY HA3 117 ARG H 5.15 
 &rst
  ixpk= 0, nxpk= 0, iat=2086,2174, r1= 1.30, r2= 1.80, r3= 5.15, r4= 5.65,  &end
#
# 110 GLY H 111 VAL H 5.04 
 &rst
  ixpk= 0, nxpk= 0, iat=2083,2090, r1= 1.30, r2= 1.80, r3= 5.04, r4= 5.54,  &end
#
# 110 GLY H 111 VAL QG1 4.44 
 &rst
  ixpk= 0, nxpk= 0, iat=2083,  -1, r1= 1.30, r2= 1.80, r3= 5.33, r4= 5.83,
 igr2=2096,2097,2098,
 &end
#
# 110 GLY H 116 VAL QG1 4.24 
 &rst
  ixpk= 0, nxpk= 0, iat=2083,  -1, r1= 1.30, r2= 1.80, r3= 5.09, r4= 5.59,
 igr2=2164,2165,2166,
 &end
#
# 110 GLY H 117 ARG HD2 5.93 
 &rst
  ixpk= 0, nxpk= 0, iat=2083,2184, r1= 1.30, r2= 1.80, r3= 5.93, r4= 6.43,  &end
#
# 110 GLY H 117 ARG H 4.00 
 &rst
  ixpk= 0, nxpk= 0, iat=2083,2174, r1= 1.30, r2= 1.80, r3= 4.00, r4= 4.50,  &end
#
# 110 GLY H 116 VAL QG1 4.71 
 &rst
  ixpk= 0, nxpk= 0, iat=2083,  -1, r1= 1.30, r2= 1.80, r3= 5.66, r4= 6.16,
 igr2=2164,2165,2166,
 &end
#
# 111 VAL HA 112 SER H 2.80 
 &rst
  ixpk= 0, nxpk= 0, iat=2092,2106, r1= 1.30, r2= 1.80, r3= 2.80, r4= 3.30,  &end
#
# 111 VAL HB 112 SER H 4.49 
 &rst
  ixpk= 0, nxpk= 0, iat=2094,2106, r1= 1.30, r2= 1.80, r3= 4.49, r4= 4.99,  &end
#
# 111 VAL H 116 VAL QG1 5.50 
 &rst
  ixpk= 0, nxpk= 0, iat=2090,  -1, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr2=2164,2165,2166,
 &end
#
# 111 VAL H 116 VAL QG2 5.50 
 &rst
  ixpk= 0, nxpk= 0, iat=2090,  -1, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr2=2168,2169,2170,
 &end
#
# 111 VAL H 117 ARG H 5.50 
 &rst
  ixpk= 0, nxpk= 0, iat=2090,2174, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
# 111 VAL QG1 113 GLY H 5.00 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,2117, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,
 igr1=2096,2097,2098,
 &end
#
# 111 VAL QG2 112 SER HB2 5.15 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,2110, r1= 1.30, r2= 1.80, r3= 6.18, r4= 6.68,
 igr1=2100,2101,2102,
 &end
#
# 111 VAL QG2 112 SER HB3 5.29 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,2111, r1= 1.30, r2= 1.80, r3= 6.35, r4= 6.85,
 igr1=2100,2101,2102,
 &end
#
# 111 VAL QG2 112 SER H 3.69 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,2106, r1= 1.30, r2= 1.80, r3= 4.43, r4= 4.93,
 igr1=2100,2101,2102,
 &end
#
# 111 VAL QG2 113 GLY HA3 5.29 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,2120, r1= 1.30, r2= 1.80, r3= 6.35, r4= 6.85,
 igr1=2100,2101,2102,
 &end
#
# 111 VAL QG2 113 GLY H 5.55 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,2117, r1= 1.30, r2= 1.80, r3= 6.67, r4= 7.17,
 igr1=2100,2101,2102,
 &end
#
# 111 VAL QG2 114 GLN HE21 6.00 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,2137, r1= 1.30, r2= 1.80, r3= 7.21, r4= 7.71,
 igr1=2100,2101,2102,
 &end
#
# 111 VAL QG2 114 GLN HE22 5.09 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,2136, r1= 1.30, r2= 1.80, r3= 6.11, r4= 6.61,
 igr1=2100,2101,2102,
 &end
#
# 111 VAL QG2 114 GLN H 6.35 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,2124, r1= 1.30, r2= 1.80, r3= 7.63, r4= 8.13,
 igr1=2100,2101,2102,
 &end
#
# 111 VAL QG2 115 GLN H 5.15 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,2141, r1= 1.30, r2= 1.80, r3= 6.18, r4= 6.68,
 igr1=2100,2101,2102,
 &end
#
# 112 SER HA 113 GLY H 3.00 
 &rst
  ixpk= 0, nxpk= 0, iat=2108,2117, r1= 1.30, r2= 1.80, r3= 3.00, r4= 3.50,  &end
#
# 112 SER HB2 115 GLN HB2 6.00 
 &rst
  ixpk= 0, nxpk= 0, iat=2110,2145, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,  &end
#
# 112 SER HB2 115 GLN HB3 6.00 
 &rst
  ixpk= 0, nxpk= 0, iat=2110,2146, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,  &end
#
# 112 SER HB3 113 GLY H 5.50 
 &rst
  ixpk= 0, nxpk= 0, iat=2111,2117, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
# 112 SER HB3 115 GLN HB3 5.36 
 &rst
  ixpk= 0, nxpk= 0, iat=2111,2146, r1= 1.30, r2= 1.80, r3= 5.36, r4= 5.86,  &end
#
# 112 SER H 113 GLY H 5.50 
 &rst
  ixpk= 0, nxpk= 0, iat=2106,2117, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
# 112 SER H 115 GLN H 5.00 
 &rst
  ixpk= 0, nxpk= 0, iat=2106,2141, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50,  &end
#
# 113 GLY HA2 114 GLN H 4.30 
 &rst
  ixpk= 0, nxpk= 0, iat=2119,2124, r1= 1.30, r2= 1.80, r3= 4.30, r4= 4.80,  &end
#
# 113 GLY HA3 114 GLN HA 5.09 
 &rst
  ixpk= 0, nxpk= 0, iat=2120,2126, r1= 1.30, r2= 1.80, r3= 5.09, r4= 5.59,  &end
#
# 113 GLY HA3 114 GLN HB3 5.45 
 &rst
  ixpk= 0, nxpk= 0, iat=2120,2129, r1= 1.30, r2= 1.80, r3= 5.45, r4= 5.95,  &end
#
# 113 GLY HA3 114 GLN H 4.00 
 &rst
  ixpk= 0, nxpk= 0, iat=2120,2124, r1= 1.30, r2= 1.80, r3= 4.00, r4= 4.50,  &end
#
# 113 GLY HA3 115 GLN HG3 5.29 
 &rst
  ixpk= 0, nxpk= 0, iat=2120,2149, r1= 1.30, r2= 1.80, r3= 5.29, r4= 5.79,  &end
#
# 113 GLY HA3 115 GLN H 5.45 
 &rst
  ixpk= 0, nxpk= 0, iat=2120,2141, r1= 1.30, r2= 1.80, r3= 5.45, r4= 5.95,  &end
#
# 113 GLY H 115 GLN H 5.50 
 &rst
  ixpk= 0, nxpk= 0, iat=2117,2141, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
# 114 GLN HA 115 GLN H 3.80 
 &rst
  ixpk= 0, nxpk= 0, iat=2126,2141, r1= 1.30, r2= 1.80, r3= 3.80, r4= 4.30,  &end
#
# 114 GLN HB2 115 GLN H 5.55 
 &rst
  ixpk= 0, nxpk= 0, iat=2128,2141, r1= 1.30, r2= 1.80, r3= 5.55, r4= 6.05,  &end
#
# 114 GLN HB3 114 GLN HE21 5.09 
 &rst
  ixpk= 0, nxpk= 0, iat=2129,2137, r1= 1.30, r2= 1.80, r3= 5.09, r4= 5.59,  &end
#
# 114 GLN HB3 114 GLN HE22 5.29 
 &rst
  ixpk= 0, nxpk= 0, iat=2129,2136, r1= 1.30, r2= 1.80, r3= 5.29, r4= 5.79,  &end
#
# 114 GLN HB3 114 GLN H 5.93 
 &rst
  ixpk= 0, nxpk= 0, iat=2129,2124, r1= 1.30, r2= 1.80, r3= 5.93, r4= 6.43,  &end
#
# 114 GLN HB3 115 GLN H 4.86 
 &rst
  ixpk= 0, nxpk= 0, iat=2129,2141, r1= 1.30, r2= 1.80, r3= 4.86, r4= 5.36,  &end
#
# 114 GLN HE21 114 GLN HB3 5.45 
 &rst
  ixpk= 0, nxpk= 0, iat=2137,2129, r1= 1.30, r2= 1.80, r3= 5.45, r4= 5.95,  &end
#
# 114 GLN H 114 GLN HB3 5.04 
 &rst
  ixpk= 0, nxpk= 0, iat=2124,2129, r1= 1.30, r2= 1.80, r3= 5.04, r4= 5.54,  &end
#
# 114 GLN H 115 GLN HB3 5.45 
 &rst
  ixpk= 0, nxpk= 0, iat=2124,2146, r1= 1.30, r2= 1.80, r3= 5.45, r4= 5.95,  &end
#
# 114 GLN H 115 GLN H 3.00 
 &rst
  ixpk= 0, nxpk= 0, iat=2124,2141, r1= 1.30, r2= 1.80, r3= 3.00, r4= 3.50,  &end
#
# 114 GLN QG 114 GLN H 5.29 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,2124, r1= 1.30, r2= 1.80, r3= 5.94, r4= 6.44,
 igr1=2131,2132,
 &end
#
# 114 GLN QG 115 GLN H 5.00 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,2141, r1= 1.30, r2= 1.80, r3= 5.61, r4= 6.11,
 igr1=2131,2132,
 &end
#
# 115 GLN HA 116 VAL H 2.80 
 &rst
  ixpk= 0, nxpk= 0, iat=2143,2158, r1= 1.30, r2= 1.80, r3= 2.80, r4= 3.30,  &end
#
# 115 GLN HG2 116 VAL H 4.82 
 &rst
  ixpk= 0, nxpk= 0, iat=2148,2158, r1= 1.30, r2= 1.80, r3= 4.82, r4= 5.32,  &end
#
# 115 GLN HG3 116 VAL H 5.29 
 &rst
  ixpk= 0, nxpk= 0, iat=2149,2158, r1= 1.30, r2= 1.80, r3= 5.29, r4= 5.79,  &end
#
# 115 GLN H 115 GLN HB2 5.04 
 &rst
  ixpk= 0, nxpk= 0, iat=2141,2145, r1= 1.30, r2= 1.80, r3= 5.04, r4= 5.54,  &end
#
# 115 GLN H 115 GLN HG2 5.50 
 &rst
  ixpk= 0, nxpk= 0, iat=2141,2148, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
# 115 GLN H 116 VAL H 5.00 
 &rst
  ixpk= 0, nxpk= 0, iat=2141,2158, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50,  &end
#
# 116 VAL HB 117 ARG H 4.78 
 &rst
  ixpk= 0, nxpk= 0, iat=2162,2174, r1= 1.30, r2= 1.80, r3= 4.78, r4= 5.28,  &end
#
# 116 VAL H 117 ARG H 5.00 
 &rst
  ixpk= 0, nxpk= 0, iat=2158,2174, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50,  &end
#
# 116 VAL QG1 117 ARG H 3.70 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,2174, r1= 1.30, r2= 1.80, r3= 4.44, r4= 4.94,
 igr1=2164,2165,2166,
 &end
#
# 116 VAL QG1 118 ILE H 6.00 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,2198, r1= 1.30, r2= 1.80, r3= 7.21, r4= 7.71,
 igr1=2164,2165,2166,
 &end
#
# 116 VAL QG2 117 ARG H 4.50 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,2174, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr1=2168,2169,2170,
 &end
#
# 117 ARG HA 118 ILE H 3.00 
 &rst
  ixpk= 0, nxpk= 0, iat=2176,2198, r1= 1.30, r2= 1.80, r3= 3.00, r4= 3.50,  &end
#
# 117 ARG HB3 118 ILE H 5.09 
 &rst
  ixpk= 0, nxpk= 0, iat=2179,2198, r1= 1.30, r2= 1.80, r3= 5.09, r4= 5.59,  &end
#
# 117 ARG HD2 118 ILE H 5.45 
 &rst
  ixpk= 0, nxpk= 0, iat=2184,2198, r1= 1.30, r2= 1.80, r3= 5.45, r4= 5.95,  &end
#
# 117 ARG HE 117 ARG HD2 5.36 
 &rst
  ixpk= 0, nxpk= 0, iat=2187,2184, r1= 1.30, r2= 1.80, r3= 5.36, r4= 5.86,  &end
#
# 117 ARG H 118 ILE HG12 4.94 
 &rst
  ixpk= 0, nxpk= 0, iat=2174,2208, r1= 1.30, r2= 1.80, r3= 4.94, r4= 5.44,  &end
#
# 117 ARG H 118 ILE H 5.00 
 &rst
  ixpk= 0, nxpk= 0, iat=2174,2198, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50,  &end
#
# 118 ILE HA 118 ILE QG2 3.00 
 &rst
  ixpk= 0, nxpk= 0, iat=2200,  -1, r1= 1.30, r2= 1.80, r3= 3.60, r4= 4.10,
 igr2=2204,2205,2206,
 &end
#
# 118 ILE HG12 119 GLY H 5.20 
 &rst
  ixpk= 0, nxpk= 0, iat=2208,2217, r1= 1.30, r2= 1.80, r3= 5.20, r4= 5.70,  &end
#
# 118 ILE H 119 GLY H 4.93 
 &rst
  ixpk= 0, nxpk= 0, iat=2198,2217, r1= 1.30, r2= 1.80, r3= 4.93, r4= 5.43,  &end
#
# 118 ILE QG2 119 GLY H 4.05 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,2217, r1= 1.30, r2= 1.80, r3= 4.86, r4= 5.36,
 igr1=2204,2205,2206,
 &end
#
# 119 GLY HA2 120 ILE H 4.00 
 &rst
  ixpk= 0, nxpk= 0, iat=2219,2224, r1= 1.30, r2= 1.80, r3= 4.00, r4= 4.50,  &end
#
# 119 GLY HA2 120 ILE QD1 5.04 
 &rst
  ixpk= 0, nxpk= 0, iat=2219,  -1, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55,
 igr2=2237,2238,2239,
 &end
#
# 119 GLY HA3 120 ILE HG12 5.50 
 &rst
  ixpk= 0, nxpk= 0, iat=2220,2234, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
# 119 GLY HA3 120 ILE HG13 5.36 
 &rst
  ixpk= 0, nxpk= 0, iat=2220,2235, r1= 1.30, r2= 1.80, r3= 5.36, r4= 5.86,  &end
#
# 119 GLY HA3 120 ILE H 5.09 
 &rst
  ixpk= 0, nxpk= 0, iat=2220,2224, r1= 1.30, r2= 1.80, r3= 5.09, r4= 5.59,  &end
#
# 120 ILE HA 121 ASN HA 4.86 
 &rst
  ixpk= 0, nxpk= 0, iat=2226,2245, r1= 1.30, r2= 1.80, r3= 4.86, r4= 5.36,  &end
#
# 120 ILE HA 121 ASN HB2 4.56 
 &rst
  ixpk= 0, nxpk= 0, iat=2226,2247, r1= 1.30, r2= 1.80, r3= 4.56, r4= 5.06,  &end
#
# 120 ILE HA 121 ASN HB3 4.42 
 &rst
  ixpk= 0, nxpk= 0, iat=2226,2248, r1= 1.30, r2= 1.80, r3= 4.42, r4= 4.92,  &end
#
# 120 ILE HA 121 ASN H 3.50 
 &rst
  ixpk= 0, nxpk= 0, iat=2226,2243, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
# 120 ILE HB 120 ILE H 5.15 
 &rst
  ixpk= 0, nxpk= 0, iat=2228,2224, r1= 1.30, r2= 1.80, r3= 5.15, r4= 5.65,  &end
#
# 120 ILE HB 121 ASN H 5.29 
 &rst
  ixpk= 0, nxpk= 0, iat=2228,2243, r1= 1.30, r2= 1.80, r3= 5.29, r4= 5.79,  &end
#
# 120 ILE HB 122 ALA H 5.15 
 &rst
  ixpk= 0, nxpk= 0, iat=2228,2257, r1= 1.30, r2= 1.80, r3= 5.15, r4= 5.65,  &end
#
# 120 ILE HB 128 VAL QG2 5.00 
 &rst
  ixpk= 0, nxpk= 0, iat=2228,  -1, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,
 igr2=2351,2352,2353,
 &end
#
# 120 ILE HG12 121 ASN H 4.90 
 &rst
  ixpk= 0, nxpk= 0, iat=2234,2243, r1= 1.30, r2= 1.80, r3= 4.90, r4= 5.40,  &end
#
# 120 ILE HG13 121 ASN H 4.90 
 &rst
  ixpk= 0, nxpk= 0, iat=2235,2243, r1= 1.30, r2= 1.80, r3= 4.90, r4= 5.40,  &end
#
# 120 ILE H 122 ALA H 5.93 
 &rst
  ixpk= 0, nxpk= 0, iat=2224,2257, r1= 1.30, r2= 1.80, r3= 5.93, r4= 6.43,  &end
#
# 120 ILE QD1 121 ASN H 6.00 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,2243, r1= 1.30, r2= 1.80, r3= 7.21, r4= 7.71,
 igr1=2237,2238,2239,
 &end
#
# 120 ILE QD1 128 VAL HA 4.47 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,2343, r1= 1.30, r2= 1.80, r3= 5.37, r4= 5.87,
 igr1=2237,2238,2239,
 &end
#
# 120 ILE QG2 121 ASN HA 4.23 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,2245, r1= 1.30, r2= 1.80, r3= 5.08, r4= 5.58,
 igr1=2230,2231,2232,
 &end
#
# 120 ILE QG2 121 ASN HB2 5.50 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,2247, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr1=2230,2231,2232,
 &end
#
# 120 ILE QG2 121 ASN HB3 5.50 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,2248, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr1=2230,2231,2232,
 &end
#
# 120 ILE QG2 121 ASN H 3.93 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,2243, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,
 igr1=2230,2231,2232,
 &end
#
# 121 ASN HA 122 ALA H 2.80 
 &rst
  ixpk= 0, nxpk= 0, iat=2245,2257, r1= 1.30, r2= 1.80, r3= 2.80, r4= 3.30,  &end
#
# 121 ASN HA 122 ALA QB 4.44 
 &rst
  ixpk= 0, nxpk= 0, iat=2245,  -1, r1= 1.30, r2= 1.80, r3= 5.33, r4= 5.83,
 igr2=2261,2262,2263,
 &end
#
# 121 ASN HB2 121 ASN HD22 4.74 
 &rst
  ixpk= 0, nxpk= 0, iat=2247,2252, r1= 1.30, r2= 1.80, r3= 4.74, r4= 5.24,  &end
#
# 121 ASN HB2 122 ALA H 4.50 
 &rst
  ixpk= 0, nxpk= 0, iat=2247,2257, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
# 121 ASN HB3 121 ASN HD22 4.82 
 &rst
  ixpk= 0, nxpk= 0, iat=2248,2252, r1= 1.30, r2= 1.80, r3= 4.82, r4= 5.32,  &end
#
# 121 ASN HB3 122 ALA H 4.50 
 &rst
  ixpk= 0, nxpk= 0, iat=2248,2257, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
# 121 ASN H 122 ALA H 4.68 
 &rst
  ixpk= 0, nxpk= 0, iat=2243,2257, r1= 1.30, r2= 1.80, r3= 4.68, r4= 5.18,  &end
#
# 121 ASN H 122 ALA QB 4.27 
 &rst
  ixpk= 0, nxpk= 0, iat=2243,  -1, r1= 1.30, r2= 1.80, r3= 5.13, r4= 5.63,
 igr2=2261,2262,2263,
 &end
#
# 121 ASN H 128 VAL QG1 4.90 
 &rst
  ixpk= 0, nxpk= 0, iat=2243,  -1, r1= 1.30, r2= 1.80, r3= 5.88, r4= 6.38,
 igr2=2347,2348,2349,
 &end
#
# 122 ALA HA 122 ALA QB 3.52 
 &rst
  ixpk= 0, nxpk= 0, iat=2259,  -1, r1= 1.30, r2= 1.80, r3= 4.23, r4= 4.73,
 igr2=2261,2262,2263,
 &end
#
# 122 ALA HA 123 PRO HB2 5.60 
 &rst
  ixpk= 0, nxpk= 0, iat=2259,2274, r1= 1.30, r2= 1.80, r3= 5.60, r4= 6.10,  &end
#
# 122 ALA HA 123 PRO HD2 4.00 
 &rst
  ixpk= 0, nxpk= 0, iat=2259,2268, r1= 1.30, r2= 1.80, r3= 4.00, r4= 4.50,  &end
#
# 122 ALA HA 123 PRO HD3 4.00 
 &rst
  ixpk= 0, nxpk= 0, iat=2259,2269, r1= 1.30, r2= 1.80, r3= 4.00, r4= 4.50,  &end
#
# 122 ALA HA 123 PRO HG2 4.86 
 &rst
  ixpk= 0, nxpk= 0, iat=2259,2271, r1= 1.30, r2= 1.80, r3= 4.86, r4= 5.36,  &end
#
# 122 ALA HA 123 PRO HG3 5.04 
 &rst
  ixpk= 0, nxpk= 0, iat=2259,2272, r1= 1.30, r2= 1.80, r3= 5.04, r4= 5.54,  &end
#
# 122 ALA HA 126 VAL QG1 5.50 
 &rst
  ixpk= 0, nxpk= 0, iat=2259,  -1, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr2=2321,2322,2323,
 &end
#
# 122 ALA H 123 PRO HA 5.50 
 &rst
  ixpk= 0, nxpk= 0, iat=2257,2277, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
# 122 ALA H 123 PRO HD2 5.00 
 &rst
  ixpk= 0, nxpk= 0, iat=2257,2268, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50,  &end
#
# 122 ALA H 123 PRO HD3 5.15 
 &rst
  ixpk= 0, nxpk= 0, iat=2257,2269, r1= 1.30, r2= 1.80, r3= 5.15, r4= 5.65,  &end
#
# 122 ALA QB 123 PRO HA 4.38 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,2277, r1= 1.30, r2= 1.80, r3= 5.26, r4= 5.76,
 igr1=2261,2262,2263,
 &end
#
# 122 ALA QB 123 PRO HB2 4.86 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,2274, r1= 1.30, r2= 1.80, r3= 5.84, r4= 6.34,
 igr1=2261,2262,2263,
 &end
#
# 122 ALA QB 123 PRO HD2 3.85 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,2268, r1= 1.30, r2= 1.80, r3= 4.62, r4= 5.12,
 igr1=2261,2262,2263,
 &end
#
# 122 ALA QB 123 PRO HD3 3.96 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,2269, r1= 1.30, r2= 1.80, r3= 4.76, r4= 5.26,
 igr1=2261,2262,2263,
 &end
#
# 122 ALA QB 123 PRO HG2 4.71 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,2271, r1= 1.30, r2= 1.80, r3= 5.66, r4= 6.16,
 igr1=2261,2262,2263,
 &end
#
# 122 ALA QB 123 PRO HG3 4.62 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,2272, r1= 1.30, r2= 1.80, r3= 5.55, r4= 6.05,
 igr1=2261,2262,2263,
 &end
#
# 122 ALA QB 124 LYS HA 5.22 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,2283, r1= 1.30, r2= 1.80, r3= 6.27, r4= 6.77,
 igr1=2261,2262,2263,
 &end
#
# 122 ALA QB 125 ASP H 5.78 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,2303, r1= 1.30, r2= 1.80, r3= 6.94, r4= 7.44,
 igr1=2261,2262,2263,
 &end
#
# 122 ALA QB 126 VAL HB 4.17 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,2319, r1= 1.30, r2= 1.80, r3= 5.01, r4= 5.51,
 igr1=2261,2262,2263,
 &end
#
# 122 ALA QB 126 VAL H 4.86 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,2315, r1= 1.30, r2= 1.80, r3= 5.84, r4= 6.34,
 igr1=2261,2262,2263,
 &end
#
# 122 ALA QB 126 VAL QG2 3.43 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.95, r4= 5.45,
 igr1=2261,2262,2263,
 igr2=2325,2326,2327,
 &end
#
# 122 ALA QB 128 VAL QG2 4.50 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.49, r4= 6.99,
 igr1=2261,2262,2263,
 igr2=2351,2352,2353,
 &end
#
# 123 PRO HA 124 LYS HD2 6.00 
 &rst
  ixpk= 0, nxpk= 0, iat=2277,2291, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,  &end
#
# 123 PRO HA 124 LYS HD3 5.60 
 &rst
  ixpk= 0, nxpk= 0, iat=2277,2292, r1= 1.30, r2= 1.80, r3= 5.60, r4= 6.10,  &end
#
# 123 PRO HA 124 LYS H 3.50 
 &rst
  ixpk= 0, nxpk= 0, iat=2277,2281, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
# 123 PRO HB2 124 LYS H 5.45 
 &rst
  ixpk= 0, nxpk= 0, iat=2274,2281, r1= 1.30, r2= 1.80, r3= 5.45, r4= 5.95,  &end
#
# 123 PRO HB2 126 VAL QG1 4.11 
 &rst
  ixpk= 0, nxpk= 0, iat=2274,  -1, r1= 1.30, r2= 1.80, r3= 4.94, r4= 5.44,
 igr2=2321,2322,2323,
 &end
#
# 123 PRO HD2 126 VAL H 5.00 
 &rst
  ixpk= 0, nxpk= 0, iat=2268,2315, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50,  &end
#
# 123 PRO HD2 126 VAL QG1 5.00 
 &rst
  ixpk= 0, nxpk= 0, iat=2268,  -1, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,
 igr2=2321,2322,2323,
 &end
#
# 123 PRO HD2 126 VAL QG2 6.00 
 &rst
  ixpk= 0, nxpk= 0, iat=2268,  -1, r1= 1.30, r2= 1.80, r3= 7.21, r4= 7.71,
 igr2=2325,2326,2327,
 &end
#
# 123 PRO HD3 125 ASP HB2 5.50 
 &rst
  ixpk= 0, nxpk= 0, iat=2269,2307, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
# 123 PRO HD3 125 ASP H 5.36 
 &rst
  ixpk= 0, nxpk= 0, iat=2269,2303, r1= 1.30, r2= 1.80, r3= 5.36, r4= 5.86,  &end
#
# 123 PRO HD3 126 VAL QG1 5.00 
 &rst
  ixpk= 0, nxpk= 0, iat=2269,  -1, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,
 igr2=2321,2322,2323,
 &end
#
# 123 PRO HG2 125 ASP H 5.22 
 &rst
  ixpk= 0, nxpk= 0, iat=2271,2303, r1= 1.30, r2= 1.80, r3= 5.22, r4= 5.72,  &end
#
# 123 PRO HG2 126 VAL QG1 4.20 
 &rst
  ixpk= 0, nxpk= 0, iat=2271,  -1, r1= 1.30, r2= 1.80, r3= 5.04, r4= 5.54,
 igr2=2321,2322,2323,
 &end
#
# 123 PRO HG2 126 VAL QG2 4.44 
 &rst
  ixpk= 0, nxpk= 0, iat=2271,  -1, r1= 1.30, r2= 1.80, r3= 5.33, r4= 5.83,
 igr2=2325,2326,2327,
 &end
#
# 123 PRO HG3 125 ASP HB2 4.90 
 &rst
  ixpk= 0, nxpk= 0, iat=2272,2307, r1= 1.30, r2= 1.80, r3= 4.90, r4= 5.40,  &end
#
# 123 PRO HG3 125 ASP HB3 4.49 
 &rst
  ixpk= 0, nxpk= 0, iat=2272,2308, r1= 1.30, r2= 1.80, r3= 4.49, r4= 4.99,  &end
#
# 123 PRO HG3 126 VAL QG1 4.50 
 &rst
  ixpk= 0, nxpk= 0, iat=2272,  -1, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr2=2321,2322,2323,
 &end
#
# 123 PRO HG3 126 VAL QG2 5.50 
 &rst
  ixpk= 0, nxpk= 0, iat=2272,  -1, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr2=2325,2326,2327,
 &end
#
# 124 LYS HA 125 ASP HB2 5.36 
 &rst
  ixpk= 0, nxpk= 0, iat=2283,2307, r1= 1.30, r2= 1.80, r3= 5.36, r4= 5.86,  &end
#
# 124 LYS HA 125 ASP H 4.00 
 &rst
  ixpk= 0, nxpk= 0, iat=2283,2303, r1= 1.30, r2= 1.80, r3= 4.00, r4= 4.50,  &end
#
# 124 LYS HA 126 VAL QG2 5.22 
 &rst
  ixpk= 0, nxpk= 0, iat=2283,  -1, r1= 1.30, r2= 1.80, r3= 6.27, r4= 6.77,
 igr2=2325,2326,2327,
 &end
#
# 124 LYS HB2 125 ASP HB2 6.00 
 &rst
  ixpk= 0, nxpk= 0, iat=2285,2307, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,  &end
#
# 124 LYS HD2 125 ASP H 6.00 
 &rst
  ixpk= 0, nxpk= 0, iat=2291,2303, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,  &end
#
# 124 LYS HD3 125 ASP H 6.00 
 &rst
  ixpk= 0, nxpk= 0, iat=2292,2303, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,  &end
#
# 124 LYS HG2 125 ASP H 5.20 
 &rst
  ixpk= 0, nxpk= 0, iat=2288,2303, r1= 1.30, r2= 1.80, r3= 5.20, r4= 5.70,  &end
#
# 124 LYS H 125 ASP H 5.00 
 &rst
  ixpk= 0, nxpk= 0, iat=2281,2303, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50,  &end
#
# 124 LYS H 124 LYS HD3 5.15 
 &rst
  ixpk= 0, nxpk= 0, iat=2281,2292, r1= 1.30, r2= 1.80, r3= 5.15, r4= 5.65,  &end
#
# 125 ASP HA 126 VAL H 3.50 
 &rst
  ixpk= 0, nxpk= 0, iat=2305,2315, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
# 125 ASP HB2 126 VAL H 4.50 
 &rst
  ixpk= 0, nxpk= 0, iat=2307,2315, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
# 125 ASP HB2 126 VAL QG1 4.00 
 &rst
  ixpk= 0, nxpk= 0, iat=2307,  -1, r1= 1.30, r2= 1.80, r3= 4.80, r4= 5.30,
 igr2=2321,2322,2323,
 &end
#
# 125 ASP HB2 126 VAL QG2 5.00 
 &rst
  ixpk= 0, nxpk= 0, iat=2307,  -1, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,
 igr2=2325,2326,2327,
 &end
#
# 125 ASP HB3 126 VAL H 5.00 
 &rst
  ixpk= 0, nxpk= 0, iat=2308,2315, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50,  &end
#
# 125 ASP HB3 126 VAL QG1 3.80 
 &rst
  ixpk= 0, nxpk= 0, iat=2308,  -1, r1= 1.30, r2= 1.80, r3= 4.56, r4= 5.06,
 igr2=2321,2322,2323,
 &end
#
# 125 ASP HB3 126 VAL QG2 4.70 
 &rst
  ixpk= 0, nxpk= 0, iat=2308,  -1, r1= 1.30, r2= 1.80, r3= 5.64, r4= 6.14,
 igr2=2325,2326,2327,
 &end
#
# 125 ASP H 126 VAL HA 5.70 
 &rst
  ixpk= 0, nxpk= 0, iat=2303,2317, r1= 1.30, r2= 1.80, r3= 5.70, r4= 6.20,  &end
#
# 125 ASP H 126 VAL H 3.50 
 &rst
  ixpk= 0, nxpk= 0, iat=2303,2315, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
# 125 ASP H 126 VAL QG1 4.00 
 &rst
  ixpk= 0, nxpk= 0, iat=2303,  -1, r1= 1.30, r2= 1.80, r3= 4.80, r4= 5.30,
 igr2=2321,2322,2323,
 &end
#
# 125 ASP H 126 VAL QG2 5.00 
 &rst
  ixpk= 0, nxpk= 0, iat=2303,  -1, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,
 igr2=2325,2326,2327,
 &end
#
# 125 ASP H 126 VAL QG2 4.78 
 &rst
  ixpk= 0, nxpk= 0, iat=2303,  -1, r1= 1.30, r2= 1.80, r3= 5.74, r4= 6.24,
 igr2=2325,2326,2327,
 &end
#
# 126 VAL HA 127 ALA HA 5.50 
 &rst
  ixpk= 0, nxpk= 0, iat=2317,2333, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
# 126 VAL HA 127 ALA H 2.80 
 &rst
  ixpk= 0, nxpk= 0, iat=2317,2331, r1= 1.30, r2= 1.80, r3= 2.80, r4= 3.30,  &end
#
# 126 VAL HA 127 ALA QB 4.05 
 &rst
  ixpk= 0, nxpk= 0, iat=2317,  -1, r1= 1.30, r2= 1.80, r3= 4.86, r4= 5.36,
 igr2=2335,2336,2337,
 &end
#
# 126 VAL HB 127 ALA H 5.00 
 &rst
  ixpk= 0, nxpk= 0, iat=2319,2331, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50,  &end
#
# 126 VAL HB 128 VAL QG1 5.50 
 &rst
  ixpk= 0, nxpk= 0, iat=2319,  -1, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr2=2347,2348,2349,
 &end
#
# 126 VAL H 127 ALA H 5.00 
 &rst
  ixpk= 0, nxpk= 0, iat=2315,2331, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50,  &end
#
# 126 VAL QG1 127 ALA H 4.31 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,2331, r1= 1.30, r2= 1.80, r3= 5.18, r4= 5.68,
 igr1=2321,2322,2323,
 &end
#
# 126 VAL QG2 127 ALA HA 3.85 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,2333, r1= 1.30, r2= 1.80, r3= 4.62, r4= 5.12,
 igr1=2325,2326,2327,
 &end
#
# 126 VAL QG2 127 ALA H 4.18 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,2331, r1= 1.30, r2= 1.80, r3= 5.02, r4= 5.52,
 igr1=2325,2326,2327,
 &end
#
# 126 VAL QG2 127 ALA QB 5.00 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.21, r4= 7.71,
 igr1=2325,2326,2327,
 igr2=2335,2336,2337,
 &end
#
# 127 ALA HA 127 ALA QB 3.32 
 &rst
  ixpk= 0, nxpk= 0, iat=2333,  -1, r1= 1.30, r2= 1.80, r3= 3.99, r4= 4.49,
 igr2=2335,2336,2337,
 &end
#
# 127 ALA HA 128 VAL H 3.00 
 &rst
  ixpk= 0, nxpk= 0, iat=2333,2341, r1= 1.30, r2= 1.80, r3= 3.00, r4= 3.50,  &end
#
# 127 ALA HA 128 VAL QG1 5.00 
 &rst
  ixpk= 0, nxpk= 0, iat=2333,  -1, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,
 igr2=2347,2348,2349,
 &end
#
# 127 ALA H 128 VAL H 5.00 
 &rst
  ixpk= 0, nxpk= 0, iat=2331,2341, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50,  &end
#
# 127 ALA QB 128 VAL H 3.73 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,2341, r1= 1.30, r2= 1.80, r3= 4.48, r4= 4.98,
 igr1=2335,2336,2337,
 &end
#
# 127 ALA QB 129 HIS HD2 4.15 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,2370, r1= 1.30, r2= 1.80, r3= 4.98, r4= 5.48,
 igr1=2335,2336,2337,
 &end
#
# 127 ALA QB 129 HIS HE1 3.85 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,2366, r1= 1.30, r2= 1.80, r3= 4.62, r4= 5.12,
 igr1=2335,2336,2337,
 &end
#
# 127 ALA QB 129 HIS H 4.90 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,2357, r1= 1.30, r2= 1.80, r3= 5.88, r4= 6.38,
 igr1=2335,2336,2337,
 &end
#
# 127 ALA QB 134 TYR QD 5.00 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.74, r4= 7.24,
 igr1=2335,2336,2337,
 igr2=2455,2464,
 &end
#
# 127 ALA QB 134 TYR QE 4.51 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.08, r4= 6.58,
 igr1=2335,2336,2337,
 igr2=2457,2462,
 &end
#
# 128 VAL HA 129 HIS HB2 5.78 
 &rst
  ixpk= 0, nxpk= 0, iat=2343,2361, r1= 1.30, r2= 1.80, r3= 5.78, r4= 6.28,  &end
#
# 128 VAL HA 129 HIS H 3.50 
 &rst
  ixpk= 0, nxpk= 0, iat=2343,2357, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
# 128 VAL HB 129 HIS H 5.78 
 &rst
  ixpk= 0, nxpk= 0, iat=2345,2357, r1= 1.30, r2= 1.80, r3= 5.78, r4= 6.28,  &end
#
# 128 VAL H 129 HIS HD2 5.01 
 &rst
  ixpk= 0, nxpk= 0, iat=2341,2370, r1= 1.30, r2= 1.80, r3= 5.01, r4= 5.51,  &end
#
# 128 VAL H 129 HIS H 5.66 
 &rst
  ixpk= 0, nxpk= 0, iat=2341,2357, r1= 1.30, r2= 1.80, r3= 5.66, r4= 6.16,  &end
#
# 128 VAL QG1 129 HIS H 5.00 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,2357, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,
 igr1=2347,2348,2349,
 &end
#
# 128 VAL QG2 129 HIS HA 4.30 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,2359, r1= 1.30, r2= 1.80, r3= 5.16, r4= 5.66,
 igr1=2351,2352,2353,
 &end
#
# 128 VAL QG2 129 HIS H 4.36 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,2357, r1= 1.30, r2= 1.80, r3= 5.24, r4= 5.74,
 igr1=2351,2352,2353,
 &end
#
# 129 HIS HB2 133 ILE HB 5.45 
 &rst
  ixpk= 0, nxpk= 0, iat=2361,2432, r1= 1.30, r2= 1.80, r3= 5.45, r4= 5.95,  &end
#
# 129 HIS HB2 133 ILE HG13 5.66 
 &rst
  ixpk= 0, nxpk= 0, iat=2361,2439, r1= 1.30, r2= 1.80, r3= 5.66, r4= 6.16,  &end
#
# 129 HIS HB2 133 ILE H 5.78 
 &rst
  ixpk= 0, nxpk= 0, iat=2361,2428, r1= 1.30, r2= 1.80, r3= 5.78, r4= 6.28,  &end
#
# 129 HIS HB2 133 ILE QD1 4.74 
 &rst
  ixpk= 0, nxpk= 0, iat=2361,  -1, r1= 1.30, r2= 1.80, r3= 5.69, r4= 6.19,
 igr2=2441,2442,2443,
 &end
#
# 129 HIS HB2 133 ILE QD1 5.29 
 &rst
  ixpk= 0, nxpk= 0, iat=2361,  -1, r1= 1.30, r2= 1.80, r3= 6.35, r4= 6.85,
 igr2=2441,2442,2443,
 &end
#
# 129 HIS HB2 133 ILE QG2 5.00 
 &rst
  ixpk= 0, nxpk= 0, iat=2361,  -1, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,
 igr2=2434,2435,2436,
 &end
#
# 129 HIS HB2 134 TYR HA 5.55 
 &rst
  ixpk= 0, nxpk= 0, iat=2361,2449, r1= 1.30, r2= 1.80, r3= 5.55, r4= 6.05,  &end
#
# 129 HIS HB2 134 TYR HB3 5.55 
 &rst
  ixpk= 0, nxpk= 0, iat=2361,2452, r1= 1.30, r2= 1.80, r3= 5.55, r4= 6.05,  &end
#
# 129 HIS HB2 134 TYR H 5.78 
 &rst
  ixpk= 0, nxpk= 0, iat=2361,2447, r1= 1.30, r2= 1.80, r3= 5.78, r4= 6.28,  &end
#
# 129 HIS HB2 134 TYR QD 5.29 
 &rst
  ixpk= 0, nxpk= 0, iat=2361,  -1, r1= 1.30, r2= 1.80, r3= 5.94, r4= 6.44,
 igr2=2455,2464,
 &end
#
# 129 HIS HB2 137 ILE QD1 5.55 
 &rst
  ixpk= 0, nxpk= 0, iat=2361,  -1, r1= 1.30, r2= 1.80, r3= 6.67, r4= 7.17,
 igr2=2522,2523,2524,
 &end
#
# 129 HIS HB3 137 ILE QD1 5.78 
 &rst
  ixpk= 0, nxpk= 0, iat=2362,  -1, r1= 1.30, r2= 1.80, r3= 6.94, r4= 7.44,
 igr2=2522,2523,2524,
 &end
#
# 129 HIS HD2 129 HIS HB3 4.37 
 &rst
  ixpk= 0, nxpk= 0, iat=2370,2362, r1= 1.30, r2= 1.80, r3= 4.37, r4= 4.87,  &end
#
# 129 HIS HD2 134 TYR HA 4.37 
 &rst
  ixpk= 0, nxpk= 0, iat=2370,2449, r1= 1.30, r2= 1.80, r3= 4.37, r4= 4.87,  &end
#
# 129 HIS HD2 137 ILE QD1 4.37 
 &rst
  ixpk= 0, nxpk= 0, iat=2370,  -1, r1= 1.30, r2= 1.80, r3= 5.25, r4= 5.75,
 igr2=2522,2523,2524,
 &end
#
# 129 HIS HD2 137 ILE QG2 4.51 
 &rst
  ixpk= 0, nxpk= 0, iat=2370,  -1, r1= 1.30, r2= 1.80, r3= 5.42, r4= 5.92,
 igr2=2515,2516,2517,
 &end
#
# 129 HIS HE1 137 ILE QD1 3.99 
 &rst
  ixpk= 0, nxpk= 0, iat=2366,  -1, r1= 1.30, r2= 1.80, r3= 4.79, r4= 5.29,
 igr2=2522,2523,2524,
 &end
#
# 129 HIS HE1 137 ILE QG2 5.50 
 &rst
  ixpk= 0, nxpk= 0, iat=2366,  -1, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr2=2515,2516,2517,
 &end
#
# 129 HIS H 130 ARG HA 5.55 
 &rst
  ixpk= 0, nxpk= 0, iat=2357,2376, r1= 1.30, r2= 1.80, r3= 5.55, r4= 6.05,  &end
#
# 130 ARG HA 131 GLU H 3.50 
 &rst
  ixpk= 0, nxpk= 0, iat=2376,2398, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
# 130 ARG HA 132 GLU H 5.78 
 &rst
  ixpk= 0, nxpk= 0, iat=2376,2413, r1= 1.30, r2= 1.80, r3= 5.78, r4= 6.28,  &end
#
# 131 GLU HA 134 TYR HA 5.55 
 &rst
  ixpk= 0, nxpk= 0, iat=2400,2449, r1= 1.30, r2= 1.80, r3= 5.55, r4= 6.05,  &end
#
# 131 GLU HA 134 TYR HB2 5.04 
 &rst
  ixpk= 0, nxpk= 0, iat=2400,2451, r1= 1.30, r2= 1.80, r3= 5.04, r4= 5.54,  &end
#
# 131 GLU HA 134 TYR HB3 4.99 
 &rst
  ixpk= 0, nxpk= 0, iat=2400,2452, r1= 1.30, r2= 1.80, r3= 4.99, r4= 5.49,  &end
#
# 131 GLU HA 134 TYR H 5.22 
 &rst
  ixpk= 0, nxpk= 0, iat=2400,2447, r1= 1.30, r2= 1.80, r3= 5.22, r4= 5.72,  &end
#
# 131 GLU HA 134 TYR QD 3.99 
 &rst
  ixpk= 0, nxpk= 0, iat=2400,  -1, r1= 1.30, r2= 1.80, r3= 4.48, r4= 4.98,
 igr2=2455,2464,
 &end
#
# 131 GLU HA 134 TYR QE 5.50 
 &rst
  ixpk= 0, nxpk= 0, iat=2400,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=2457,2462,
 &end
#
# 131 GLU HG2 132 GLU H 4.78 
 &rst
  ixpk= 0, nxpk= 0, iat=2405,2413, r1= 1.30, r2= 1.80, r3= 4.78, r4= 5.28,  &end
#
# 131 GLU HG2 134 TYR HB2 5.09 
 &rst
  ixpk= 0, nxpk= 0, iat=2405,2451, r1= 1.30, r2= 1.80, r3= 5.09, r4= 5.59,  &end
#
# 131 GLU HG2 134 TYR H 6.00 
 &rst
  ixpk= 0, nxpk= 0, iat=2405,2447, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,  &end
#
# 131 GLU HG3 132 GLU H 5.50 
 &rst
  ixpk= 0, nxpk= 0, iat=2406,2413, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
# 131 GLU H 132 GLU H 5.00 
 &rst
  ixpk= 0, nxpk= 0, iat=2398,2413, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50,  &end
#
# 131 GLU H 134 TYR HB2 5.55 
 &rst
  ixpk= 0, nxpk= 0, iat=2398,2451, r1= 1.30, r2= 1.80, r3= 5.55, r4= 6.05,  &end
#
# 131 GLU QB 132 GLU H 5.50 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,2413, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=2402,2403,
 &end
#
# 131 GLU QB 134 TYR H 5.36 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,2447, r1= 1.30, r2= 1.80, r3= 6.02, r4= 6.52,
 igr1=2402,2403,
 &end
#
# 132 GLU HA 133 ILE H 5.09 
 &rst
  ixpk= 0, nxpk= 0, iat=2415,2428, r1= 1.30, r2= 1.80, r3= 5.09, r4= 5.59,  &end
#
# 132 GLU HA 133 ILE QD1 4.99 
 &rst
  ixpk= 0, nxpk= 0, iat=2415,  -1, r1= 1.30, r2= 1.80, r3= 5.99, r4= 6.49,
 igr2=2441,2442,2443,
 &end
#
# 132 GLU HA 135 GLN HB2 5.00 
 &rst
  ixpk= 0, nxpk= 0, iat=2415,2472, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50,  &end
#
# 132 GLU HA 135 GLN HG2 5.50 
 &rst
  ixpk= 0, nxpk= 0, iat=2415,2475, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
# 132 GLU HA 135 GLN HG3 4.78 
 &rst
  ixpk= 0, nxpk= 0, iat=2415,2476, r1= 1.30, r2= 1.80, r3= 4.78, r4= 5.28,  &end
#
# 132 GLU HA 135 GLN H 5.09 
 &rst
  ixpk= 0, nxpk= 0, iat=2415,2468, r1= 1.30, r2= 1.80, r3= 5.09, r4= 5.59,  &end
#
# 132 GLU HB2 133 ILE H 5.00 
 &rst
  ixpk= 0, nxpk= 0, iat=2417,2428, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50,  &end
#
# 132 GLU HB2 133 ILE QD1 4.03 
 &rst
  ixpk= 0, nxpk= 0, iat=2417,  -1, r1= 1.30, r2= 1.80, r3= 4.84, r4= 5.34,
 igr2=2441,2442,2443,
 &end
#
# 132 GLU HB3 133 ILE H 5.50 
 &rst
  ixpk= 0, nxpk= 0, iat=2418,2428, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
# 132 GLU HB3 133 ILE QD1 5.00 
 &rst
  ixpk= 0, nxpk= 0, iat=2418,  -1, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,
 igr2=2441,2442,2443,
 &end
#
# 132 GLU HG2 133 ILE H 4.90 
 &rst
  ixpk= 0, nxpk= 0, iat=2420,2428, r1= 1.30, r2= 1.80, r3= 4.90, r4= 5.40,  &end
#
# 132 GLU HG2 133 ILE QD1 5.09 
 &rst
  ixpk= 0, nxpk= 0, iat=2420,  -1, r1= 1.30, r2= 1.80, r3= 6.11, r4= 6.61,
 igr2=2441,2442,2443,
 &end
#
# 132 GLU HG3 133 ILE QD1 4.65 
 &rst
  ixpk= 0, nxpk= 0, iat=2421,  -1, r1= 1.30, r2= 1.80, r3= 5.58, r4= 6.08,
 igr2=2441,2442,2443,
 &end
#
# 132 GLU H 133 ILE HB 5.00 
 &rst
  ixpk= 0, nxpk= 0, iat=2413,2432, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50,  &end
#
# 132 GLU H 133 ILE H 4.50 
 &rst
  ixpk= 0, nxpk= 0, iat=2413,2428, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
# 132 GLU H 133 ILE QD1 5.36 
 &rst
  ixpk= 0, nxpk= 0, iat=2413,  -1, r1= 1.30, r2= 1.80, r3= 6.44, r4= 6.94,
 igr2=2441,2442,2443,
 &end
#
# 132 GLU H 134 TYR H 5.50 
 &rst
  ixpk= 0, nxpk= 0, iat=2413,2447, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
# 133 ILE HA 134 TYR HB2 6.00 
 &rst
  ixpk= 0, nxpk= 0, iat=2430,2451, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,  &end
#
# 133 ILE HA 134 TYR H 5.66 
 &rst
  ixpk= 0, nxpk= 0, iat=2430,2447, r1= 1.30, r2= 1.80, r3= 5.66, r4= 6.16,  &end
#
# 133 ILE HA 136 ARG HB2 4.94 
 &rst
  ixpk= 0, nxpk= 0, iat=2430,2489, r1= 1.30, r2= 1.80, r3= 4.94, r4= 5.44,  &end
#
# 133 ILE HA 136 ARG HD2 5.55 
 &rst
  ixpk= 0, nxpk= 0, iat=2430,2495, r1= 1.30, r2= 1.80, r3= 5.55, r4= 6.05,  &end
#
# 133 ILE HA 136 ARG HD3 4.71 
 &rst
  ixpk= 0, nxpk= 0, iat=2430,2496, r1= 1.30, r2= 1.80, r3= 4.71, r4= 5.21,  &end
#
# 133 ILE HB 134 TYR HB2 5.36 
 &rst
  ixpk= 0, nxpk= 0, iat=2432,2451, r1= 1.30, r2= 1.80, r3= 5.36, r4= 5.86,  &end
#
# 133 ILE HB 134 TYR H 4.00 
 &rst
  ixpk= 0, nxpk= 0, iat=2432,2447, r1= 1.30, r2= 1.80, r3= 4.00, r4= 4.50,  &end
#
# 133 ILE HB 136 ARG H 6.00 
 &rst
  ixpk= 0, nxpk= 0, iat=2432,2485, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,  &end
#
# 133 ILE H 134 TYR HB2 5.36 
 &rst
  ixpk= 0, nxpk= 0, iat=2428,2451, r1= 1.30, r2= 1.80, r3= 5.36, r4= 5.86,  &end
#
# 133 ILE H 134 TYR HB3 5.45 
 &rst
  ixpk= 0, nxpk= 0, iat=2428,2452, r1= 1.30, r2= 1.80, r3= 5.45, r4= 5.95,  &end
#
# 133 ILE H 134 TYR H 3.50 
 &rst
  ixpk= 0, nxpk= 0, iat=2428,2447, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
# 133 ILE H 135 GLN H 6.12 
 &rst
  ixpk= 0, nxpk= 0, iat=2428,2468, r1= 1.30, r2= 1.80, r3= 6.12, r4= 6.62,  &end
#
# 133 ILE H 137 ILE QD1 5.66 
 &rst
  ixpk= 0, nxpk= 0, iat=2428,  -1, r1= 1.30, r2= 1.80, r3= 6.80, r4= 7.30,
 igr2=2522,2523,2524,
 &end
#
# 133 ILE QD1 134 TYR H 5.09 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,2447, r1= 1.30, r2= 1.80, r3= 6.11, r4= 6.61,
 igr1=2441,2442,2443,
 &end
#
# 133 ILE QD1 135 GLN H 5.45 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,2468, r1= 1.30, r2= 1.80, r3= 6.55, r4= 7.05,
 igr1=2441,2442,2443,
 &end
#
# 133 ILE QD1 136 ARG HD2 4.70 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,2495, r1= 1.30, r2= 1.80, r3= 5.64, r4= 6.14,
 igr1=2441,2442,2443,
 &end
#
# 133 ILE QD1 136 ARG HD3 4.33 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,2496, r1= 1.30, r2= 1.80, r3= 5.20, r4= 5.70,
 igr1=2441,2442,2443,
 &end
#
# 133 ILE QG2 136 ARG HB2 4.27 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,2489, r1= 1.30, r2= 1.80, r3= 5.13, r4= 5.63,
 igr1=2434,2435,2436,
 &end
#
# 133 ILE QG2 136 ARG H 4.94 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,2485, r1= 1.30, r2= 1.80, r3= 5.93, r4= 6.43,
 igr1=2434,2435,2436,
 &end
#
# 134 TYR HA 135 GLN H 5.36 
 &rst
  ixpk= 0, nxpk= 0, iat=2449,2468, r1= 1.30, r2= 1.80, r3= 5.36, r4= 5.86,  &end
#
# 134 TYR HA 136 ARG H 5.09 
 &rst
  ixpk= 0, nxpk= 0, iat=2449,2485, r1= 1.30, r2= 1.80, r3= 5.09, r4= 5.59,  &end
#
# 134 TYR HA 137 ILE HB 3.35 
 &rst
  ixpk= 0, nxpk= 0, iat=2449,2513, r1= 1.30, r2= 1.80, r3= 3.35, r4= 3.85,  &end
#
# 134 TYR HA 137 ILE HG12 5.04 
 &rst
  ixpk= 0, nxpk= 0, iat=2449,2519, r1= 1.30, r2= 1.80, r3= 5.04, r4= 5.54,  &end
#
# 134 TYR HA 137 ILE H 4.31 
 &rst
  ixpk= 0, nxpk= 0, iat=2449,2509, r1= 1.30, r2= 1.80, r3= 4.31, r4= 4.81,  &end
#
# 134 TYR HA 137 ILE QD1 4.54 
 &rst
  ixpk= 0, nxpk= 0, iat=2449,  -1, r1= 1.30, r2= 1.80, r3= 5.45, r4= 5.95,
 igr2=2522,2523,2524,
 &end
#
# 134 TYR HA 137 ILE QG2 5.50 
 &rst
  ixpk= 0, nxpk= 0, iat=2449,  -1, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr2=2515,2516,2517,
 &end
#
# 134 TYR HB2 135 GLN HG3 4.94 
 &rst
  ixpk= 0, nxpk= 0, iat=2451,2476, r1= 1.30, r2= 1.80, r3= 4.94, r4= 5.44,  &end
#
# 134 TYR HB2 135 GLN H 5.00 
 &rst
  ixpk= 0, nxpk= 0, iat=2451,2468, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50,  &end
#
# 134 TYR HB3 135 GLN H 5.29 
 &rst
  ixpk= 0, nxpk= 0, iat=2452,2468, r1= 1.30, r2= 1.80, r3= 5.29, r4= 5.79,  &end
#
# 134 TYR HB3 137 ILE QD1 5.55 
 &rst
  ixpk= 0, nxpk= 0, iat=2452,  -1, r1= 1.30, r2= 1.80, r3= 6.67, r4= 7.17,
 igr2=2522,2523,2524,
 &end
#
# 134 TYR HB3 138 GLN HG2 6.00 
 &rst
  ixpk= 0, nxpk= 0, iat=2452,2535, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,  &end
#
# 134 TYR H 134 TYR HA 5.09 
 &rst
  ixpk= 0, nxpk= 0, iat=2447,2449, r1= 1.30, r2= 1.80, r3= 5.09, r4= 5.59,  &end
#
# 134 TYR H 135 GLN HG3 5.15 
 &rst
  ixpk= 0, nxpk= 0, iat=2447,2476, r1= 1.30, r2= 1.80, r3= 5.15, r4= 5.65,  &end
#
# 134 TYR H 135 GLN H 4.00 
 &rst
  ixpk= 0, nxpk= 0, iat=2447,2468, r1= 1.30, r2= 1.80, r3= 4.00, r4= 4.50,  &end
#
# 134 TYR H 136 ARG H 5.55 
 &rst
  ixpk= 0, nxpk= 0, iat=2447,2485, r1= 1.30, r2= 1.80, r3= 5.55, r4= 6.05,  &end
#
# 134 TYR H 137 ILE HB 5.93 
 &rst
  ixpk= 0, nxpk= 0, iat=2447,2513, r1= 1.30, r2= 1.80, r3= 5.93, r4= 6.43,  &end
#
# 134 TYR H 137 ILE QD1 5.78 
 &rst
  ixpk= 0, nxpk= 0, iat=2447,  -1, r1= 1.30, r2= 1.80, r3= 6.94, r4= 7.44,
 igr2=2522,2523,2524,
 &end
#
# 134 TYR QD 135 GLN HA 4.12 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,2470, r1= 1.30, r2= 1.80, r3= 4.62, r4= 5.12,
 igr1=2455,2464,
 &end
#
# 134 TYR QD 135 GLN HG2 4.59 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,2475, r1= 1.30, r2= 1.80, r3= 5.15, r4= 5.65,
 igr1=2455,2464,
 &end
#
# 134 TYR QD 135 GLN HG3 4.12 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,2476, r1= 1.30, r2= 1.80, r3= 4.62, r4= 5.12,
 igr1=2455,2464,
 &end
#
# 134 TYR QD 137 ILE HB 4.85 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,2513, r1= 1.30, r2= 1.80, r3= 5.44, r4= 5.94,
 igr1=2455,2464,
 &end
#
# 134 TYR QD 137 ILE QD1 4.46 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.01, r4= 6.51,
 igr1=2455,2464,
 igr2=2522,2523,2524,
 &end
#
# 134 TYR QD 137 ILE QG2 4.29 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.78, r4= 6.28,
 igr1=2455,2464,
 igr2=2515,2516,2517,
 &end
#
# 134 TYR QD 138 GLN HB3 5.70 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,2533, r1= 1.30, r2= 1.80, r3= 6.40, r4= 6.90,
 igr1=2455,2464,
 &end
#
# 134 TYR QD 138 GLN HE22 5.15 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,2540, r1= 1.30, r2= 1.80, r3= 5.78, r4= 6.28,
 igr1=2455,2464,
 &end
#
# 134 TYR QD 138 GLN HG2 4.86 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,2535, r1= 1.30, r2= 1.80, r3= 5.46, r4= 5.96,
 igr1=2455,2464,
 &end
#
# 134 TYR QE 134 TYR HA 5.09 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,2449, r1= 1.30, r2= 1.80, r3= 5.71, r4= 6.21,
 igr1=2457,2462,
 &end
#
# 134 TYR QE 135 GLN HA 4.50 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,2470, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1=2457,2462,
 &end
#
# 134 TYR QE 135 GLN HG3 5.00 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,2476, r1= 1.30, r2= 1.80, r3= 5.61, r4= 6.11,
 igr1=2457,2462,
 &end
#
# 134 TYR QE 137 ILE HB 4.85 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,2513, r1= 1.30, r2= 1.80, r3= 5.44, r4= 5.94,
 igr1=2457,2462,
 &end
#
# 134 TYR QE 137 ILE QD1 5.50 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1=2457,2462,
 igr2=2522,2523,2524,
 &end
#
# 134 TYR QE 137 ILE QG2 4.37 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.89, r4= 6.39,
 igr1=2457,2462,
 igr2=2515,2516,2517,
 &end
#
# 134 TYR QE 138 GLN HB2 5.04 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,2532, r1= 1.30, r2= 1.80, r3= 5.66, r4= 6.16,
 igr1=2457,2462,
 &end
#
# 134 TYR QE 138 GLN HB3 4.41 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,2533, r1= 1.30, r2= 1.80, r3= 4.95, r4= 5.45,
 igr1=2457,2462,
 &end
#
# 134 TYR QE 138 GLN HG2 4.00 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,2535, r1= 1.30, r2= 1.80, r3= 4.49, r4= 4.99,
 igr1=2457,2462,
 &end
#
# 135 GLN HA 136 ARG H 4.59 
 &rst
  ixpk= 0, nxpk= 0, iat=2470,2485, r1= 1.30, r2= 1.80, r3= 4.59, r4= 5.09,  &end
#
# 135 GLN HA 139 ALA QB 4.86 
 &rst
  ixpk= 0, nxpk= 0, iat=2470,  -1, r1= 1.30, r2= 1.80, r3= 5.84, r4= 6.34,
 igr2=2549,2550,2551,
 &end
#
# 135 GLN HB2 136 ARG H 4.65 
 &rst
  ixpk= 0, nxpk= 0, iat=2472,2485, r1= 1.30, r2= 1.80, r3= 4.65, r4= 5.15,  &end
#
# 135 GLN HB2 137 ILE H 6.00 
 &rst
  ixpk= 0, nxpk= 0, iat=2472,2509, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,  &end
#
# 135 GLN H 136 ARG HA 5.45 
 &rst
  ixpk= 0, nxpk= 0, iat=2468,2487, r1= 1.30, r2= 1.80, r3= 5.45, r4= 5.95,  &end
#
# 135 GLN H 136 ARG HB2 5.29 
 &rst
  ixpk= 0, nxpk= 0, iat=2468,2489, r1= 1.30, r2= 1.80, r3= 5.29, r4= 5.79,  &end
#
# 135 GLN H 136 ARG H 3.50 
 &rst
  ixpk= 0, nxpk= 0, iat=2468,2485, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
# 135 GLN H 137 ILE H 6.66 
 &rst
  ixpk= 0, nxpk= 0, iat=2468,2509, r1= 1.30, r2= 1.80, r3= 6.66, r4= 7.16,  &end
#
# 135 GLN H 137 ILE QD1 5.93 
 &rst
  ixpk= 0, nxpk= 0, iat=2468,  -1, r1= 1.30, r2= 1.80, r3= 7.12, r4= 7.62,
 igr2=2522,2523,2524,
 &end
#
# 136 ARG HA 137 ILE H 4.68 
 &rst
  ixpk= 0, nxpk= 0, iat=2487,2509, r1= 1.30, r2= 1.80, r3= 4.68, r4= 5.18,  &end
#
# 136 ARG HA 139 ALA QB 4.00 
 &rst
  ixpk= 0, nxpk= 0, iat=2487,  -1, r1= 1.30, r2= 1.80, r3= 4.80, r4= 5.30,
 igr2=2549,2550,2551,
 &end
#
# 136 ARG HA 141 LEU QD1 5.00 
 &rst
  ixpk= 0, nxpk= 0, iat=2487,  -1, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,
 igr2=2571,2572,2573,
 &end
#
# 136 ARG HB2 137 ILE HG12 5.00 
 &rst
  ixpk= 0, nxpk= 0, iat=2489,2519, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50,  &end
#
# 136 ARG HB2 137 ILE H 5.00 
 &rst
  ixpk= 0, nxpk= 0, iat=2489,2509, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50,  &end
#
# 136 ARG HB2 137 ILE QD1 4.74 
 &rst
  ixpk= 0, nxpk= 0, iat=2489,  -1, r1= 1.30, r2= 1.80, r3= 5.69, r4= 6.19,
 igr2=2522,2523,2524,
 &end
#
# 136 ARG HB3 137 ILE H 5.09 
 &rst
  ixpk= 0, nxpk= 0, iat=2490,2509, r1= 1.30, r2= 1.80, r3= 5.09, r4= 5.59,  &end
#
# 136 ARG HD2 137 ILE H 5.36 
 &rst
  ixpk= 0, nxpk= 0, iat=2495,2509, r1= 1.30, r2= 1.80, r3= 5.36, r4= 5.86,  &end
#
# 136 ARG HD2 139 ALA QB 5.36 
 &rst
  ixpk= 0, nxpk= 0, iat=2495,  -1, r1= 1.30, r2= 1.80, r3= 6.44, r4= 6.94,
 igr2=2549,2550,2551,
 &end
#
# 136 ARG HD3 137 ILE H 5.55 
 &rst
  ixpk= 0, nxpk= 0, iat=2496,2509, r1= 1.30, r2= 1.80, r3= 5.55, r4= 6.05,  &end
#
# 136 ARG HD3 137 ILE QD1 5.55 
 &rst
  ixpk= 0, nxpk= 0, iat=2496,  -1, r1= 1.30, r2= 1.80, r3= 6.67, r4= 7.17,
 igr2=2522,2523,2524,
 &end
#
# 136 ARG H 137 ILE H 4.86 
 &rst
  ixpk= 0, nxpk= 0, iat=2485,2509, r1= 1.30, r2= 1.80, r3= 4.86, r4= 5.36,  &end
#
# 136 ARG H 137 ILE QD1 5.36 
 &rst
  ixpk= 0, nxpk= 0, iat=2485,  -1, r1= 1.30, r2= 1.80, r3= 6.44, r4= 6.94,
 igr2=2522,2523,2524,
 &end
#
# 136 ARG H 137 ILE QG2 5.50 
 &rst
  ixpk= 0, nxpk= 0, iat=2485,  -1, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr2=2515,2516,2517,
 &end
#
# 136 ARG H 138 GLN H 5.50 
 &rst
  ixpk= 0, nxpk= 0, iat=2485,2528, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
# 136 ARG H 137 ILE HB 5.78 
 &rst
  ixpk= 0, nxpk= 0, iat=2485,2513, r1= 1.30, r2= 1.80, r3= 5.78, r4= 6.28,  &end
#
# 136 ARG H 139 ALA QB 5.22 
 &rst
  ixpk= 0, nxpk= 0, iat=2485,  -1, r1= 1.30, r2= 1.80, r3= 6.27, r4= 6.77,
 igr2=2549,2550,2551,
 &end
#
# 136 ARG H 141 LEU QD1 5.93 
 &rst
  ixpk= 0, nxpk= 0, iat=2485,  -1, r1= 1.30, r2= 1.80, r3= 7.12, r4= 7.62,
 igr2=2571,2572,2573,
 &end
#
# 137 ILE HA 138 GLN HE21 5.45 
 &rst
  ixpk= 0, nxpk= 0, iat=2511,2541, r1= 1.30, r2= 1.80, r3= 5.45, r4= 5.95,  &end
#
# 137 ILE HA 138 GLN H 4.00 
 &rst
  ixpk= 0, nxpk= 0, iat=2511,2528, r1= 1.30, r2= 1.80, r3= 4.00, r4= 4.50,  &end
#
# 137 ILE HA 139 ALA H 5.00 
 &rst
  ixpk= 0, nxpk= 0, iat=2511,2545, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50,  &end
#
# 137 ILE HA 141 LEU HG 5.22 
 &rst
  ixpk= 0, nxpk= 0, iat=2511,2569, r1= 1.30, r2= 1.80, r3= 5.22, r4= 5.72,  &end
#
# 137 ILE HA 141 LEU QD1 5.22 
 &rst
  ixpk= 0, nxpk= 0, iat=2511,  -1, r1= 1.30, r2= 1.80, r3= 6.27, r4= 6.77,
 igr2=2571,2572,2573,
 &end
#
# 137 ILE HB 138 GLN HA 5.09 
 &rst
  ixpk= 0, nxpk= 0, iat=2513,2530, r1= 1.30, r2= 1.80, r3= 5.09, r4= 5.59,  &end
#
# 137 ILE HB 138 GLN HE21 4.00 
 &rst
  ixpk= 0, nxpk= 0, iat=2513,2541, r1= 1.30, r2= 1.80, r3= 4.00, r4= 4.50,  &end
#
# 137 ILE HB 138 GLN HE22 4.50 
 &rst
  ixpk= 0, nxpk= 0, iat=2513,2540, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
# 137 ILE HB 138 GLN HG3 5.50 
 &rst
  ixpk= 0, nxpk= 0, iat=2513,2536, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
# 137 ILE HB 138 GLN H 4.00 
 &rst
  ixpk= 0, nxpk= 0, iat=2513,2528, r1= 1.30, r2= 1.80, r3= 4.00, r4= 4.50,  &end
#
# 137 ILE HG12 138 GLN H 5.20 
 &rst
  ixpk= 0, nxpk= 0, iat=2519,2528, r1= 1.30, r2= 1.80, r3= 5.20, r4= 5.70,  &end
#
# 137 ILE H 141 LEU QD1 5.09 
 &rst
  ixpk= 0, nxpk= 0, iat=2509,  -1, r1= 1.30, r2= 1.80, r3= 6.11, r4= 6.61,
 igr2=2571,2572,2573,
 &end
#
# 137 ILE QD1 138 GLN HE22 5.66 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,2540, r1= 1.30, r2= 1.80, r3= 6.80, r4= 7.30,
 igr1=2522,2523,2524,
 &end
#
# 137 ILE QD1 138 GLN H 4.50 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,2528, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr1=2522,2523,2524,
 &end
#
# 137 ILE QD1 142 THR HA 5.45 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,2583, r1= 1.30, r2= 1.80, r3= 6.55, r4= 7.05,
 igr1=2522,2523,2524,
 &end
#
# 137 ILE QD1 142 THR QG2 4.38 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.32, r4= 6.82,
 igr1=2522,2523,2524,
 igr2=2587,2588,2589,
 &end
#
# 137 ILE QG2 138 GLN HA 3.90 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,2530, r1= 1.30, r2= 1.80, r3= 4.68, r4= 5.18,
 igr1=2515,2516,2517,
 &end
#
# 137 ILE QG2 138 GLN HE21 4.29 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,2541, r1= 1.30, r2= 1.80, r3= 5.15, r4= 5.65,
 igr1=2515,2516,2517,
 &end
#
# 137 ILE QG2 138 GLN HE22 4.94 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,2540, r1= 1.30, r2= 1.80, r3= 5.93, r4= 6.43,
 igr1=2515,2516,2517,
 &end
#
# 137 ILE QG2 138 GLN HG3 5.00 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,2536, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,
 igr1=2515,2516,2517,
 &end
#
# 137 ILE QG2 138 GLN H 4.00 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,2528, r1= 1.30, r2= 1.80, r3= 4.80, r4= 5.30,
 igr1=2515,2516,2517,
 &end
#
# 138 GLN HA 138 GLN H 4.15 
 &rst
  ixpk= 0, nxpk= 0, iat=2530,2528, r1= 1.30, r2= 1.80, r3= 4.15, r4= 4.65,  &end
#
# 138 GLN HA 139 ALA H 4.59 
 &rst
  ixpk= 0, nxpk= 0, iat=2530,2545, r1= 1.30, r2= 1.80, r3= 4.59, r4= 5.09,  &end
#
# 138 GLN HA 141 LEU QD1 5.50 
 &rst
  ixpk= 0, nxpk= 0, iat=2530,  -1, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr2=2571,2572,2573,
 &end
#
# 138 GLN HA 141 LEU HG 5.50 
 &rst
  ixpk= 0, nxpk= 0, iat=2530,2569, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
# 138 GLN HB2 139 ALA H 5.45 
 &rst
  ixpk= 0, nxpk= 0, iat=2532,2545, r1= 1.30, r2= 1.80, r3= 5.45, r4= 5.95,  &end
#
# 138 GLN HB2 140 GLY H 5.66 
 &rst
  ixpk= 0, nxpk= 0, iat=2532,2555, r1= 1.30, r2= 1.80, r3= 5.66, r4= 6.16,  &end
#
# 138 GLN HB3 139 ALA H 5.66 
 &rst
  ixpk= 0, nxpk= 0, iat=2533,2545, r1= 1.30, r2= 1.80, r3= 5.66, r4= 6.16,  &end
#
# 138 GLN HE21 141 LEU QD1 5.50 
 &rst
  ixpk= 0, nxpk= 0, iat=2541,  -1, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr2=2571,2572,2573,
 &end
#
# 138 GLN HE22 141 LEU QD1 5.50 
 &rst
  ixpk= 0, nxpk= 0, iat=2540,  -1, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr2=2571,2572,2573,
 &end
#
# 138 GLN HG2 139 ALA H 5.50 
 &rst
  ixpk= 0, nxpk= 0, iat=2535,2545, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
# 138 GLN H 139 ALA HA 5.22 
 &rst
  ixpk= 0, nxpk= 0, iat=2528,2547, r1= 1.30, r2= 1.80, r3= 5.22, r4= 5.72,  &end
#
# 138 GLN H 139 ALA H 4.50 
 &rst
  ixpk= 0, nxpk= 0, iat=2528,2545, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
# 138 GLN H 139 ALA QB 4.38 
 &rst
  ixpk= 0, nxpk= 0, iat=2528,  -1, r1= 1.30, r2= 1.80, r3= 5.26, r4= 5.76,
 igr2=2549,2550,2551,
 &end
#
# 138 GLN H 140 GLY H 5.66 
 &rst
  ixpk= 0, nxpk= 0, iat=2528,2555, r1= 1.30, r2= 1.80, r3= 5.66, r4= 6.16,  &end
#
# 139 ALA HA 140 GLY H 4.56 
 &rst
  ixpk= 0, nxpk= 0, iat=2547,2555, r1= 1.30, r2= 1.80, r3= 4.56, r4= 5.06,  &end
#
# 139 ALA HA 140 GLY HA3 5.50 
 &rst
  ixpk= 0, nxpk= 0, iat=2547,2558, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
# 139 ALA HA 141 LEU HG 6.00 
 &rst
  ixpk= 0, nxpk= 0, iat=2547,2569, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,  &end
#
# 139 ALA HA 141 LEU QD1 6.00 
 &rst
  ixpk= 0, nxpk= 0, iat=2547,  -1, r1= 1.30, r2= 1.80, r3= 7.21, r4= 7.71,
 igr2=2571,2572,2573,
 &end
#
# 139 ALA H 141 LEU QD1 5.93 
 &rst
  ixpk= 0, nxpk= 0, iat=2545,  -1, r1= 1.30, r2= 1.80, r3= 7.12, r4= 7.62,
 igr2=2571,2572,2573,
 &end
#
# 139 ALA QB 140 GLY HA3 4.24 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,2558, r1= 1.30, r2= 1.80, r3= 5.09, r4= 5.59,
 igr1=2549,2550,2551,
 &end
#
# 139 ALA QB 140 GLY H 4.65 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,2555, r1= 1.30, r2= 1.80, r3= 5.58, r4= 6.08,
 igr1=2549,2550,2551,
 &end
#
# 139 ALA QB 141 LEU QD1 5.00 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.21, r4= 7.71,
 igr1=2549,2550,2551,
 igr2=2571,2572,2573,
 &end
#
# 140 GLY HA2 141 LEU QD2 4.80 
 &rst
  ixpk= 0, nxpk= 0, iat=2557,  -1, r1= 1.30, r2= 1.80, r3= 5.76, r4= 6.26,
 igr2=2575,2576,2577,
 &end
#
# 140 GLY HA3 141 LEU QD2 4.47 
 &rst
  ixpk= 0, nxpk= 0, iat=2558,  -1, r1= 1.30, r2= 1.80, r3= 5.37, r4= 5.87,
 igr2=2575,2576,2577,
 &end
#
# 140 GLY H 141 LEU HG 5.29 
 &rst
  ixpk= 0, nxpk= 0, iat=2555,2569, r1= 1.30, r2= 1.80, r3= 5.29, r4= 5.79,  &end
#
# 140 GLY H 141 LEU QD1 5.66 
 &rst
  ixpk= 0, nxpk= 0, iat=2555,  -1, r1= 1.30, r2= 1.80, r3= 6.80, r4= 7.30,
 igr2=2571,2572,2573,
 &end
#
# 141 LEU HB2 142 THR HA 4.65 
 &rst
  ixpk= 0, nxpk= 0, iat=2566,2583, r1= 1.30, r2= 1.80, r3= 4.65, r4= 5.15,  &end
#
# 141 LEU HB2 142 THR H 5.93 
 &rst
  ixpk= 0, nxpk= 0, iat=2566,2581, r1= 1.30, r2= 1.80, r3= 5.93, r4= 6.43,  &end
#
# 141 LEU H 142 THR QG2 6.12 
 &rst
  ixpk= 0, nxpk= 0, iat=2562,  -1, r1= 1.30, r2= 1.80, r3= 7.35, r4= 7.85,
 igr2=2587,2588,2589,
 &end
#
# 141 LEU H 142 THR HA 5.78 
 &rst
  ixpk= 0, nxpk= 0, iat=2562,2583, r1= 1.30, r2= 1.80, r3= 5.78, r4= 6.28,  &end
#
# 141 LEU H 142 THR H 5.87 
 &rst
  ixpk= 0, nxpk= 0, iat=2562,2581, r1= 1.30, r2= 1.80, r3= 5.87, r4= 6.37,  &end
#
# 141 LEU QD1 142 THR H 6.12 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,2581, r1= 1.30, r2= 1.80, r3= 7.35, r4= 7.85,
 igr1=2571,2572,2573,
 &end
#
# 141 LEU QD2 144 PRO HA 5.04 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,2615, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55,
 igr1=2575,2576,2577,
 &end
#
# 142 THR HA 143 ALA H 4.90 
 &rst
  ixpk= 0, nxpk= 0, iat=2583,2595, r1= 1.30, r2= 1.80, r3= 4.90, r4= 5.40,  &end
#
# 142 THR HA 144 PRO HD3 5.04 
 &rst
  ixpk= 0, nxpk= 0, iat=2583,2607, r1= 1.30, r2= 1.80, r3= 5.04, r4= 5.54,  &end
#
# 142 THR HB 143 ALA H 5.29 
 &rst
  ixpk= 0, nxpk= 0, iat=2585,2595, r1= 1.30, r2= 1.80, r3= 5.29, r4= 5.79,  &end
#
# 142 THR QG2 143 ALA H 5.78 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,2595, r1= 1.30, r2= 1.80, r3= 6.94, r4= 7.44,
 igr1=2587,2588,2589,
 &end
#
# 143 ALA HA 144 PRO HD2 5.00 
 &rst
  ixpk= 0, nxpk= 0, iat=2597,2606, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50,  &end
#
# 143 ALA QB 144 PRO HA 4.86 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,2615, r1= 1.30, r2= 1.80, r3= 5.84, r4= 6.34,
 igr1=2599,2600,2601,
 &end
#
# 143 ALA QB 144 PRO HD2 4.03 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,2606, r1= 1.30, r2= 1.80, r3= 4.84, r4= 5.34,
 igr1=2599,2600,2601,
 &end
#
# 143 ALA QB 144 PRO HD3 4.03 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,2607, r1= 1.30, r2= 1.80, r3= 4.84, r4= 5.34,
 igr1=2599,2600,2601,
 &end
#
# 144 PRO HA 145 ASP HB2 4.54 
 &rst
  ixpk= 0, nxpk= 0, iat=2615,2623, r1= 1.30, r2= 1.80, r3= 4.54, r4= 5.04,  &end
#
# 144 PRO HA 145 ASP H 4.18 
 &rst
  ixpk= 0, nxpk= 0, iat=2615,2619, r1= 1.30, r2= 1.80, r3= 4.18, r4= 4.68,  &end
#
# 144 PRO HB2 145 ASP H 5.55 
 &rst
  ixpk= 0, nxpk= 0, iat=2612,2619, r1= 1.30, r2= 1.80, r3= 5.55, r4= 6.05,  &end
#
# 144 PRO HB3 145 ASP HB2 4.59 
 &rst
  ixpk= 0, nxpk= 0, iat=2613,2623, r1= 1.30, r2= 1.80, r3= 4.59, r4= 5.09,  &end
#
# 144 PRO HB3 145 ASP HB3 4.51 
 &rst
  ixpk= 0, nxpk= 0, iat=2613,2624, r1= 1.30, r2= 1.80, r3= 4.51, r4= 5.01,  &end
#
# 144 PRO HB3 145 ASP H 4.82 
 &rst
  ixpk= 0, nxpk= 0, iat=2613,2619, r1= 1.30, r2= 1.80, r3= 4.82, r4= 5.32,  &end
#
# 145 ASP HB2 146 LYS HG3 4.86 
 &rst
  ixpk= 0, nxpk= 0, iat=2623,2639, r1= 1.30, r2= 1.80, r3= 4.86, r4= 5.36,  &end
#
# 145 ASP HB2 146 LYS QD 4.99 
 &rst
  ixpk= 0, nxpk= 0, iat=2623,  -1, r1= 1.30, r2= 1.80, r3= 5.60, r4= 6.10,
 igr2=2641,2642,
 &end
#
# 146 LYS QE 149 THR HB 4.56 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,2696, r1= 1.30, r2= 1.80, r3= 5.12, r4= 5.62,
 igr1=2644,2645,
 &end
#
# 146 LYS QE 149 THR QG2 4.40 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.93, r4= 6.43,
 igr1=2644,2645,
 igr2=2698,2699,2700,
 &end
#
# 148 GLU HA 149 THR H 4.94 
 &rst
  ixpk= 0, nxpk= 0, iat=2679,2692, r1= 1.30, r2= 1.80, r3= 4.94, r4= 5.44,  &end
#
# 148 GLU HG2 149 THR HB 5.09 
 &rst
  ixpk= 0, nxpk= 0, iat=2684,2696, r1= 1.30, r2= 1.80, r3= 5.09, r4= 5.59,  &end
#
# 149 THR HA 150 PRO HD2 2.97 
 &rst
  ixpk= 0, nxpk= 0, iat=2694,2707, r1= 1.30, r2= 1.80, r3= 2.97, r4= 3.47,  &end
#
# 149 THR HA 150 PRO HD3 2.96 
 &rst
  ixpk= 0, nxpk= 0, iat=2694,2708, r1= 1.30, r2= 1.80, r3= 2.96, r4= 3.46,  &end
#
# 149 THR HB 150 PRO HD2 3.60 
 &rst
  ixpk= 0, nxpk= 0, iat=2696,2707, r1= 1.30, r2= 1.80, r3= 3.60, r4= 4.10,  &end
#
# 149 THR HB 150 PRO HD3 3.83 
 &rst
  ixpk= 0, nxpk= 0, iat=2696,2708, r1= 1.30, r2= 1.80, r3= 3.83, r4= 4.33,  &end
#
# 149 THR HB 150 PRO QG 5.20 
 &rst
  ixpk= 0, nxpk= 0, iat=2696,  -1, r1= 1.30, r2= 1.80, r3= 5.84, r4= 6.34,
 igr2=2710,2711,
 &end
#
# 149 THR QG2 150 PRO HA 5.50 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,2716, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr1=2698,2699,2700,
 &end
#
# 149 THR QG2 150 PRO HD2 3.90 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,2707, r1= 1.30, r2= 1.80, r3= 4.68, r4= 5.18,
 igr1=2698,2699,2700,
 &end
#
# 149 THR QG2 150 PRO HD3 4.24 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,2708, r1= 1.30, r2= 1.80, r3= 5.09, r4= 5.59,
 igr1=2698,2699,2700,
 &end
#
# 149 THR QG2 150 PRO HD3 4.65 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,2708, r1= 1.30, r2= 1.80, r3= 5.58, r4= 6.08,
 igr1=2698,2699,2700,
 &end
#
# 149 THR QG2 150 PRO QG 4.82 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.50, r4= 7.00,
 igr1=2698,2699,2700,
 igr2=2710,2711,
 &end
#
# 150 PRO HA 151 HIS HB3 5.50 
 &rst
  ixpk= 0, nxpk= 0, iat=2716,2725, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
# 150 PRO HD3 151 HIS HB3 6.00 
 &rst
  ixpk= 0, nxpk= 0, iat=2708,2725, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,  &end
#
# 66 RGUA H1' 67 RGUA H8 4.52 
 &rst
  ixpk= 0, nxpk= 0, iat=1037,1074, r1= 1.30, r2= 1.80, r3= 4.52, r4= 5.02,  &end
#
# 66 RGUA H2' 67 RGUA H1' 4.21 
 &rst
  ixpk= 0, nxpk= 0, iat=1056,1071, r1= 1.30, r2= 1.80, r3= 4.21, r4= 4.71,  &end
#
# 66 RGUA H2' 67 RGUA H5' 4.28 
 &rst
  ixpk= 0, nxpk= 0, iat=1056,1065, r1= 1.30, r2= 1.80, r3= 4.28, r4= 4.78,  &end
#
# 66 RGUA H2' 67 RGUA H8 3.24 
 &rst
  ixpk= 0, nxpk= 0, iat=1056,1074, r1= 1.30, r2= 1.80, r3= 3.24, r4= 3.74,  &end
#
# 66 RGUA H3' 67 RGUA H8 3.73 
 &rst
  ixpk= 0, nxpk= 0, iat=1054,1074, r1= 1.30, r2= 1.80, r3= 3.73, r4= 4.23,  &end
#
# 66 RGUA H8 66 RGUA H1' 4.72 
 &rst
  ixpk= 0, nxpk= 0, iat=1040,1037, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,  &end
#
# 66 RGUA H8 66 RGUA H2' 4.83 
 &rst
  ixpk= 0, nxpk= 0, iat=1040,1056, r1= 1.30, r2= 1.80, r3= 4.83, r4= 5.33,  &end
#
# 66 RGUA H8 66 RGUA H3' 4.96 
 &rst
  ixpk= 0, nxpk= 0, iat=1040,1054, r1= 1.30, r2= 1.80, r3= 4.96, r4= 5.46,  &end
#
# 66 RGUA H8 66 RGUA H4' 4.89 
 &rst
  ixpk= 0, nxpk= 0, iat=1040,1034, r1= 1.30, r2= 1.80, r3= 4.89, r4= 5.39,  &end
#
# 66 RGUA H8 66 RGUA H5' 5.03 
 &rst
  ixpk= 0, nxpk= 0, iat=1040,1031, r1= 1.30, r2= 1.80, r3= 5.03, r4= 5.53,  &end
#
# 66 RGUA H8 66 RGUA H5" 5.03 
 &rst
  ixpk= 0, nxpk= 0, iat=1040,1032, r1= 1.30, r2= 1.80, r3= 5.03, r4= 5.53,  &end
#
# 66 RGUA H8 67 RGUA H8 4.85 
 &rst
  ixpk= 0, nxpk= 0, iat=1040,1074, r1= 1.30, r2= 1.80, r3= 4.85, r4= 5.35,  &end
#
# 67 RGUA H1 68 RGUA H1 4.16 
 &rst
  ixpk= 0, nxpk= 0, iat=1080,1114, r1= 1.30, r2= 1.80, r3= 4.16, r4= 4.66,  &end
#
# 67 RGUA H1' 68 RGUA H8 3.98 
 &rst
  ixpk= 0, nxpk= 0, iat=1071,1108, r1= 1.30, r2= 1.80, r3= 3.98, r4= 4.48,  &end
#
# 67 RGUA H1' 68 RGUA H8 4.48 
 &rst
  ixpk= 0, nxpk= 0, iat=1071,1108, r1= 1.30, r2= 1.80, r3= 4.48, r4= 4.98,  &end
#
# 67 RGUA H1 86 RCYT H1' 6.24 
 &rst
  ixpk= 0, nxpk= 0, iat=1080,1689, r1= 1.30, r2= 1.80, r3= 6.24, r4= 6.74,  &end
#
# 67 RGUA H2' 68 RGUA H8 2.40 
 &rst
  ixpk= 0, nxpk= 0, iat=1090,1108, r1= 1.30, r2= 1.80, r3= 2.40, r4= 2.90,  &end
#
# 67 RGUA H3' 68 RGUA H8 4.33 
 &rst
  ixpk= 0, nxpk= 0, iat=1088,1108, r1= 1.30, r2= 1.80, r3= 4.33, r4= 4.83,  &end
#
# 67 RGUA H8 67 RGUA H1' 4.25 
 &rst
  ixpk= 0, nxpk= 0, iat=1074,1071, r1= 1.30, r2= 1.80, r3= 4.25, r4= 4.75,  &end
#
# 67 RGUA H8 67 RGUA H3' 3.89 
 &rst
  ixpk= 0, nxpk= 0, iat=1074,1088, r1= 1.30, r2= 1.80, r3= 3.89, r4= 4.39,  &end
#
# 67 RGUA H8 67 RGUA H4' 5.00 
 &rst
  ixpk= 0, nxpk= 0, iat=1074,1068, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50,  &end
#
# 67 RGUA H8 67 RGUA H5" 5.00 
 &rst
  ixpk= 0, nxpk= 0, iat=1074,1066, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50,  &end
#
# 67 RGUA H8 67 RGUA H5' 5.00 
 &rst
  ixpk= 0, nxpk= 0, iat=1074,1065, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50,  &end
#
# 67 RGUA H8 68 RGUA H8 5.35 
 &rst
  ixpk= 0, nxpk= 0, iat=1074,1108, r1= 1.30, r2= 1.80, r3= 5.35, r4= 5.85,  &end
#
# 68 RGUA H1' 68 RGUA H8 4.37 
 &rst
  ixpk= 0, nxpk= 0, iat=1105,1108, r1= 1.30, r2= 1.80, r3= 4.37, r4= 4.87,  &end
#
# 68 RGUA H1 69 RADE H1' 5.06 
 &rst
  ixpk= 0, nxpk= 0, iat=1114,1139, r1= 1.30, r2= 1.80, r3= 5.06, r4= 5.56,  &end
#
# 68 RGUA H1' 69 RADE H1' 6.00 
 &rst
  ixpk= 0, nxpk= 0, iat=1105,1139, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,  &end
#
# 68 RGUA H1' 69 RADE H8 4.50 
 &rst
  ixpk= 0, nxpk= 0, iat=1105,1142, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
# 68 RGUA H1 83 URA H3 4.40 
 &rst
  ixpk= 0, nxpk= 0, iat=1114,1606, r1= 1.30, r2= 1.80, r3= 4.40, r4= 4.90,  &end
#
# 68 RGUA H1 84 RCYT H1' 5.19 
 &rst
  ixpk= 0, nxpk= 0, iat=1114,1627, r1= 1.30, r2= 1.80, r3= 5.19, r4= 5.69,  &end
#
# 68 RGUA H1 84 RCYT H41 4.69 
 &rst
  ixpk= 0, nxpk= 0, iat=1114,1635, r1= 1.30, r2= 1.80, r3= 4.69, r4= 5.19,  &end
#
# 68 RGUA H1 84 RCYT H42 4.63 
 &rst
  ixpk= 0, nxpk= 0, iat=1114,1636, r1= 1.30, r2= 1.80, r3= 4.63, r4= 5.13,  &end
#
# 68 RGUA H1 84 RCYT H5 5.19 
 &rst
  ixpk= 0, nxpk= 0, iat=1114,1632, r1= 1.30, r2= 1.80, r3= 5.19, r4= 5.69,  &end
#
# 68 RGUA H1 85 RCYT H1' 5.06 
 &rst
  ixpk= 0, nxpk= 0, iat=1114,1658, r1= 1.30, r2= 1.80, r3= 5.06, r4= 5.56,  &end
#
# 68 RGUA H1 85 RCYT H6 5.56 
 &rst
  ixpk= 0, nxpk= 0, iat=1114,1661, r1= 1.30, r2= 1.80, r3= 5.56, r4= 6.06,  &end
#
# 68 RGUA H2' 69 RADE H1' 4.77 
 &rst
  ixpk= 0, nxpk= 0, iat=1124,1139, r1= 1.30, r2= 1.80, r3= 4.77, r4= 5.27,  &end
#
# 68 RGUA H2' 69 RADE H5" 5.00 
 &rst
  ixpk= 0, nxpk= 0, iat=1124,1134, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50,  &end
#
# 68 RGUA H2' 69 RADE H8 2.40 
 &rst
  ixpk= 0, nxpk= 0, iat=1124,1142, r1= 1.30, r2= 1.80, r3= 2.40, r4= 2.90,  &end
#
# 68 RGUA H3' 68 RGUA H8 3.42 
 &rst
  ixpk= 0, nxpk= 0, iat=1122,1108, r1= 1.30, r2= 1.80, r3= 3.42, r4= 3.92,  &end
#
# 68 RGUA H3' 69 RADE H8 3.74 
 &rst
  ixpk= 0, nxpk= 0, iat=1122,1142, r1= 1.30, r2= 1.80, r3= 3.74, r4= 4.24,  &end
#
# 68 RGUA H5" 68 RGUA H8 4.16 
 &rst
  ixpk= 0, nxpk= 0, iat=1100,1108, r1= 1.30, r2= 1.80, r3= 4.16, r4= 4.66,  &end
#
# 68 RGUA H8 68 RGUA H3' 4.19 
 &rst
  ixpk= 0, nxpk= 0, iat=1108,1122, r1= 1.30, r2= 1.80, r3= 4.19, r4= 4.69,  &end
#
# 68 RGUA H8 68 RGUA H4' 4.69 
 &rst
  ixpk= 0, nxpk= 0, iat=1108,1102, r1= 1.30, r2= 1.80, r3= 4.69, r4= 5.19,  &end
#
# 68 RGUA H8 68 RGUA H5" 4.69 
 &rst
  ixpk= 0, nxpk= 0, iat=1108,1100, r1= 1.30, r2= 1.80, r3= 4.69, r4= 5.19,  &end
#
# 68 RGUA H8 69 RADE H8 4.82 
 &rst
  ixpk= 0, nxpk= 0, iat=1108,1142, r1= 1.30, r2= 1.80, r3= 4.82, r4= 5.32,  &end
#
# 69 RADE H1' 70 URA H5 5.83 
 &rst
  ixpk= 0, nxpk= 0, iat=1139,1177, r1= 1.30, r2= 1.80, r3= 5.83, r4= 6.33,  &end
#
# 69 RADE H1' 70 URA H6 5.00 
 &rst
  ixpk= 0, nxpk= 0, iat=1139,1175, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50,  &end
#
# 69 RADE H2 69 RADE H1' 5.19 
 &rst
  ixpk= 0, nxpk= 0, iat=1151,1139, r1= 1.30, r2= 1.80, r3= 5.19, r4= 5.69,  &end
#
# 69 RADE H2 70 URA H1' 3.70 
 &rst
  ixpk= 0, nxpk= 0, iat=1151,1172, r1= 1.30, r2= 1.80, r3= 3.70, r4= 4.20,  &end
#
# 69 RADE H2' 70 URA H5 5.00 
 &rst
  ixpk= 0, nxpk= 0, iat=1157,1177, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50,  &end
#
# 69 RADE H2' 70 URA H6 4.25 
 &rst
  ixpk= 0, nxpk= 0, iat=1157,1175, r1= 1.30, r2= 1.80, r3= 4.25, r4= 4.75,  &end
#
# 69 RADE H2 83 URA H3 4.51 
 &rst
  ixpk= 0, nxpk= 0, iat=1151,1606, r1= 1.30, r2= 1.80, r3= 4.51, r4= 5.01,  &end
#
# 69 RADE H2 84 RCYT H1' 3.59 
 &rst
  ixpk= 0, nxpk= 0, iat=1151,1627, r1= 1.30, r2= 1.80, r3= 3.59, r4= 4.09,  &end
#
# 69 RADE H2 84 RCYT H2' 5.50 
 &rst
  ixpk= 0, nxpk= 0, iat=1151,1643, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
# 69 RADE H2 84 RCYT H5 5.00 
 &rst
  ixpk= 0, nxpk= 0, iat=1151,1632, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50,  &end
#
# 69 RADE H3' 70 URA H5 5.00 
 &rst
  ixpk= 0, nxpk= 0, iat=1155,1177, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50,  &end
#
# 69 RADE H3' 70 URA H6 3.00 
 &rst
  ixpk= 0, nxpk= 0, iat=1155,1175, r1= 1.30, r2= 1.80, r3= 3.00, r4= 3.50,  &end
#
# 69 RADE H8 69 RADE H1' 4.02 
 &rst
  ixpk= 0, nxpk= 0, iat=1142,1139, r1= 1.30, r2= 1.80, r3= 4.02, r4= 4.52,  &end
#
# 69 RADE H8 69 RADE H2' 4.50 
 &rst
  ixpk= 0, nxpk= 0, iat=1142,1157, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
# 69 RADE H8 69 RADE H3' 3.93 
 &rst
  ixpk= 0, nxpk= 0, iat=1142,1155, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,  &end
#
# 69 RADE H8 69 RADE H4' 5.00 
 &rst
  ixpk= 0, nxpk= 0, iat=1142,1136, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50,  &end
#
# 69 RADE H8 70 URA H5 5.00 
 &rst
  ixpk= 0, nxpk= 0, iat=1142,1177, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50,  &end
#
# 69 RADE H8 70 URA H6 5.00 
 &rst
  ixpk= 0, nxpk= 0, iat=1142,1175, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50,  &end
#
# 70 URA H1' 70 URA H6 4.58 
 &rst
  ixpk= 0, nxpk= 0, iat=1172,1175, r1= 1.30, r2= 1.80, r3= 4.58, r4= 5.08,  &end
#
# 70 URA H1' 71 RCYT H5 6.00 
 &rst
  ixpk= 0, nxpk= 0, iat=1172,1207, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,  &end
#
# 70 URA H1' 71 RCYT H6 4.50 
 &rst
  ixpk= 0, nxpk= 0, iat=1172,1205, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
# 70 URA H1' 83 URA H3 6.00 
 &rst
  ixpk= 0, nxpk= 0, iat=1172,1606, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,  &end
#
# 70 URA H2' 71 RCYT H1' 4.50 
 &rst
  ixpk= 0, nxpk= 0, iat=1187,1202, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
# 70 URA H2' 71 RCYT H5 3.82 
 &rst
  ixpk= 0, nxpk= 0, iat=1187,1207, r1= 1.30, r2= 1.80, r3= 3.82, r4= 4.32,  &end
#
# 70 URA H2' 71 RCYT H6 2.40 
 &rst
  ixpk= 0, nxpk= 0, iat=1187,1205, r1= 1.30, r2= 1.80, r3= 2.40, r4= 2.90,  &end
#
# 70 URA H3 71 RCYT H1' 5.56 
 &rst
  ixpk= 0, nxpk= 0, iat=1181,1202, r1= 1.30, r2= 1.80, r3= 5.56, r4= 6.06,  &end
#
# 70 URA H3 81 RGUA H1 4.45 
 &rst
  ixpk= 0, nxpk= 0, iat=1181,1539, r1= 1.30, r2= 1.80, r3= 4.45, r4= 4.95,  &end
#
# 70 URA H3 82 RADE H2 4.32 
 &rst
  ixpk= 0, nxpk= 0, iat=1181,1576, r1= 1.30, r2= 1.80, r3= 4.32, r4= 4.82,  &end
#
# 70 URA H3 83 URA H1' 6.24 
 &rst
  ixpk= 0, nxpk= 0, iat=1181,1597, r1= 1.30, r2= 1.80, r3= 6.24, r4= 6.74,  &end
#
# 70 URA H3 83 URA H3 3.62 
 &rst
  ixpk= 0, nxpk= 0, iat=1181,1606, r1= 1.30, r2= 1.80, r3= 3.62, r4= 4.12,  &end
#
# 70 URA H5 71 RCYT H5 5.00 
 &rst
  ixpk= 0, nxpk= 0, iat=1177,1207, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50,  &end
#
# 70 URA H6 70 URA H2' 4.41 
 &rst
  ixpk= 0, nxpk= 0, iat=1175,1187, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,  &end
#
# 71 RCYT H1' 72 RGUA H8 4.72 
 &rst
  ixpk= 0, nxpk= 0, iat=1202,1236, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,  &end
#
# 71 RCYT H1' 81 RGUA H1 5.50 
 &rst
  ixpk= 0, nxpk= 0, iat=1202,1539, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
# 71 RCYT H1' 82 RADE H2 3.50 
 &rst
  ixpk= 0, nxpk= 0, iat=1202,1576, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
# 71 RCYT H2' 72 RGUA H8 2.40 
 &rst
  ixpk= 0, nxpk= 0, iat=1218,1236, r1= 1.30, r2= 1.80, r3= 2.40, r4= 2.90,  &end
#
# 71 RCYT H2' 82 RADE H2 5.50 
 &rst
  ixpk= 0, nxpk= 0, iat=1218,1576, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
# 71 RCYT H3' 72 RGUA H8 4.95 
 &rst
  ixpk= 0, nxpk= 0, iat=1216,1236, r1= 1.30, r2= 1.80, r3= 4.95, r4= 5.45,  &end
#
# 71 RCYT H41 81 RGUA H1 4.69 
 &rst
  ixpk= 0, nxpk= 0, iat=1210,1539, r1= 1.30, r2= 1.80, r3= 4.69, r4= 5.19,  &end
#
# 71 RCYT H42 81 RGUA H1 4.46 
 &rst
  ixpk= 0, nxpk= 0, iat=1211,1539, r1= 1.30, r2= 1.80, r3= 4.46, r4= 4.96,  &end
#
# 71 RCYT H6 71 RCYT H1' 3.74 
 &rst
  ixpk= 0, nxpk= 0, iat=1205,1202, r1= 1.30, r2= 1.80, r3= 3.74, r4= 4.24,  &end
#
# 71 RCYT H6 71 RCYT H4' 5.00 
 &rst
  ixpk= 0, nxpk= 0, iat=1205,1199, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50,  &end
#
# 71 RCYT H6 71 RCYT H5" 4.78 
 &rst
  ixpk= 0, nxpk= 0, iat=1205,1197, r1= 1.30, r2= 1.80, r3= 4.78, r4= 5.28,  &end
#
# 71 RCYT H6 81 RGUA H1 5.56 
 &rst
  ixpk= 0, nxpk= 0, iat=1205,1539, r1= 1.30, r2= 1.80, r3= 5.56, r4= 6.06,  &end
#
# 72 RGUA H1' 73 RCYT H1' 6.00 
 &rst
  ixpk= 0, nxpk= 0, iat=1233,1267, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,  &end
#
# 72 RGUA H1 73 RCYT H5 5.83 
 &rst
  ixpk= 0, nxpk= 0, iat=1242,1272, r1= 1.30, r2= 1.80, r3= 5.83, r4= 6.33,  &end
#
# 72 RGUA H1' 73 RCYT H6 5.35 
 &rst
  ixpk= 0, nxpk= 0, iat=1233,1270, r1= 1.30, r2= 1.80, r3= 5.35, r4= 5.85,  &end
#
# 72 RGUA H1 79 RGUA H1 4.16 
 &rst
  ixpk= 0, nxpk= 0, iat=1242,1474, r1= 1.30, r2= 1.80, r3= 4.16, r4= 4.66,  &end
#
# 72 RGUA H1 80 RCYT H41 5.56 
 &rst
  ixpk= 0, nxpk= 0, iat=1242,1507, r1= 1.30, r2= 1.80, r3= 5.56, r4= 6.06,  &end
#
# 72 RGUA H1 80 RCYT H5 5.56 
 &rst
  ixpk= 0, nxpk= 0, iat=1242,1504, r1= 1.30, r2= 1.80, r3= 5.56, r4= 6.06,  &end
#
# 72 RGUA H1' 81 RGUA H1 4.77 
 &rst
  ixpk= 0, nxpk= 0, iat=1233,1539, r1= 1.30, r2= 1.80, r3= 4.77, r4= 5.27,  &end
#
# 72 RGUA H1 81 RGUA H1' 5.35 
 &rst
  ixpk= 0, nxpk= 0, iat=1242,1530, r1= 1.30, r2= 1.80, r3= 5.35, r4= 5.85,  &end
#
# 72 RGUA H8 72 RGUA H1' 4.63 
 &rst
  ixpk= 0, nxpk= 0, iat=1236,1233, r1= 1.30, r2= 1.80, r3= 4.63, r4= 5.13,  &end
#
# 72 RGUA H8 72 RGUA H2' 4.00 
 &rst
  ixpk= 0, nxpk= 0, iat=1236,1252, r1= 1.30, r2= 1.80, r3= 4.00, r4= 4.50,  &end
#
# 72 RGUA H8 72 RGUA H3' 3.50 
 &rst
  ixpk= 0, nxpk= 0, iat=1236,1250, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
# 72 RGUA H8 81 RGUA H1 5.56 
 &rst
  ixpk= 0, nxpk= 0, iat=1236,1539, r1= 1.30, r2= 1.80, r3= 5.56, r4= 6.06,  &end
#
# 73 RCYT H2' 74 RADE H8 4.00 
 &rst
  ixpk= 0, nxpk= 0, iat=1283,1301, r1= 1.30, r2= 1.80, r3= 4.00, r4= 4.50,  &end
#
# 73 RCYT H3' 74 RADE H8 4.50 
 &rst
  ixpk= 0, nxpk= 0, iat=1281,1301, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
# 73 RCYT H42 79 RGUA H1 5.83 
 &rst
  ixpk= 0, nxpk= 0, iat=1276,1474, r1= 1.30, r2= 1.80, r3= 5.83, r4= 6.33,  &end
#
# 73 RCYT H4' 74 RADE H8 6.40 
 &rst
  ixpk= 0, nxpk= 0, iat=1264,1301, r1= 1.30, r2= 1.80, r3= 6.40, r4= 6.90,  &end
#
# 73 RCYT H6 73 RCYT H1' 4.85 
 &rst
  ixpk= 0, nxpk= 0, iat=1270,1267, r1= 1.30, r2= 1.80, r3= 4.85, r4= 5.35,  &end
#
# 73 RCYT H6 73 RCYT H3' 4.78 
 &rst
  ixpk= 0, nxpk= 0, iat=1270,1281, r1= 1.30, r2= 1.80, r3= 4.78, r4= 5.28,  &end
#
# 73 RCYT H6 73 RCYT H4' 4.59 
 &rst
  ixpk= 0, nxpk= 0, iat=1270,1264, r1= 1.30, r2= 1.80, r3= 4.59, r4= 5.09,  &end
#
# 73 RCYT H6 79 RGUA H1 6.00 
 &rst
  ixpk= 0, nxpk= 0, iat=1270,1474, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,  &end
#
# 74 RADE H1' 74 RADE H8 4.90 
 &rst
  ixpk= 0, nxpk= 0, iat=1298,1301, r1= 1.30, r2= 1.80, r3= 4.90, r4= 5.40,  &end
#
# 74 RADE H1' 75 RGUA H1' 6.50 
 &rst
  ixpk= 0, nxpk= 0, iat=1298,1331, r1= 1.30, r2= 1.80, r3= 6.50, r4= 7.00,  &end
#
# 74 RADE H1' 75 RGUA H8 4.37 
 &rst
  ixpk= 0, nxpk= 0, iat=1298,1334, r1= 1.30, r2= 1.80, r3= 4.37, r4= 4.87,  &end
#
# 74 RADE H1' 79 RGUA H1 4.50 
 &rst
  ixpk= 0, nxpk= 0, iat=1298,1474, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
# 74 RADE H2' 75 RGUA H8 3.00 
 &rst
  ixpk= 0, nxpk= 0, iat=1316,1334, r1= 1.30, r2= 1.80, r3= 3.00, r4= 3.50,  &end
#
# 74 RADE H2 75 RGUA H8 3.80 
 &rst
  ixpk= 0, nxpk= 0, iat=1310,1334, r1= 1.30, r2= 1.80, r3= 3.80, r4= 4.30,  &end
#
# 74 RADE H8 74 RADE H1' 4.77 
 &rst
  ixpk= 0, nxpk= 0, iat=1301,1298, r1= 1.30, r2= 1.80, r3= 4.77, r4= 5.27,  &end
#
# 74 RADE H8 74 RADE H2' 4.63 
 &rst
  ixpk= 0, nxpk= 0, iat=1301,1316, r1= 1.30, r2= 1.80, r3= 4.63, r4= 5.13,  &end
#
# 74 RADE H8 75 RGUA H8 6.50 
 &rst
  ixpk= 0, nxpk= 0, iat=1301,1334, r1= 1.30, r2= 1.80, r3= 6.50, r4= 7.00,  &end
#
# 75 RGUA H1' 75 RGUA H8 4.34 
 &rst
  ixpk= 0, nxpk= 0, iat=1331,1334, r1= 1.30, r2= 1.80, r3= 4.34, r4= 4.84,  &end
#
# 75 RGUA H1' 76 RGUA H8 4.50 
 &rst
  ixpk= 0, nxpk= 0, iat=1331,1368, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
# 75 RGUA H1' 77 RADE H2 5.50 
 &rst
  ixpk= 0, nxpk= 0, iat=1331,1411, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
# 75 RGUA H2' 76 RGUA H8 5.42 
 &rst
  ixpk= 0, nxpk= 0, iat=1350,1368, r1= 1.30, r2= 1.80, r3= 5.42, r4= 5.92,  &end
#
# 75 RGUA H3' 76 RGUA H8 5.03 
 &rst
  ixpk= 0, nxpk= 0, iat=1348,1368, r1= 1.30, r2= 1.80, r3= 5.03, r4= 5.53,  &end
#
# 75 RGUA H3' 77 RADE H2 5.50 
 &rst
  ixpk= 0, nxpk= 0, iat=1348,1411, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
# 75 RGUA H8 75 RGUA H1' 4.78 
 &rst
  ixpk= 0, nxpk= 0, iat=1334,1331, r1= 1.30, r2= 1.80, r3= 4.78, r4= 5.28,  &end
#
# 75 RGUA H8 75 RGUA H2' 5.56 
 &rst
  ixpk= 0, nxpk= 0, iat=1334,1350, r1= 1.30, r2= 1.80, r3= 5.56, r4= 6.06,  &end
#
# 75 RGUA H8 75 RGUA H3' 6.00 
 &rst
  ixpk= 0, nxpk= 0, iat=1334,1348, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,  &end
#
# 76 RGUA H1' 76 RGUA H8 4.59 
 &rst
  ixpk= 0, nxpk= 0, iat=1365,1368, r1= 1.30, r2= 1.80, r3= 4.59, r4= 5.09,  &end
#
# 76 RGUA H2' 76 RGUA H8 3.67 
 &rst
  ixpk= 0, nxpk= 0, iat=1384,1368, r1= 1.30, r2= 1.80, r3= 3.67, r4= 4.17,  &end
#
# 76 RGUA H3' 77 RADE H3' 6.00 
 &rst
  ixpk= 0, nxpk= 0, iat=1382,1415, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,  &end
#
# 76 RGUA H3' 77 RADE H8 6.00 
 &rst
  ixpk= 0, nxpk= 0, iat=1382,1402, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,  &end
#
# 76 RGUA H4' 76 RGUA H1' 4.63 
 &rst
  ixpk= 0, nxpk= 0, iat=1362,1365, r1= 1.30, r2= 1.80, r3= 4.63, r4= 5.13,  &end
#
# 76 RGUA H4' 77 RADE H3' 5.20 
 &rst
  ixpk= 0, nxpk= 0, iat=1362,1415, r1= 1.30, r2= 1.80, r3= 5.20, r4= 5.70,  &end
#
# 76 RGUA H4' 77 RADE H8 5.30 
 &rst
  ixpk= 0, nxpk= 0, iat=1362,1402, r1= 1.30, r2= 1.80, r3= 5.30, r4= 5.80,  &end
#
# 76 RGUA H5" 76 RGUA H8 4.59 
 &rst
  ixpk= 0, nxpk= 0, iat=1360,1368, r1= 1.30, r2= 1.80, r3= 4.59, r4= 5.09,  &end
#
# 76 RGUA H5" 77 RADE H1' 4.46 
 &rst
  ixpk= 0, nxpk= 0, iat=1360,1399, r1= 1.30, r2= 1.80, r3= 4.46, r4= 4.96,  &end
#
# 76 RGUA H5' 77 RADE H1' 4.69 
 &rst
  ixpk= 0, nxpk= 0, iat=1359,1399, r1= 1.30, r2= 1.80, r3= 4.69, r4= 5.19,  &end
#
# 76 RGUA H5' 77 RADE H4' 5.30 
 &rst
  ixpk= 0, nxpk= 0, iat=1359,1396, r1= 1.30, r2= 1.80, r3= 5.30, r4= 5.80,  &end
#
# 76 RGUA H5" 77 RADE H4' 5.30 
 &rst
  ixpk= 0, nxpk= 0, iat=1360,1396, r1= 1.30, r2= 1.80, r3= 5.30, r4= 5.80,  &end
#
# 76 RGUA H8 76 RGUA H2' 3.93 
 &rst
  ixpk= 0, nxpk= 0, iat=1368,1384, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,  &end
#
# 77 RADE H1' 77 RADE H2 4.58 
 &rst
  ixpk= 0, nxpk= 0, iat=1399,1411, r1= 1.30, r2= 1.80, r3= 4.58, r4= 5.08,  &end
#
# 77 RADE H1' 77 RADE H8 4.58 
 &rst
  ixpk= 0, nxpk= 0, iat=1399,1402, r1= 1.30, r2= 1.80, r3= 4.58, r4= 5.08,  &end
#
# 77 RADE H1' 78 RADE H5' 5.00 
 &rst
  ixpk= 0, nxpk= 0, iat=1399,1426, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50,  &end
#
# 77 RADE H1' 79 RGUA H1' 4.72 
 &rst
  ixpk= 0, nxpk= 0, iat=1399,1465, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,  &end
#
# 77 RADE H1' 79 RGUA H4' 4.02 
 &rst
  ixpk= 0, nxpk= 0, iat=1399,1462, r1= 1.30, r2= 1.80, r3= 4.02, r4= 4.52,  &end
#
# 77 RADE H1' 79 RGUA H8 6.70 
 &rst
  ixpk= 0, nxpk= 0, iat=1399,1468, r1= 1.30, r2= 1.80, r3= 6.70, r4= 7.20,  &end
#
# 77 RADE H2 77 RADE H1' 4.77 
 &rst
  ixpk= 0, nxpk= 0, iat=1411,1399, r1= 1.30, r2= 1.80, r3= 4.77, r4= 5.27,  &end
#
# 77 RADE H2 79 RGUA H1' 4.46 
 &rst
  ixpk= 0, nxpk= 0, iat=1411,1465, r1= 1.30, r2= 1.80, r3= 4.46, r4= 4.96,  &end
#
# 77 RADE H2 79 RGUA H2' 5.50 
 &rst
  ixpk= 0, nxpk= 0, iat=1411,1484, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
# 77 RADE H2' 79 RGUA H8 4.85 
 &rst
  ixpk= 0, nxpk= 0, iat=1417,1468, r1= 1.30, r2= 1.80, r3= 4.85, r4= 5.35,  &end
#
# 77 RADE H3' 78 RADE H4' 4.50 
 &rst
  ixpk= 0, nxpk= 0, iat=1415,1429, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
# 77 RADE H3' 78 RADE H5' 3.99 
 &rst
  ixpk= 0, nxpk= 0, iat=1415,1426, r1= 1.30, r2= 1.80, r3= 3.99, r4= 4.49,  &end
#
# 77 RADE H3' 78 RADE H5" 4.07 
 &rst
  ixpk= 0, nxpk= 0, iat=1415,1427, r1= 1.30, r2= 1.80, r3= 4.07, r4= 4.57,  &end
#
# 77 RADE H8 77 RADE H1' 4.29 
 &rst
  ixpk= 0, nxpk= 0, iat=1402,1399, r1= 1.30, r2= 1.80, r3= 4.29, r4= 4.79,  &end
#
# 77 RADE H8 77 RADE H2' 5.19 
 &rst
  ixpk= 0, nxpk= 0, iat=1402,1417, r1= 1.30, r2= 1.80, r3= 5.19, r4= 5.69,  &end
#
# 77 RADE H8 77 RADE H3' 4.82 
 &rst
  ixpk= 0, nxpk= 0, iat=1402,1415, r1= 1.30, r2= 1.80, r3= 4.82, r4= 5.32,  &end
#
# 77 RADE H8 77 RADE H4' 5.00 
 &rst
  ixpk= 0, nxpk= 0, iat=1402,1396, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50,  &end
#
# 77 RADE H8 77 RADE H5" 6.00 
 &rst
  ixpk= 0, nxpk= 0, iat=1402,1394, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,  &end
#
# 77 RADE H8 77 RADE H5' 4.69 
 &rst
  ixpk= 0, nxpk= 0, iat=1402,1393, r1= 1.30, r2= 1.80, r3= 4.69, r4= 5.19,  &end
#
# 77 RADE H8 78 RADE H4' 4.57 
 &rst
  ixpk= 0, nxpk= 0, iat=1402,1429, r1= 1.30, r2= 1.80, r3= 4.57, r4= 5.07,  &end
#
# 77 RADE H8 78 RADE H5" 4.63 
 &rst
  ixpk= 0, nxpk= 0, iat=1402,1427, r1= 1.30, r2= 1.80, r3= 4.63, r4= 5.13,  &end
#
# 77 RADE H8 78 RADE H5' 5.19 
 &rst
  ixpk= 0, nxpk= 0, iat=1402,1426, r1= 1.30, r2= 1.80, r3= 5.19, r4= 5.69,  &end
#
# 78 RADE H1' 78 RADE H5" 5.00 
 &rst
  ixpk= 0, nxpk= 0, iat=1432,1427, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50,  &end
#
# 78 RADE H2 78 RADE H1' 5.50 
 &rst
  ixpk= 0, nxpk= 0, iat=1444,1432, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
# 78 RADE H3' 79 RGUA H5' 4.50 
 &rst
  ixpk= 0, nxpk= 0, iat=1448,1459, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
# 78 RADE H4' 79 RGUA H8 6.00 
 &rst
  ixpk= 0, nxpk= 0, iat=1429,1468, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,  &end
#
# 78 RADE H5' 79 RGUA H5' 6.00 
 &rst
  ixpk= 0, nxpk= 0, iat=1426,1459, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,  &end
#
# 78 RADE H8 78 RADE H1' 4.19 
 &rst
  ixpk= 0, nxpk= 0, iat=1435,1432, r1= 1.30, r2= 1.80, r3= 4.19, r4= 4.69,  &end
#
# 78 RADE H8 78 RADE H2' 2.80 
 &rst
  ixpk= 0, nxpk= 0, iat=1435,1450, r1= 1.30, r2= 1.80, r3= 2.80, r4= 3.30,  &end
#
# 78 RADE H8 78 RADE H3' 4.80 
 &rst
  ixpk= 0, nxpk= 0, iat=1435,1448, r1= 1.30, r2= 1.80, r3= 4.80, r4= 5.30,  &end
#
# 78 RADE H8 78 RADE H4' 5.00 
 &rst
  ixpk= 0, nxpk= 0, iat=1435,1429, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50,  &end
#
# 78 RADE H8 78 RADE H5' 4.30 
 &rst
  ixpk= 0, nxpk= 0, iat=1435,1426, r1= 1.30, r2= 1.80, r3= 4.30, r4= 4.80,  &end
#
# 78 RADE H8 78 RADE H5" 4.50 
 &rst
  ixpk= 0, nxpk= 0, iat=1435,1427, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
# 79 RGUA H1' 79 RGUA H8 4.00 
 &rst
  ixpk= 0, nxpk= 0, iat=1465,1468, r1= 1.30, r2= 1.80, r3= 4.00, r4= 4.50,  &end
#
# 79 RGUA H1 80 RCYT H1' 5.83 
 &rst
  ixpk= 0, nxpk= 0, iat=1474,1499, r1= 1.30, r2= 1.80, r3= 5.83, r4= 6.33,  &end
#
# 79 RGUA H1' 80 RCYT H6 4.70 
 &rst
  ixpk= 0, nxpk= 0, iat=1465,1502, r1= 1.30, r2= 1.80, r3= 4.70, r4= 5.20,  &end
#
# 79 RGUA H2' 80 RCYT H5 4.42 
 &rst
  ixpk= 0, nxpk= 0, iat=1484,1504, r1= 1.30, r2= 1.80, r3= 4.42, r4= 4.92,  &end
#
# 79 RGUA H2' 80 RCYT H6 4.04 
 &rst
  ixpk= 0, nxpk= 0, iat=1484,1502, r1= 1.30, r2= 1.80, r3= 4.04, r4= 4.54,  &end
#
# 79 RGUA H8 79 RGUA H1' 5.20 
 &rst
  ixpk= 0, nxpk= 0, iat=1468,1465, r1= 1.30, r2= 1.80, r3= 5.20, r4= 5.70,  &end
#
# 79 RGUA H8 79 RGUA H2' 4.45 
 &rst
  ixpk= 0, nxpk= 0, iat=1468,1484, r1= 1.30, r2= 1.80, r3= 4.45, r4= 4.95,  &end
#
# 79 RGUA H8 80 RCYT H5 4.89 
 &rst
  ixpk= 0, nxpk= 0, iat=1468,1504, r1= 1.30, r2= 1.80, r3= 4.89, r4= 5.39,  &end
#
# 79 RGUA H8 80 RCYT H5 5.35 
 &rst
  ixpk= 0, nxpk= 0, iat=1468,1504, r1= 1.30, r2= 1.80, r3= 5.35, r4= 5.85,  &end
#
# 80 RCYT H1' 80 RCYT H6 4.37 
 &rst
  ixpk= 0, nxpk= 0, iat=1499,1502, r1= 1.30, r2= 1.80, r3= 4.37, r4= 4.87,  &end
#
# 80 RCYT H1' 81 RGUA H8 4.24 
 &rst
  ixpk= 0, nxpk= 0, iat=1499,1533, r1= 1.30, r2= 1.80, r3= 4.24, r4= 4.74,  &end
#
# 80 RCYT H2' 81 RGUA H8 2.40 
 &rst
  ixpk= 0, nxpk= 0, iat=1515,1533, r1= 1.30, r2= 1.80, r3= 2.40, r4= 2.90,  &end
#
# 80 RCYT H3' 80 RCYT H6 3.54 
 &rst
  ixpk= 0, nxpk= 0, iat=1513,1502, r1= 1.30, r2= 1.80, r3= 3.54, r4= 4.04,  &end
#
# 80 RCYT H3' 81 RGUA H8 3.50 
 &rst
  ixpk= 0, nxpk= 0, iat=1513,1533, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
# 80 RCYT H5 80 RCYT H3' 5.50 
 &rst
  ixpk= 0, nxpk= 0, iat=1504,1513, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
# 80 RCYT H6 80 RCYT H1' 4.24 
 &rst
  ixpk= 0, nxpk= 0, iat=1502,1499, r1= 1.30, r2= 1.80, r3= 4.24, r4= 4.74,  &end
#
# 80 RCYT H6 80 RCYT H2' 4.34 
 &rst
  ixpk= 0, nxpk= 0, iat=1502,1515, r1= 1.30, r2= 1.80, r3= 4.34, r4= 4.84,  &end
#
# 80 RCYT H6 80 RCYT H3' 3.50 
 &rst
  ixpk= 0, nxpk= 0, iat=1502,1513, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
# 81 RGUA H1' 81 RGUA H3' 4.72 
 &rst
  ixpk= 0, nxpk= 0, iat=1530,1547, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,  &end
#
# 81 RGUA H1' 81 RGUA H8 4.02 
 &rst
  ixpk= 0, nxpk= 0, iat=1530,1533, r1= 1.30, r2= 1.80, r3= 4.02, r4= 4.52,  &end
#
# 81 RGUA H1 82 RADE H1' 4.85 
 &rst
  ixpk= 0, nxpk= 0, iat=1539,1564, r1= 1.30, r2= 1.80, r3= 4.85, r4= 5.35,  &end
#
# 81 RGUA H1 82 RADE H2 5.80 
 &rst
  ixpk= 0, nxpk= 0, iat=1539,1576, r1= 1.30, r2= 1.80, r3= 5.80, r4= 6.30,  &end
#
# 81 RGUA H1' 82 RADE H8 4.60 
 &rst
  ixpk= 0, nxpk= 0, iat=1530,1567, r1= 1.30, r2= 1.80, r3= 4.60, r4= 5.10,  &end
#
# 81 RGUA H1 82 RADE H8 6.24 
 &rst
  ixpk= 0, nxpk= 0, iat=1539,1567, r1= 1.30, r2= 1.80, r3= 6.24, r4= 6.74,  &end
#
# 81 RGUA H2' 82 RADE H8 2.50 
 &rst
  ixpk= 0, nxpk= 0, iat=1549,1567, r1= 1.30, r2= 1.80, r3= 2.50, r4= 3.00,  &end
#
# 81 RGUA H3' 82 RADE H8 3.00 
 &rst
  ixpk= 0, nxpk= 0, iat=1547,1567, r1= 1.30, r2= 1.80, r3= 3.00, r4= 3.50,  &end
#
# 81 RGUA H5" 82 RADE H8 6.00 
 &rst
  ixpk= 0, nxpk= 0, iat=1525,1567, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,  &end
#
# 81 RGUA H8 81 RGUA H1' 4.63 
 &rst
  ixpk= 0, nxpk= 0, iat=1533,1530, r1= 1.30, r2= 1.80, r3= 4.63, r4= 5.13,  &end
#
# 81 RGUA H8 81 RGUA H3' 4.63 
 &rst
  ixpk= 0, nxpk= 0, iat=1533,1547, r1= 1.30, r2= 1.80, r3= 4.63, r4= 5.13,  &end
#
# 82 RADE H1' 82 RADE H3' 4.63 
 &rst
  ixpk= 0, nxpk= 0, iat=1564,1580, r1= 1.30, r2= 1.80, r3= 4.63, r4= 5.13,  &end
#
# 82 RADE H1' 83 URA H5 6.00 
 &rst
  ixpk= 0, nxpk= 0, iat=1564,1602, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,  &end
#
# 82 RADE H1' 83 URA H6 4.50 
 &rst
  ixpk= 0, nxpk= 0, iat=1564,1600, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
# 82 RADE H2 82 RADE H1' 5.35 
 &rst
  ixpk= 0, nxpk= 0, iat=1576,1564, r1= 1.30, r2= 1.80, r3= 5.35, r4= 5.85,  &end
#
# 82 RADE H2 83 URA H1' 3.50 
 &rst
  ixpk= 0, nxpk= 0, iat=1576,1597, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
# 82 RADE H2' 83 URA H1' 4.41 
 &rst
  ixpk= 0, nxpk= 0, iat=1582,1597, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,  &end
#
# 82 RADE H2' 83 URA H5 5.00 
 &rst
  ixpk= 0, nxpk= 0, iat=1582,1602, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50,  &end
#
# 82 RADE H2' 83 URA H6 2.50 
 &rst
  ixpk= 0, nxpk= 0, iat=1582,1600, r1= 1.30, r2= 1.80, r3= 2.50, r4= 3.00,  &end
#
# 82 RADE H3' 83 URA H5 4.63 
 &rst
  ixpk= 0, nxpk= 0, iat=1580,1602, r1= 1.30, r2= 1.80, r3= 4.63, r4= 5.13,  &end
#
# 82 RADE H8 82 RADE H1' 5.56 
 &rst
  ixpk= 0, nxpk= 0, iat=1567,1564, r1= 1.30, r2= 1.80, r3= 5.56, r4= 6.06,  &end
#
# 82 RADE H8 82 RADE H2' 5.56 
 &rst
  ixpk= 0, nxpk= 0, iat=1567,1582, r1= 1.30, r2= 1.80, r3= 5.56, r4= 6.06,  &end
#
# 82 RADE H8 82 RADE H3' 4.24 
 &rst
  ixpk= 0, nxpk= 0, iat=1567,1580, r1= 1.30, r2= 1.80, r3= 4.24, r4= 4.74,  &end
#
# 83 URA H1' 84 RCYT H5 6.00 
 &rst
  ixpk= 0, nxpk= 0, iat=1597,1632, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,  &end
#
# 83 URA H1' 84 RCYT H6 4.50 
 &rst
  ixpk= 0, nxpk= 0, iat=1597,1630, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
# 83 URA H2' 84 RCYT H5 5.00 
 &rst
  ixpk= 0, nxpk= 0, iat=1612,1632, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50,  &end
#
# 83 URA H2' 84 RCYT H5" 3.82 
 &rst
  ixpk= 0, nxpk= 0, iat=1612,1622, r1= 1.30, r2= 1.80, r3= 3.82, r4= 4.32,  &end
#
# 83 URA H2' 84 RCYT H5" 4.09 
 &rst
  ixpk= 0, nxpk= 0, iat=1612,1622, r1= 1.30, r2= 1.80, r3= 4.09, r4= 4.59,  &end
#
# 83 URA H2' 84 RCYT H6 2.50 
 &rst
  ixpk= 0, nxpk= 0, iat=1612,1630, r1= 1.30, r2= 1.80, r3= 2.50, r4= 3.00,  &end
#
# 83 URA H3' 84 RCYT H5" 5.50 
 &rst
  ixpk= 0, nxpk= 0, iat=1610,1622, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
# 83 URA H3' 84 RCYT H5 5.30 
 &rst
  ixpk= 0, nxpk= 0, iat=1610,1632, r1= 1.30, r2= 1.80, r3= 5.30, r4= 5.80,  &end
#
# 83 URA H3 84 RCYT H5 6.24 
 &rst
  ixpk= 0, nxpk= 0, iat=1606,1632, r1= 1.30, r2= 1.80, r3= 6.24, r4= 6.74,  &end
#
# 83 URA H3' 84 RCYT H6 4.34 
 &rst
  ixpk= 0, nxpk= 0, iat=1610,1630, r1= 1.30, r2= 1.80, r3= 4.34, r4= 4.84,  &end
#
# 83 URA H3' 84 RCYT H6 3.00 
 &rst
  ixpk= 0, nxpk= 0, iat=1610,1630, r1= 1.30, r2= 1.80, r3= 3.00, r4= 3.50,  &end
#
# 83 URA H5 84 RCYT H5 5.06 
 &rst
  ixpk= 0, nxpk= 0, iat=1602,1632, r1= 1.30, r2= 1.80, r3= 5.06, r4= 5.56,  &end
#
# 83 URA H6 83 URA H2' 4.20 
 &rst
  ixpk= 0, nxpk= 0, iat=1600,1612, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,  &end
#
# 83 URA H6 83 URA H5" 4.57 
 &rst
  ixpk= 0, nxpk= 0, iat=1600,1592, r1= 1.30, r2= 1.80, r3= 4.57, r4= 5.07,  &end
#
# 83 URA H6 83 URA H5' 4.85 
 &rst
  ixpk= 0, nxpk= 0, iat=1600,1591, r1= 1.30, r2= 1.80, r3= 4.85, r4= 5.35,  &end
#
# 84 RCYT H2' 85 RCYT H5 5.00 
 &rst
  ixpk= 0, nxpk= 0, iat=1643,1663, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50,  &end
#
# 84 RCYT H2' 85 RCYT H6 2.50 
 &rst
  ixpk= 0, nxpk= 0, iat=1643,1661, r1= 1.30, r2= 1.80, r3= 2.50, r4= 3.00,  &end
#
# 84 RCYT H3' 85 RCYT H6 3.80 
 &rst
  ixpk= 0, nxpk= 0, iat=1641,1661, r1= 1.30, r2= 1.80, r3= 3.80, r4= 4.30,  &end
#
# 84 RCYT H6 84 RCYT H1' 4.48 
 &rst
  ixpk= 0, nxpk= 0, iat=1630,1627, r1= 1.30, r2= 1.80, r3= 4.48, r4= 4.98,  &end
#
# 84 RCYT H6 84 RCYT H2' 5.06 
 &rst
  ixpk= 0, nxpk= 0, iat=1630,1643, r1= 1.30, r2= 1.80, r3= 5.06, r4= 5.56,  &end
#
# 84 RCYT H6 84 RCYT H3' 4.41 
 &rst
  ixpk= 0, nxpk= 0, iat=1630,1641, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,  &end
#
# 84 RCYT H6 84 RCYT H5" 5.35 
 &rst
  ixpk= 0, nxpk= 0, iat=1630,1622, r1= 1.30, r2= 1.80, r3= 5.35, r4= 5.85,  &end
#
# 85 RCYT H1' 86 RCYT H6 4.50 
 &rst
  ixpk= 0, nxpk= 0, iat=1658,1692, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
# 85 RCYT H2' 86 RCYT H1' 4.59 
 &rst
  ixpk= 0, nxpk= 0, iat=1674,1689, r1= 1.30, r2= 1.80, r3= 4.59, r4= 5.09,  &end
#
# 85 RCYT H2' 86 RCYT H6 2.50 
 &rst
  ixpk= 0, nxpk= 0, iat=1674,1692, r1= 1.30, r2= 1.80, r3= 2.50, r4= 3.00,  &end
#
# 85 RCYT H3' 86 RCYT H6 3.79 
 &rst
  ixpk= 0, nxpk= 0, iat=1672,1692, r1= 1.30, r2= 1.80, r3= 3.79, r4= 4.29,  &end
#
# 85 RCYT H6 85 RCYT H1' 3.99 
 &rst
  ixpk= 0, nxpk= 0, iat=1661,1658, r1= 1.30, r2= 1.80, r3= 3.99, r4= 4.49,  &end
#
# 85 RCYT H6 85 RCYT H3' 3.73 
 &rst
  ixpk= 0, nxpk= 0, iat=1661,1672, r1= 1.30, r2= 1.80, r3= 3.73, r4= 4.23,  &end
#
# 85 RCYT H6 85 RCYT H4' 4.42 
 &rst
  ixpk= 0, nxpk= 0, iat=1661,1655, r1= 1.30, r2= 1.80, r3= 4.42, r4= 4.92,  &end
#
# 86 RCYT H1' 86 RCYT H6 4.00 
 &rst
  ixpk= 0, nxpk= 0, iat=1689,1692, r1= 1.30, r2= 1.80, r3= 4.00, r4= 4.50,  &end
#
# 86 RCYT H3' 86 RCYT H6 3.56 
 &rst
  ixpk= 0, nxpk= 0, iat=1703,1692, r1= 1.30, r2= 1.80, r3= 3.56, r4= 4.06,  &end
#
# 86 RCYT H6 86 RCYT H1' 3.91 
 &rst
  ixpk= 0, nxpk= 0, iat=1692,1689, r1= 1.30, r2= 1.80, r3= 3.91, r4= 4.41,  &end
#
# 86 RCYT H6 86 RCYT H2' 3.79 
 &rst
  ixpk= 0, nxpk= 0, iat=1692,1705, r1= 1.30, r2= 1.80, r3= 3.79, r4= 4.29,  &end
#
# 86 RCYT H6 86 RCYT H2' 4.07 
 &rst
  ixpk= 0, nxpk= 0, iat=1692,1705, r1= 1.30, r2= 1.80, r3= 4.07, r4= 4.57,  &end
#
# 86 RCYT H6 86 RCYT H3' 3.67 
 &rst
  ixpk= 0, nxpk= 0, iat=1692,1703, r1= 1.30, r2= 1.80, r3= 3.67, r4= 4.17,  &end
#
# 152 RGUA H1' 153 RGUA H8 4.52 
 &rst
  ixpk= 0, nxpk= 0, iat=2746,2783, r1= 1.30, r2= 1.80, r3= 4.52, r4= 5.02,  &end
#
# 152 RGUA H2' 153 RGUA H1' 4.21 
 &rst
  ixpk= 0, nxpk= 0, iat=2765,2780, r1= 1.30, r2= 1.80, r3= 4.21, r4= 4.71,  &end
#
# 152 RGUA H2' 153 RGUA H5' 4.28 
 &rst
  ixpk= 0, nxpk= 0, iat=2765,2774, r1= 1.30, r2= 1.80, r3= 4.28, r4= 4.78,  &end
#
# 152 RGUA H2' 153 RGUA H8 3.24 
 &rst
  ixpk= 0, nxpk= 0, iat=2765,2783, r1= 1.30, r2= 1.80, r3= 3.24, r4= 3.74,  &end
#
# 152 RGUA H3' 153 RGUA H8 3.73 
 &rst
  ixpk= 0, nxpk= 0, iat=2763,2783, r1= 1.30, r2= 1.80, r3= 3.73, r4= 4.23,  &end
#
# 152 RGUA H8 152 RGUA H1' 4.72 
 &rst
  ixpk= 0, nxpk= 0, iat=2749,2746, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,  &end
#
# 152 RGUA H8 152 RGUA H2' 4.83 
 &rst
  ixpk= 0, nxpk= 0, iat=2749,2765, r1= 1.30, r2= 1.80, r3= 4.83, r4= 5.33,  &end
#
# 152 RGUA H8 152 RGUA H3' 4.96 
 &rst
  ixpk= 0, nxpk= 0, iat=2749,2763, r1= 1.30, r2= 1.80, r3= 4.96, r4= 5.46,  &end
#
# 152 RGUA H8 152 RGUA H4' 4.89 
 &rst
  ixpk= 0, nxpk= 0, iat=2749,2743, r1= 1.30, r2= 1.80, r3= 4.89, r4= 5.39,  &end
#
# 152 RGUA H8 152 RGUA H5' 5.03 
 &rst
  ixpk= 0, nxpk= 0, iat=2749,2740, r1= 1.30, r2= 1.80, r3= 5.03, r4= 5.53,  &end
#
# 152 RGUA H8 152 RGUA H5" 5.03 
 &rst
  ixpk= 0, nxpk= 0, iat=2749,2741, r1= 1.30, r2= 1.80, r3= 5.03, r4= 5.53,  &end
#
# 152 RGUA H8 153 RGUA H8 4.85 
 &rst
  ixpk= 0, nxpk= 0, iat=2749,2783, r1= 1.30, r2= 1.80, r3= 4.85, r4= 5.35,  &end
#
# 153 RGUA H1 154 RGUA H1 4.16 
 &rst
  ixpk= 0, nxpk= 0, iat=2789,2823, r1= 1.30, r2= 1.80, r3= 4.16, r4= 4.66,  &end
#
# 153 RGUA H1' 154 RGUA H8 3.98 
 &rst
  ixpk= 0, nxpk= 0, iat=2780,2817, r1= 1.30, r2= 1.80, r3= 3.98, r4= 4.48,  &end
#
# 153 RGUA H1' 154 RGUA H8 4.48 
 &rst
  ixpk= 0, nxpk= 0, iat=2780,2817, r1= 1.30, r2= 1.80, r3= 4.48, r4= 4.98,  &end
#
# 153 RGUA H1 172 RCYT H1' 6.24 
 &rst
  ixpk= 0, nxpk= 0, iat=2789,3398, r1= 1.30, r2= 1.80, r3= 6.24, r4= 6.74,  &end
#
# 153 RGUA H2' 154 RGUA H8 2.40 
 &rst
  ixpk= 0, nxpk= 0, iat=2799,2817, r1= 1.30, r2= 1.80, r3= 2.40, r4= 2.90,  &end
#
# 153 RGUA H3' 154 RGUA H8 4.33 
 &rst
  ixpk= 0, nxpk= 0, iat=2797,2817, r1= 1.30, r2= 1.80, r3= 4.33, r4= 4.83,  &end
#
# 153 RGUA H8 153 RGUA H1' 4.25 
 &rst
  ixpk= 0, nxpk= 0, iat=2783,2780, r1= 1.30, r2= 1.80, r3= 4.25, r4= 4.75,  &end
#
# 153 RGUA H8 153 RGUA H3' 3.89 
 &rst
  ixpk= 0, nxpk= 0, iat=2783,2797, r1= 1.30, r2= 1.80, r3= 3.89, r4= 4.39,  &end
#
# 153 RGUA H8 153 RGUA H4' 5.00 
 &rst
  ixpk= 0, nxpk= 0, iat=2783,2777, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50,  &end
#
# 153 RGUA H8 153 RGUA H5" 5.00 
 &rst
  ixpk= 0, nxpk= 0, iat=2783,2775, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50,  &end
#
# 153 RGUA H8 153 RGUA H5' 5.00 
 &rst
  ixpk= 0, nxpk= 0, iat=2783,2774, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50,  &end
#
# 153 RGUA H8 154 RGUA H8 5.35 
 &rst
  ixpk= 0, nxpk= 0, iat=2783,2817, r1= 1.30, r2= 1.80, r3= 5.35, r4= 5.85,  &end
#
# 154 RGUA H1' 154 RGUA H8 4.37 
 &rst
  ixpk= 0, nxpk= 0, iat=2814,2817, r1= 1.30, r2= 1.80, r3= 4.37, r4= 4.87,  &end
#
# 154 RGUA H1 155 RADE H1' 5.06 
 &rst
  ixpk= 0, nxpk= 0, iat=2823,2848, r1= 1.30, r2= 1.80, r3= 5.06, r4= 5.56,  &end
#
# 154 RGUA H1' 155 RADE H1' 6.00 
 &rst
  ixpk= 0, nxpk= 0, iat=2814,2848, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,  &end
#
# 154 RGUA H1' 155 RADE H8 4.50 
 &rst
  ixpk= 0, nxpk= 0, iat=2814,2851, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
# 154 RGUA H1 169 URA H3 4.40 
 &rst
  ixpk= 0, nxpk= 0, iat=2823,3315, r1= 1.30, r2= 1.80, r3= 4.40, r4= 4.90,  &end
#
# 154 RGUA H1 170 RCYT H1' 5.19 
 &rst
  ixpk= 0, nxpk= 0, iat=2823,3336, r1= 1.30, r2= 1.80, r3= 5.19, r4= 5.69,  &end
#
# 154 RGUA H1 170 RCYT H41 4.69 
 &rst
  ixpk= 0, nxpk= 0, iat=2823,3344, r1= 1.30, r2= 1.80, r3= 4.69, r4= 5.19,  &end
#
# 154 RGUA H1 170 RCYT H42 4.63 
 &rst
  ixpk= 0, nxpk= 0, iat=2823,3345, r1= 1.30, r2= 1.80, r3= 4.63, r4= 5.13,  &end
#
# 154 RGUA H1 170 RCYT H5 5.19 
 &rst
  ixpk= 0, nxpk= 0, iat=2823,3341, r1= 1.30, r2= 1.80, r3= 5.19, r4= 5.69,  &end
#
# 154 RGUA H1 171 RCYT H1' 5.06 
 &rst
  ixpk= 0, nxpk= 0, iat=2823,3367, r1= 1.30, r2= 1.80, r3= 5.06, r4= 5.56,  &end
#
# 154 RGUA H1 171 RCYT H6 5.56 
 &rst
  ixpk= 0, nxpk= 0, iat=2823,3370, r1= 1.30, r2= 1.80, r3= 5.56, r4= 6.06,  &end
#
# 154 RGUA H2' 155 RADE H1' 4.77 
 &rst
  ixpk= 0, nxpk= 0, iat=2833,2848, r1= 1.30, r2= 1.80, r3= 4.77, r4= 5.27,  &end
#
# 154 RGUA H2' 155 RADE H5" 5.00 
 &rst
  ixpk= 0, nxpk= 0, iat=2833,2843, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50,  &end
#
# 154 RGUA H2' 155 RADE H8 2.40 
 &rst
  ixpk= 0, nxpk= 0, iat=2833,2851, r1= 1.30, r2= 1.80, r3= 2.40, r4= 2.90,  &end
#
# 154 RGUA H3' 154 RGUA H8 3.42 
 &rst
  ixpk= 0, nxpk= 0, iat=2831,2817, r1= 1.30, r2= 1.80, r3= 3.42, r4= 3.92,  &end
#
# 154 RGUA H3' 155 RADE H8 3.74 
 &rst
  ixpk= 0, nxpk= 0, iat=2831,2851, r1= 1.30, r2= 1.80, r3= 3.74, r4= 4.24,  &end
#
# 154 RGUA H5" 154 RGUA H8 4.16 
 &rst
  ixpk= 0, nxpk= 0, iat=2809,2817, r1= 1.30, r2= 1.80, r3= 4.16, r4= 4.66,  &end
#
# 154 RGUA H8 154 RGUA H3' 4.19 
 &rst
  ixpk= 0, nxpk= 0, iat=2817,2831, r1= 1.30, r2= 1.80, r3= 4.19, r4= 4.69,  &end
#
# 154 RGUA H8 154 RGUA H4' 4.69 
 &rst
  ixpk= 0, nxpk= 0, iat=2817,2811, r1= 1.30, r2= 1.80, r3= 4.69, r4= 5.19,  &end
#
# 154 RGUA H8 154 RGUA H5" 4.69 
 &rst
  ixpk= 0, nxpk= 0, iat=2817,2809, r1= 1.30, r2= 1.80, r3= 4.69, r4= 5.19,  &end
#
# 154 RGUA H8 155 RADE H8 4.82 
 &rst
  ixpk= 0, nxpk= 0, iat=2817,2851, r1= 1.30, r2= 1.80, r3= 4.82, r4= 5.32,  &end
#
# 155 RADE H1' 156 URA H5 5.83 
 &rst
  ixpk= 0, nxpk= 0, iat=2848,2886, r1= 1.30, r2= 1.80, r3= 5.83, r4= 6.33,  &end
#
# 155 RADE H1' 156 URA H6 5.00 
 &rst
  ixpk= 0, nxpk= 0, iat=2848,2884, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50,  &end
#
# 155 RADE H2 155 RADE H1' 5.19 
 &rst
  ixpk= 0, nxpk= 0, iat=2860,2848, r1= 1.30, r2= 1.80, r3= 5.19, r4= 5.69,  &end
#
# 155 RADE H2 156 URA H1' 3.70 
 &rst
  ixpk= 0, nxpk= 0, iat=2860,2881, r1= 1.30, r2= 1.80, r3= 3.70, r4= 4.20,  &end
#
# 155 RADE H2' 156 URA H5 5.00 
 &rst
  ixpk= 0, nxpk= 0, iat=2866,2886, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50,  &end
#
# 155 RADE H2' 156 URA H6 4.25 
 &rst
  ixpk= 0, nxpk= 0, iat=2866,2884, r1= 1.30, r2= 1.80, r3= 4.25, r4= 4.75,  &end
#
# 155 RADE H2 169 URA H3 4.51 
 &rst
  ixpk= 0, nxpk= 0, iat=2860,3315, r1= 1.30, r2= 1.80, r3= 4.51, r4= 5.01,  &end
#
# 155 RADE H2 170 RCYT H1' 3.59 
 &rst
  ixpk= 0, nxpk= 0, iat=2860,3336, r1= 1.30, r2= 1.80, r3= 3.59, r4= 4.09,  &end
#
# 155 RADE H2 170 RCYT H2' 5.50 
 &rst
  ixpk= 0, nxpk= 0, iat=2860,3352, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
# 155 RADE H2 170 RCYT H5 5.00 
 &rst
  ixpk= 0, nxpk= 0, iat=2860,3341, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50,  &end
#
# 155 RADE H3' 156 URA H5 5.00 
 &rst
  ixpk= 0, nxpk= 0, iat=2864,2886, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50,  &end
#
# 155 RADE H3' 156 URA H6 3.00 
 &rst
  ixpk= 0, nxpk= 0, iat=2864,2884, r1= 1.30, r2= 1.80, r3= 3.00, r4= 3.50,  &end
#
# 155 RADE H8 155 RADE H1' 4.02 
 &rst
  ixpk= 0, nxpk= 0, iat=2851,2848, r1= 1.30, r2= 1.80, r3= 4.02, r4= 4.52,  &end
#
# 155 RADE H8 155 RADE H2' 4.50 
 &rst
  ixpk= 0, nxpk= 0, iat=2851,2866, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
# 155 RADE H8 155 RADE H3' 3.93 
 &rst
  ixpk= 0, nxpk= 0, iat=2851,2864, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,  &end
#
# 155 RADE H8 155 RADE H4' 5.00 
 &rst
  ixpk= 0, nxpk= 0, iat=2851,2845, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50,  &end
#
# 155 RADE H8 156 URA H5 5.00 
 &rst
  ixpk= 0, nxpk= 0, iat=2851,2886, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50,  &end
#
# 155 RADE H8 156 URA H6 5.00 
 &rst
  ixpk= 0, nxpk= 0, iat=2851,2884, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50,  &end
#
# 156 URA H1' 156 URA H6 4.58 
 &rst
  ixpk= 0, nxpk= 0, iat=2881,2884, r1= 1.30, r2= 1.80, r3= 4.58, r4= 5.08,  &end
#
# 156 URA H1' 157 RCYT H5 6.00 
 &rst
  ixpk= 0, nxpk= 0, iat=2881,2916, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,  &end
#
# 156 URA H1' 157 RCYT H6 4.50 
 &rst
  ixpk= 0, nxpk= 0, iat=2881,2914, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
# 156 URA H1' 169 URA H3 6.00 
 &rst
  ixpk= 0, nxpk= 0, iat=2881,3315, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,  &end
#
# 156 URA H2' 157 RCYT H1' 4.50 
 &rst
  ixpk= 0, nxpk= 0, iat=2896,2911, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
# 156 URA H2' 157 RCYT H5 3.82 
 &rst
  ixpk= 0, nxpk= 0, iat=2896,2916, r1= 1.30, r2= 1.80, r3= 3.82, r4= 4.32,  &end
#
# 156 URA H2' 157 RCYT H6 2.40 
 &rst
  ixpk= 0, nxpk= 0, iat=2896,2914, r1= 1.30, r2= 1.80, r3= 2.40, r4= 2.90,  &end
#
# 156 URA H3 157 RCYT H1' 5.56 
 &rst
  ixpk= 0, nxpk= 0, iat=2890,2911, r1= 1.30, r2= 1.80, r3= 5.56, r4= 6.06,  &end
#
# 156 URA H3 167 RGUA H1 4.45 
 &rst
  ixpk= 0, nxpk= 0, iat=2890,3248, r1= 1.30, r2= 1.80, r3= 4.45, r4= 4.95,  &end
#
# 156 URA H3 168 RADE H2 4.32 
 &rst
  ixpk= 0, nxpk= 0, iat=2890,3285, r1= 1.30, r2= 1.80, r3= 4.32, r4= 4.82,  &end
#
# 156 URA H3 169 URA H1' 6.24 
 &rst
  ixpk= 0, nxpk= 0, iat=2890,3306, r1= 1.30, r2= 1.80, r3= 6.24, r4= 6.74,  &end
#
# 156 URA H3 169 URA H3 3.62 
 &rst
  ixpk= 0, nxpk= 0, iat=2890,3315, r1= 1.30, r2= 1.80, r3= 3.62, r4= 4.12,  &end
#
# 156 URA H5 157 RCYT H5 5.00 
 &rst
  ixpk= 0, nxpk= 0, iat=2886,2916, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50,  &end
#
# 156 URA H6 156 URA H2' 4.41 
 &rst
  ixpk= 0, nxpk= 0, iat=2884,2896, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,  &end
#
# 157 RCYT H1' 158 RGUA H8 4.72 
 &rst
  ixpk= 0, nxpk= 0, iat=2911,2945, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,  &end
#
# 157 RCYT H1' 167 RGUA H1 5.50 
 &rst
  ixpk= 0, nxpk= 0, iat=2911,3248, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
# 157 RCYT H1' 168 RADE H2 3.50 
 &rst
  ixpk= 0, nxpk= 0, iat=2911,3285, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
# 157 RCYT H2' 158 RGUA H8 2.40 
 &rst
  ixpk= 0, nxpk= 0, iat=2927,2945, r1= 1.30, r2= 1.80, r3= 2.40, r4= 2.90,  &end
#
# 157 RCYT H2' 168 RADE H2 5.50 
 &rst
  ixpk= 0, nxpk= 0, iat=2927,3285, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
# 157 RCYT H3' 158 RGUA H8 4.95 
 &rst
  ixpk= 0, nxpk= 0, iat=2925,2945, r1= 1.30, r2= 1.80, r3= 4.95, r4= 5.45,  &end
#
# 157 RCYT H41 167 RGUA H1 4.69 
 &rst
  ixpk= 0, nxpk= 0, iat=2919,3248, r1= 1.30, r2= 1.80, r3= 4.69, r4= 5.19,  &end
#
# 157 RCYT H42 167 RGUA H1 4.46 
 &rst
  ixpk= 0, nxpk= 0, iat=2920,3248, r1= 1.30, r2= 1.80, r3= 4.46, r4= 4.96,  &end
#
# 157 RCYT H6 157 RCYT H1' 3.74 
 &rst
  ixpk= 0, nxpk= 0, iat=2914,2911, r1= 1.30, r2= 1.80, r3= 3.74, r4= 4.24,  &end
#
# 157 RCYT H6 157 RCYT H4' 5.00 
 &rst
  ixpk= 0, nxpk= 0, iat=2914,2908, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50,  &end
#
# 157 RCYT H6 157 RCYT H5" 4.78 
 &rst
  ixpk= 0, nxpk= 0, iat=2914,2906, r1= 1.30, r2= 1.80, r3= 4.78, r4= 5.28,  &end
#
# 157 RCYT H6 167 RGUA H1 5.56 
 &rst
  ixpk= 0, nxpk= 0, iat=2914,3248, r1= 1.30, r2= 1.80, r3= 5.56, r4= 6.06,  &end
#
# 158 RGUA H1' 159 RCYT H1' 6.00 
 &rst
  ixpk= 0, nxpk= 0, iat=2942,2976, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,  &end
#
# 158 RGUA H1 159 RCYT H5 5.83 
 &rst
  ixpk= 0, nxpk= 0, iat=2951,2981, r1= 1.30, r2= 1.80, r3= 5.83, r4= 6.33,  &end
#
# 158 RGUA H1' 159 RCYT H6 5.35 
 &rst
  ixpk= 0, nxpk= 0, iat=2942,2979, r1= 1.30, r2= 1.80, r3= 5.35, r4= 5.85,  &end
#
# 158 RGUA H1 165 RGUA H1 4.16 
 &rst
  ixpk= 0, nxpk= 0, iat=2951,3183, r1= 1.30, r2= 1.80, r3= 4.16, r4= 4.66,  &end
#
# 158 RGUA H1 166 RCYT H41 5.56 
 &rst
  ixpk= 0, nxpk= 0, iat=2951,3216, r1= 1.30, r2= 1.80, r3= 5.56, r4= 6.06,  &end
#
# 158 RGUA H1 166 RCYT H5 5.56 
 &rst
  ixpk= 0, nxpk= 0, iat=2951,3213, r1= 1.30, r2= 1.80, r3= 5.56, r4= 6.06,  &end
#
# 158 RGUA H1' 167 RGUA H1 4.77 
 &rst
  ixpk= 0, nxpk= 0, iat=2942,3248, r1= 1.30, r2= 1.80, r3= 4.77, r4= 5.27,  &end
#
# 158 RGUA H1 167 RGUA H1' 5.35 
 &rst
  ixpk= 0, nxpk= 0, iat=2951,3239, r1= 1.30, r2= 1.80, r3= 5.35, r4= 5.85,  &end
#
# 158 RGUA H8 158 RGUA H1' 4.63 
 &rst
  ixpk= 0, nxpk= 0, iat=2945,2942, r1= 1.30, r2= 1.80, r3= 4.63, r4= 5.13,  &end
#
# 158 RGUA H8 158 RGUA H2' 4.00 
 &rst
  ixpk= 0, nxpk= 0, iat=2945,2961, r1= 1.30, r2= 1.80, r3= 4.00, r4= 4.50,  &end
#
# 158 RGUA H8 158 RGUA H3' 3.50 
 &rst
  ixpk= 0, nxpk= 0, iat=2945,2959, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
# 158 RGUA H8 167 RGUA H1 5.56 
 &rst
  ixpk= 0, nxpk= 0, iat=2945,3248, r1= 1.30, r2= 1.80, r3= 5.56, r4= 6.06,  &end
#
# 159 RCYT H2' 160 RADE H8 4.00 
 &rst
  ixpk= 0, nxpk= 0, iat=2992,3010, r1= 1.30, r2= 1.80, r3= 4.00, r4= 4.50,  &end
#
# 159 RCYT H3' 160 RADE H8 4.50 
 &rst
  ixpk= 0, nxpk= 0, iat=2990,3010, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
# 159 RCYT H42 165 RGUA H1 5.83 
 &rst
  ixpk= 0, nxpk= 0, iat=2985,3183, r1= 1.30, r2= 1.80, r3= 5.83, r4= 6.33,  &end
#
# 159 RCYT H4' 160 RADE H8 6.40 
 &rst
  ixpk= 0, nxpk= 0, iat=2973,3010, r1= 1.30, r2= 1.80, r3= 6.40, r4= 6.90,  &end
#
# 159 RCYT H6 159 RCYT H1' 4.85 
 &rst
  ixpk= 0, nxpk= 0, iat=2979,2976, r1= 1.30, r2= 1.80, r3= 4.85, r4= 5.35,  &end
#
# 159 RCYT H6 159 RCYT H3' 4.78 
 &rst
  ixpk= 0, nxpk= 0, iat=2979,2990, r1= 1.30, r2= 1.80, r3= 4.78, r4= 5.28,  &end
#
# 159 RCYT H6 159 RCYT H4' 4.59 
 &rst
  ixpk= 0, nxpk= 0, iat=2979,2973, r1= 1.30, r2= 1.80, r3= 4.59, r4= 5.09,  &end
#
# 159 RCYT H6 165 RGUA H1 6.00 
 &rst
  ixpk= 0, nxpk= 0, iat=2979,3183, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,  &end
#
# 160 RADE H1' 160 RADE H8 4.90 
 &rst
  ixpk= 0, nxpk= 0, iat=3007,3010, r1= 1.30, r2= 1.80, r3= 4.90, r4= 5.40,  &end
#
# 160 RADE H1' 161 RGUA H1' 6.50 
 &rst
  ixpk= 0, nxpk= 0, iat=3007,3040, r1= 1.30, r2= 1.80, r3= 6.50, r4= 7.00,  &end
#
# 160 RADE H1' 161 RGUA H8 4.37 
 &rst
  ixpk= 0, nxpk= 0, iat=3007,3043, r1= 1.30, r2= 1.80, r3= 4.37, r4= 4.87,  &end
#
# 160 RADE H1' 165 RGUA H1 4.50 
 &rst
  ixpk= 0, nxpk= 0, iat=3007,3183, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
# 160 RADE H2' 161 RGUA H8 3.00 
 &rst
  ixpk= 0, nxpk= 0, iat=3025,3043, r1= 1.30, r2= 1.80, r3= 3.00, r4= 3.50,  &end
#
# 160 RADE H2 161 RGUA H8 3.80 
 &rst
  ixpk= 0, nxpk= 0, iat=3019,3043, r1= 1.30, r2= 1.80, r3= 3.80, r4= 4.30,  &end
#
# 160 RADE H8 160 RADE H1' 4.77 
 &rst
  ixpk= 0, nxpk= 0, iat=3010,3007, r1= 1.30, r2= 1.80, r3= 4.77, r4= 5.27,  &end
#
# 160 RADE H8 160 RADE H2' 4.63 
 &rst
  ixpk= 0, nxpk= 0, iat=3010,3025, r1= 1.30, r2= 1.80, r3= 4.63, r4= 5.13,  &end
#
# 160 RADE H8 161 RGUA H8 6.50 
 &rst
  ixpk= 0, nxpk= 0, iat=3010,3043, r1= 1.30, r2= 1.80, r3= 6.50, r4= 7.00,  &end
#
# 161 RGUA H1' 161 RGUA H8 4.34 
 &rst
  ixpk= 0, nxpk= 0, iat=3040,3043, r1= 1.30, r2= 1.80, r3= 4.34, r4= 4.84,  &end
#
# 161 RGUA H1' 162 RGUA H8 4.50 
 &rst
  ixpk= 0, nxpk= 0, iat=3040,3077, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
# 161 RGUA H1' 163 RADE H2 5.50 
 &rst
  ixpk= 0, nxpk= 0, iat=3040,3120, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
# 161 RGUA H2' 162 RGUA H8 5.42 
 &rst
  ixpk= 0, nxpk= 0, iat=3059,3077, r1= 1.30, r2= 1.80, r3= 5.42, r4= 5.92,  &end
#
# 161 RGUA H3' 162 RGUA H8 5.03 
 &rst
  ixpk= 0, nxpk= 0, iat=3057,3077, r1= 1.30, r2= 1.80, r3= 5.03, r4= 5.53,  &end
#
# 161 RGUA H3' 163 RADE H2 5.50 
 &rst
  ixpk= 0, nxpk= 0, iat=3057,3120, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
# 161 RGUA H8 161 RGUA H1' 4.78 
 &rst
  ixpk= 0, nxpk= 0, iat=3043,3040, r1= 1.30, r2= 1.80, r3= 4.78, r4= 5.28,  &end
#
# 161 RGUA H8 161 RGUA H2' 5.56 
 &rst
  ixpk= 0, nxpk= 0, iat=3043,3059, r1= 1.30, r2= 1.80, r3= 5.56, r4= 6.06,  &end
#
# 161 RGUA H8 161 RGUA H3' 6.00 
 &rst
  ixpk= 0, nxpk= 0, iat=3043,3057, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,  &end
#
# 162 RGUA H1' 162 RGUA H8 4.59 
 &rst
  ixpk= 0, nxpk= 0, iat=3074,3077, r1= 1.30, r2= 1.80, r3= 4.59, r4= 5.09,  &end
#
# 162 RGUA H2' 162 RGUA H8 3.67 
 &rst
  ixpk= 0, nxpk= 0, iat=3093,3077, r1= 1.30, r2= 1.80, r3= 3.67, r4= 4.17,  &end
#
# 162 RGUA H3' 163 RADE H3' 6.00 
 &rst
  ixpk= 0, nxpk= 0, iat=3091,3124, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,  &end
#
# 162 RGUA H3' 163 RADE H8 6.00 
 &rst
  ixpk= 0, nxpk= 0, iat=3091,3111, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,  &end
#
# 162 RGUA H4' 162 RGUA H1' 4.63 
 &rst
  ixpk= 0, nxpk= 0, iat=3071,3074, r1= 1.30, r2= 1.80, r3= 4.63, r4= 5.13,  &end
#
# 162 RGUA H4' 163 RADE H3' 5.20 
 &rst
  ixpk= 0, nxpk= 0, iat=3071,3124, r1= 1.30, r2= 1.80, r3= 5.20, r4= 5.70,  &end
#
# 162 RGUA H4' 163 RADE H8 5.30 
 &rst
  ixpk= 0, nxpk= 0, iat=3071,3111, r1= 1.30, r2= 1.80, r3= 5.30, r4= 5.80,  &end
#
# 162 RGUA H5" 162 RGUA H8 4.59 
 &rst
  ixpk= 0, nxpk= 0, iat=3069,3077, r1= 1.30, r2= 1.80, r3= 4.59, r4= 5.09,  &end
#
# 162 RGUA H5" 163 RADE H1' 4.46 
 &rst
  ixpk= 0, nxpk= 0, iat=3069,3108, r1= 1.30, r2= 1.80, r3= 4.46, r4= 4.96,  &end
#
# 162 RGUA H5' 163 RADE H1' 4.69 
 &rst
  ixpk= 0, nxpk= 0, iat=3068,3108, r1= 1.30, r2= 1.80, r3= 4.69, r4= 5.19,  &end
#
# 162 RGUA H5' 163 RADE H4' 5.30 
 &rst
  ixpk= 0, nxpk= 0, iat=3068,3105, r1= 1.30, r2= 1.80, r3= 5.30, r4= 5.80,  &end
#
# 162 RGUA H5" 163 RADE H4' 5.30 
 &rst
  ixpk= 0, nxpk= 0, iat=3069,3105, r1= 1.30, r2= 1.80, r3= 5.30, r4= 5.80,  &end
#
# 162 RGUA H8 162 RGUA H2' 3.93 
 &rst
  ixpk= 0, nxpk= 0, iat=3077,3093, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,  &end
#
# 163 RADE H1' 163 RADE H2 4.58 
 &rst
  ixpk= 0, nxpk= 0, iat=3108,3120, r1= 1.30, r2= 1.80, r3= 4.58, r4= 5.08,  &end
#
# 163 RADE H1' 163 RADE H8 4.58 
 &rst
  ixpk= 0, nxpk= 0, iat=3108,3111, r1= 1.30, r2= 1.80, r3= 4.58, r4= 5.08,  &end
#
# 163 RADE H1' 164 RADE H5' 5.00 
 &rst
  ixpk= 0, nxpk= 0, iat=3108,3135, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50,  &end
#
# 163 RADE H1' 165 RGUA H1' 4.72 
 &rst
  ixpk= 0, nxpk= 0, iat=3108,3174, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,  &end
#
# 163 RADE H1' 165 RGUA H4' 4.02 
 &rst
  ixpk= 0, nxpk= 0, iat=3108,3171, r1= 1.30, r2= 1.80, r3= 4.02, r4= 4.52,  &end
#
# 163 RADE H1' 165 RGUA H8 6.70 
 &rst
  ixpk= 0, nxpk= 0, iat=3108,3177, r1= 1.30, r2= 1.80, r3= 6.70, r4= 7.20,  &end
#
# 163 RADE H2 163 RADE H1' 4.77 
 &rst
  ixpk= 0, nxpk= 0, iat=3120,3108, r1= 1.30, r2= 1.80, r3= 4.77, r4= 5.27,  &end
#
# 163 RADE H2 165 RGUA H1' 4.46 
 &rst
  ixpk= 0, nxpk= 0, iat=3120,3174, r1= 1.30, r2= 1.80, r3= 4.46, r4= 4.96,  &end
#
# 163 RADE H2 165 RGUA H2' 5.50 
 &rst
  ixpk= 0, nxpk= 0, iat=3120,3193, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
# 163 RADE H2' 165 RGUA H8 4.85 
 &rst
  ixpk= 0, nxpk= 0, iat=3126,3177, r1= 1.30, r2= 1.80, r3= 4.85, r4= 5.35,  &end
#
# 163 RADE H3' 164 RADE H4' 4.50 
 &rst
  ixpk= 0, nxpk= 0, iat=3124,3138, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
# 163 RADE H3' 164 RADE H5' 3.99 
 &rst
  ixpk= 0, nxpk= 0, iat=3124,3135, r1= 1.30, r2= 1.80, r3= 3.99, r4= 4.49,  &end
#
# 163 RADE H3' 164 RADE H5" 4.07 
 &rst
  ixpk= 0, nxpk= 0, iat=3124,3136, r1= 1.30, r2= 1.80, r3= 4.07, r4= 4.57,  &end
#
# 163 RADE H8 163 RADE H1' 4.29 
 &rst
  ixpk= 0, nxpk= 0, iat=3111,3108, r1= 1.30, r2= 1.80, r3= 4.29, r4= 4.79,  &end
#
# 163 RADE H8 163 RADE H2' 5.19 
 &rst
  ixpk= 0, nxpk= 0, iat=3111,3126, r1= 1.30, r2= 1.80, r3= 5.19, r4= 5.69,  &end
#
# 163 RADE H8 163 RADE H3' 4.82 
 &rst
  ixpk= 0, nxpk= 0, iat=3111,3124, r1= 1.30, r2= 1.80, r3= 4.82, r4= 5.32,  &end
#
# 163 RADE H8 163 RADE H4' 5.00 
 &rst
  ixpk= 0, nxpk= 0, iat=3111,3105, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50,  &end
#
# 163 RADE H8 163 RADE H5" 6.00 
 &rst
  ixpk= 0, nxpk= 0, iat=3111,3103, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,  &end
#
# 163 RADE H8 163 RADE H5' 4.69 
 &rst
  ixpk= 0, nxpk= 0, iat=3111,3102, r1= 1.30, r2= 1.80, r3= 4.69, r4= 5.19,  &end
#
# 163 RADE H8 164 RADE H4' 4.57 
 &rst
  ixpk= 0, nxpk= 0, iat=3111,3138, r1= 1.30, r2= 1.80, r3= 4.57, r4= 5.07,  &end
#
# 163 RADE H8 164 RADE H5" 4.63 
 &rst
  ixpk= 0, nxpk= 0, iat=3111,3136, r1= 1.30, r2= 1.80, r3= 4.63, r4= 5.13,  &end
#
# 163 RADE H8 164 RADE H5' 5.19 
 &rst
  ixpk= 0, nxpk= 0, iat=3111,3135, r1= 1.30, r2= 1.80, r3= 5.19, r4= 5.69,  &end
#
# 164 RADE H1' 164 RADE H5" 5.00 
 &rst
  ixpk= 0, nxpk= 0, iat=3141,3136, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50,  &end
#
# 164 RADE H2 164 RADE H1' 5.50 
 &rst
  ixpk= 0, nxpk= 0, iat=3153,3141, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
# 164 RADE H3' 165 RGUA H5' 4.50 
 &rst
  ixpk= 0, nxpk= 0, iat=3157,3168, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
# 164 RADE H4' 165 RGUA H8 6.00 
 &rst
  ixpk= 0, nxpk= 0, iat=3138,3177, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,  &end
#
# 164 RADE H5' 165 RGUA H5' 6.00 
 &rst
  ixpk= 0, nxpk= 0, iat=3135,3168, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,  &end
#
# 164 RADE H8 164 RADE H1' 4.19 
 &rst
  ixpk= 0, nxpk= 0, iat=3144,3141, r1= 1.30, r2= 1.80, r3= 4.19, r4= 4.69,  &end
#
# 164 RADE H8 164 RADE H2' 2.80 
 &rst
  ixpk= 0, nxpk= 0, iat=3144,3159, r1= 1.30, r2= 1.80, r3= 2.80, r4= 3.30,  &end
#
# 164 RADE H8 164 RADE H3' 4.80 
 &rst
  ixpk= 0, nxpk= 0, iat=3144,3157, r1= 1.30, r2= 1.80, r3= 4.80, r4= 5.30,  &end
#
# 164 RADE H8 164 RADE H4' 5.00 
 &rst
  ixpk= 0, nxpk= 0, iat=3144,3138, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50,  &end
#
# 164 RADE H8 164 RADE H5' 4.30 
 &rst
  ixpk= 0, nxpk= 0, iat=3144,3135, r1= 1.30, r2= 1.80, r3= 4.30, r4= 4.80,  &end
#
# 164 RADE H8 164 RADE H5" 4.50 
 &rst
  ixpk= 0, nxpk= 0, iat=3144,3136, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
# 165 RGUA H1' 165 RGUA H8 4.00 
 &rst
  ixpk= 0, nxpk= 0, iat=3174,3177, r1= 1.30, r2= 1.80, r3= 4.00, r4= 4.50,  &end
#
# 165 RGUA H1 166 RCYT H1' 5.83 
 &rst
  ixpk= 0, nxpk= 0, iat=3183,3208, r1= 1.30, r2= 1.80, r3= 5.83, r4= 6.33,  &end
#
# 165 RGUA H1' 166 RCYT H6 4.70 
 &rst
  ixpk= 0, nxpk= 0, iat=3174,3211, r1= 1.30, r2= 1.80, r3= 4.70, r4= 5.20,  &end
#
# 165 RGUA H2' 166 RCYT H5 4.42 
 &rst
  ixpk= 0, nxpk= 0, iat=3193,3213, r1= 1.30, r2= 1.80, r3= 4.42, r4= 4.92,  &end
#
# 165 RGUA H2' 166 RCYT H6 4.04 
 &rst
  ixpk= 0, nxpk= 0, iat=3193,3211, r1= 1.30, r2= 1.80, r3= 4.04, r4= 4.54,  &end
#
# 165 RGUA H8 165 RGUA H1' 5.20 
 &rst
  ixpk= 0, nxpk= 0, iat=3177,3174, r1= 1.30, r2= 1.80, r3= 5.20, r4= 5.70,  &end
#
# 165 RGUA H8 165 RGUA H2' 4.45 
 &rst
  ixpk= 0, nxpk= 0, iat=3177,3193, r1= 1.30, r2= 1.80, r3= 4.45, r4= 4.95,  &end
#
# 165 RGUA H8 166 RCYT H5 4.89 
 &rst
  ixpk= 0, nxpk= 0, iat=3177,3213, r1= 1.30, r2= 1.80, r3= 4.89, r4= 5.39,  &end
#
# 165 RGUA H8 166 RCYT H5 5.35 
 &rst
  ixpk= 0, nxpk= 0, iat=3177,3213, r1= 1.30, r2= 1.80, r3= 5.35, r4= 5.85,  &end
#
# 166 RCYT H1' 166 RCYT H6 4.37 
 &rst
  ixpk= 0, nxpk= 0, iat=3208,3211, r1= 1.30, r2= 1.80, r3= 4.37, r4= 4.87,  &end
#
# 166 RCYT H1' 167 RGUA H8 4.24 
 &rst
  ixpk= 0, nxpk= 0, iat=3208,3242, r1= 1.30, r2= 1.80, r3= 4.24, r4= 4.74,  &end
#
# 166 RCYT H2' 167 RGUA H8 2.40 
 &rst
  ixpk= 0, nxpk= 0, iat=3224,3242, r1= 1.30, r2= 1.80, r3= 2.40, r4= 2.90,  &end
#
# 166 RCYT H3' 166 RCYT H6 3.54 
 &rst
  ixpk= 0, nxpk= 0, iat=3222,3211, r1= 1.30, r2= 1.80, r3= 3.54, r4= 4.04,  &end
#
# 166 RCYT H3' 167 RGUA H8 3.50 
 &rst
  ixpk= 0, nxpk= 0, iat=3222,3242, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
# 166 RCYT H5 166 RCYT H3' 5.50 
 &rst
  ixpk= 0, nxpk= 0, iat=3213,3222, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
# 166 RCYT H6 166 RCYT H1' 4.24 
 &rst
  ixpk= 0, nxpk= 0, iat=3211,3208, r1= 1.30, r2= 1.80, r3= 4.24, r4= 4.74,  &end
#
# 166 RCYT H6 166 RCYT H2' 4.34 
 &rst
  ixpk= 0, nxpk= 0, iat=3211,3224, r1= 1.30, r2= 1.80, r3= 4.34, r4= 4.84,  &end
#
# 166 RCYT H6 166 RCYT H3' 3.50 
 &rst
  ixpk= 0, nxpk= 0, iat=3211,3222, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
# 167 RGUA H1' 167 RGUA H3' 4.72 
 &rst
  ixpk= 0, nxpk= 0, iat=3239,3256, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,  &end
#
# 167 RGUA H1' 167 RGUA H8 4.02 
 &rst
  ixpk= 0, nxpk= 0, iat=3239,3242, r1= 1.30, r2= 1.80, r3= 4.02, r4= 4.52,  &end
#
# 167 RGUA H1 168 RADE H1' 4.85 
 &rst
  ixpk= 0, nxpk= 0, iat=3248,3273, r1= 1.30, r2= 1.80, r3= 4.85, r4= 5.35,  &end
#
# 167 RGUA H1 168 RADE H2 5.80 
 &rst
  ixpk= 0, nxpk= 0, iat=3248,3285, r1= 1.30, r2= 1.80, r3= 5.80, r4= 6.30,  &end
#
# 167 RGUA H1' 168 RADE H8 4.60 
 &rst
  ixpk= 0, nxpk= 0, iat=3239,3276, r1= 1.30, r2= 1.80, r3= 4.60, r4= 5.10,  &end
#
# 167 RGUA H1 168 RADE H8 6.24 
 &rst
  ixpk= 0, nxpk= 0, iat=3248,3276, r1= 1.30, r2= 1.80, r3= 6.24, r4= 6.74,  &end
#
# 167 RGUA H2' 168 RADE H8 2.50 
 &rst
  ixpk= 0, nxpk= 0, iat=3258,3276, r1= 1.30, r2= 1.80, r3= 2.50, r4= 3.00,  &end
#
# 167 RGUA H3' 168 RADE H8 3.00 
 &rst
  ixpk= 0, nxpk= 0, iat=3256,3276, r1= 1.30, r2= 1.80, r3= 3.00, r4= 3.50,  &end
#
# 167 RGUA H5" 168 RADE H8 6.00 
 &rst
  ixpk= 0, nxpk= 0, iat=3234,3276, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,  &end
#
# 167 RGUA H8 167 RGUA H1' 4.63 
 &rst
  ixpk= 0, nxpk= 0, iat=3242,3239, r1= 1.30, r2= 1.80, r3= 4.63, r4= 5.13,  &end
#
# 167 RGUA H8 167 RGUA H3' 4.63 
 &rst
  ixpk= 0, nxpk= 0, iat=3242,3256, r1= 1.30, r2= 1.80, r3= 4.63, r4= 5.13,  &end
#
# 168 RADE H1' 168 RADE H3' 4.63 
 &rst
  ixpk= 0, nxpk= 0, iat=3273,3289, r1= 1.30, r2= 1.80, r3= 4.63, r4= 5.13,  &end
#
# 168 RADE H1' 169 URA H5 6.00 
 &rst
  ixpk= 0, nxpk= 0, iat=3273,3311, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,  &end
#
# 168 RADE H1' 169 URA H6 4.50 
 &rst
  ixpk= 0, nxpk= 0, iat=3273,3309, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
# 168 RADE H2 168 RADE H1' 5.35 
 &rst
  ixpk= 0, nxpk= 0, iat=3285,3273, r1= 1.30, r2= 1.80, r3= 5.35, r4= 5.85,  &end
#
# 168 RADE H2 169 URA H1' 3.50 
 &rst
  ixpk= 0, nxpk= 0, iat=3285,3306, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
# 168 RADE H2' 169 URA H1' 4.41 
 &rst
  ixpk= 0, nxpk= 0, iat=3291,3306, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,  &end
#
# 168 RADE H2' 169 URA H5 5.00 
 &rst
  ixpk= 0, nxpk= 0, iat=3291,3311, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50,  &end
#
# 168 RADE H2' 169 URA H6 2.50 
 &rst
  ixpk= 0, nxpk= 0, iat=3291,3309, r1= 1.30, r2= 1.80, r3= 2.50, r4= 3.00,  &end
#
# 168 RADE H3' 169 URA H5 4.63 
 &rst
  ixpk= 0, nxpk= 0, iat=3289,3311, r1= 1.30, r2= 1.80, r3= 4.63, r4= 5.13,  &end
#
# 168 RADE H8 168 RADE H1' 5.56 
 &rst
  ixpk= 0, nxpk= 0, iat=3276,3273, r1= 1.30, r2= 1.80, r3= 5.56, r4= 6.06,  &end
#
# 168 RADE H8 168 RADE H2' 5.56 
 &rst
  ixpk= 0, nxpk= 0, iat=3276,3291, r1= 1.30, r2= 1.80, r3= 5.56, r4= 6.06,  &end
#
# 168 RADE H8 168 RADE H3' 4.24 
 &rst
  ixpk= 0, nxpk= 0, iat=3276,3289, r1= 1.30, r2= 1.80, r3= 4.24, r4= 4.74,  &end
#
# 169 URA H1' 170 RCYT H5 6.00 
 &rst
  ixpk= 0, nxpk= 0, iat=3306,3341, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,  &end
#
# 169 URA H1' 170 RCYT H6 4.50 
 &rst
  ixpk= 0, nxpk= 0, iat=3306,3339, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
# 169 URA H2' 170 RCYT H5 5.00 
 &rst
  ixpk= 0, nxpk= 0, iat=3321,3341, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50,  &end
#
# 169 URA H2' 170 RCYT H5" 3.82 
 &rst
  ixpk= 0, nxpk= 0, iat=3321,3331, r1= 1.30, r2= 1.80, r3= 3.82, r4= 4.32,  &end
#
# 169 URA H2' 170 RCYT H5" 4.09 
 &rst
  ixpk= 0, nxpk= 0, iat=3321,3331, r1= 1.30, r2= 1.80, r3= 4.09, r4= 4.59,  &end
#
# 169 URA H2' 170 RCYT H6 2.50 
 &rst
  ixpk= 0, nxpk= 0, iat=3321,3339, r1= 1.30, r2= 1.80, r3= 2.50, r4= 3.00,  &end
#
# 169 URA H3' 170 RCYT H5" 5.50 
 &rst
  ixpk= 0, nxpk= 0, iat=3319,3331, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
# 169 URA H3' 170 RCYT H5 5.30 
 &rst
  ixpk= 0, nxpk= 0, iat=3319,3341, r1= 1.30, r2= 1.80, r3= 5.30, r4= 5.80,  &end
#
# 169 URA H3 170 RCYT H5 6.24 
 &rst
  ixpk= 0, nxpk= 0, iat=3315,3341, r1= 1.30, r2= 1.80, r3= 6.24, r4= 6.74,  &end
#
# 169 URA H3' 170 RCYT H6 4.34 
 &rst
  ixpk= 0, nxpk= 0, iat=3319,3339, r1= 1.30, r2= 1.80, r3= 4.34, r4= 4.84,  &end
#
# 169 URA H3' 170 RCYT H6 3.00 
 &rst
  ixpk= 0, nxpk= 0, iat=3319,3339, r1= 1.30, r2= 1.80, r3= 3.00, r4= 3.50,  &end
#
# 169 URA H5 170 RCYT H5 5.06 
 &rst
  ixpk= 0, nxpk= 0, iat=3311,3341, r1= 1.30, r2= 1.80, r3= 5.06, r4= 5.56,  &end
#
# 169 URA H6 169 URA H2' 4.20 
 &rst
  ixpk= 0, nxpk= 0, iat=3309,3321, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,  &end
#
# 169 URA H6 169 URA H5" 4.57 
 &rst
  ixpk= 0, nxpk= 0, iat=3309,3301, r1= 1.30, r2= 1.80, r3= 4.57, r4= 5.07,  &end
#
# 169 URA H6 169 URA H5' 4.85 
 &rst
  ixpk= 0, nxpk= 0, iat=3309,3300, r1= 1.30, r2= 1.80, r3= 4.85, r4= 5.35,  &end
#
# 170 RCYT H2' 171 RCYT H5 5.00 
 &rst
  ixpk= 0, nxpk= 0, iat=3352,3372, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50,  &end
#
# 170 RCYT H2' 171 RCYT H6 2.50 
 &rst
  ixpk= 0, nxpk= 0, iat=3352,3370, r1= 1.30, r2= 1.80, r3= 2.50, r4= 3.00,  &end
#
# 170 RCYT H3' 171 RCYT H6 3.80 
 &rst
  ixpk= 0, nxpk= 0, iat=3350,3370, r1= 1.30, r2= 1.80, r3= 3.80, r4= 4.30,  &end
#
# 170 RCYT H6 170 RCYT H1' 4.48 
 &rst
  ixpk= 0, nxpk= 0, iat=3339,3336, r1= 1.30, r2= 1.80, r3= 4.48, r4= 4.98,  &end
#
# 170 RCYT H6 170 RCYT H2' 5.06 
 &rst
  ixpk= 0, nxpk= 0, iat=3339,3352, r1= 1.30, r2= 1.80, r3= 5.06, r4= 5.56,  &end
#
# 170 RCYT H6 170 RCYT H3' 4.41 
 &rst
  ixpk= 0, nxpk= 0, iat=3339,3350, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,  &end
#
# 170 RCYT H6 170 RCYT H5" 5.35 
 &rst
  ixpk= 0, nxpk= 0, iat=3339,3331, r1= 1.30, r2= 1.80, r3= 5.35, r4= 5.85,  &end
#
# 171 RCYT H1' 172 RCYT H6 4.50 
 &rst
  ixpk= 0, nxpk= 0, iat=3367,3401, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
# 171 RCYT H2' 172 RCYT H1' 4.59 
 &rst
  ixpk= 0, nxpk= 0, iat=3383,3398, r1= 1.30, r2= 1.80, r3= 4.59, r4= 5.09,  &end
#
# 171 RCYT H2' 172 RCYT H6 2.50 
 &rst
  ixpk= 0, nxpk= 0, iat=3383,3401, r1= 1.30, r2= 1.80, r3= 2.50, r4= 3.00,  &end
#
# 171 RCYT H3' 172 RCYT H6 3.79 
 &rst
  ixpk= 0, nxpk= 0, iat=3381,3401, r1= 1.30, r2= 1.80, r3= 3.79, r4= 4.29,  &end
#
# 171 RCYT H6 171 RCYT H1' 3.99 
 &rst
  ixpk= 0, nxpk= 0, iat=3370,3367, r1= 1.30, r2= 1.80, r3= 3.99, r4= 4.49,  &end
#
# 171 RCYT H6 171 RCYT H3' 3.73 
 &rst
  ixpk= 0, nxpk= 0, iat=3370,3381, r1= 1.30, r2= 1.80, r3= 3.73, r4= 4.23,  &end
#
# 171 RCYT H6 171 RCYT H4' 4.42 
 &rst
  ixpk= 0, nxpk= 0, iat=3370,3364, r1= 1.30, r2= 1.80, r3= 4.42, r4= 4.92,  &end
#
# 172 RCYT H1' 172 RCYT H6 4.00 
 &rst
  ixpk= 0, nxpk= 0, iat=3398,3401, r1= 1.30, r2= 1.80, r3= 4.00, r4= 4.50,  &end
#
# 172 RCYT H3' 172 RCYT H6 3.56 
 &rst
  ixpk= 0, nxpk= 0, iat=3412,3401, r1= 1.30, r2= 1.80, r3= 3.56, r4= 4.06,  &end
#
# 172 RCYT H6 172 RCYT H1' 3.91 
 &rst
  ixpk= 0, nxpk= 0, iat=3401,3398, r1= 1.30, r2= 1.80, r3= 3.91, r4= 4.41,  &end
#
# 172 RCYT H6 172 RCYT H2' 3.79 
 &rst
  ixpk= 0, nxpk= 0, iat=3401,3414, r1= 1.30, r2= 1.80, r3= 3.79, r4= 4.29,  &end
#
# 172 RCYT H6 172 RCYT H2' 4.07 
 &rst
  ixpk= 0, nxpk= 0, iat=3401,3414, r1= 1.30, r2= 1.80, r3= 4.07, r4= 4.57,  &end
#
# 172 RCYT H6 172 RCYT H3' 3.67 
 &rst
  ixpk= 0, nxpk= 0, iat=3401,3412, r1= 1.30, r2= 1.80, r3= 3.67, r4= 4.17,  &end
#


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