*HEADER    HORMONE/GROWTH FACTOR                   09-JUL-04   1TZ5              
*TITLE     [PNPY19-23]-HPP BOUND TO DPC MICELLES                                 
*COMPND    MOL_ID: 1;                                                            
*COMPND   2 MOLECULE: CHIMERA OF PANCREATIC HORMONE AND NEUROPEPTIDE Y;          
*COMPND   3 CHAIN: A;                                                            
*COMPND   4 SYNONYM: [PNPY19-23]-HPP;                                            
*COMPND   5 ENGINEERED: YES                                                      
*SOURCE    MOL_ID: 1;                                                            
*SOURCE   2 ORGANISM_SCIENTIFIC: HOMO SAPIENS AND SUS SCROFA;                    
*SOURCE   3 ORGANISM_COMMON: HUMAN AND PIG;                                      
*SOURCE   4 EXPRESSION_SYSTEM: ESCHERICHIA COLI;                                 
*SOURCE   5 EXPRESSION_SYSTEM_COMMON: BACTERIA;                                  
*SOURCE   6 EXPRESSION_SYSTEM_STRAIN: BL21(DE3);                                 
*SOURCE   7 EXPRESSION_SYSTEM_VECTOR_TYPE: PLASMID;                              
*SOURCE   8 EXPRESSION_SYSTEM_PLASMID: PUBK19-[PNPY19-23]-HPP-G                  
*KEYWDS    NPY-PP CHIMERA                                                        
*EXPDTA    NMR, 20 STRUCTURES                                                    
*AUTHOR    M.LERCH, H.KAMIMORI, G.FOLKERS, M.I.AGUILAR, A.G.BECK-                
*AUTHOR   2 SICKINGER, O.ZERBE                                                   
*REVDAT   1   05-JUL-05 1TZ5    0                                                

#
#   3 LEU  HA      3 LEU  QD1     6.53                
 &rst
  ixpk= 0, nxpk= 0, iat=  30,  -1, r1= 1.30, r2= 1.80, r3= 7.84, r4= 8.34,

      rk2=20.0, rk3=20.0, ir6=1, ialtd=0,
 igr2=  37,  38,  39,
 &end
#
#   3 LEU  HA      3 LEU  QD2     6.53                
 &rst
  ixpk= 0, nxpk= 0, iat=  30,  -1, r1= 1.30, r2= 1.80, r3= 7.84, r4= 8.34,
 igr2=  41,  42,  43,
 &end
#
#   3 LEU  HA      4 GLU- HN      3.36                
 &rst
  ixpk= 0, nxpk= 0, iat=  30,  47, r1= 1.30, r2= 1.80, r3= 3.36, r4= 3.86,  &end
#
#   4 GLU- HN      4 GLU- HB2     4.01                
 &rst
  ixpk= 0, nxpk= 0, iat=  47,  51, r1= 1.30, r2= 1.80, r3= 4.01, r4= 4.51,  &end
#
#   4 GLU- HN      4 GLU- HB3     4.01                
 &rst
  ixpk= 0, nxpk= 0, iat=  47,  52, r1= 1.30, r2= 1.80, r3= 4.01, r4= 4.51,  &end
#
#   4 GLU- HN      4 GLU- QB      3.50                
 &rst
  ixpk= 0, nxpk= 0, iat=  47,  -1, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr2=  51,  52,
 &end
#
#   4 GLU- HN      4 GLU- QG      6.38                
 &rst
  ixpk= 0, nxpk= 0, iat=  47,  -1, r1= 1.30, r2= 1.80, r3= 7.16, r4= 7.66,
 igr2=  54,  55,
 &end
#
#   5 PRO  HA      6 VAL  HN      3.11                
 &rst
  ixpk= 0, nxpk= 0, iat=  72,  76, r1= 1.30, r2= 1.80, r3= 3.11, r4= 3.61,  &end
#
#   5 PRO  HA      6 VAL  QG1     6.53                
 &rst
  ixpk= 0, nxpk= 0, iat=  72,  -1, r1= 1.30, r2= 1.80, r3= 7.84, r4= 8.34,
 igr2=  82,  83,  84,
 &end
#
#   5 PRO  HA      6 VAL  QG2     6.53                
 &rst
  ixpk= 0, nxpk= 0, iat=  72,  -1, r1= 1.30, r2= 1.80, r3= 7.84, r4= 8.34,
 igr2=  86,  87,  88,
 &end
#
#   6 VAL  HN      6 VAL  HB      3.89                
 &rst
  ixpk= 0, nxpk= 0, iat=  76,  80, r1= 1.30, r2= 1.80, r3= 3.89, r4= 4.39,  &end
#
#   6 VAL  HA      7 TYR  HN      3.33                
 &rst
  ixpk= 0, nxpk= 0, iat=  78,  92, r1= 1.30, r2= 1.80, r3= 3.33, r4= 3.83,  &end
#
#   6 VAL  HB      7 TYR  HN      4.04                
 &rst
  ixpk= 0, nxpk= 0, iat=  80,  92, r1= 1.30, r2= 1.80, r3= 4.04, r4= 4.54,  &end
#
#   6 VAL  QG1     7 TYR  HN      6.53                
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  92, r1= 1.30, r2= 1.80, r3= 7.84, r4= 8.34,
 igr1=  82,  83,  84,
 &end
#
#   6 VAL  QG2     7 TYR  HN      6.53                
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  92, r1= 1.30, r2= 1.80, r3= 7.84, r4= 8.34,
 igr1=  86,  87,  88,
 &end
#
#   7 TYR  HN      7 TYR  HB2     4.14                
 &rst
  ixpk= 0, nxpk= 0, iat=  92,  96, r1= 1.30, r2= 1.80, r3= 4.14, r4= 4.64,  &end
#
#   7 TYR  HN      7 TYR  HB3     4.14                
 &rst
  ixpk= 0, nxpk= 0, iat=  92,  97, r1= 1.30, r2= 1.80, r3= 4.14, r4= 4.64,  &end
#
#   7 TYR  HB2     8 PRO  HD2     5.50                
 &rst
  ixpk= 0, nxpk= 0, iat=  96, 114, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   7 TYR  HB2     8 PRO  HD3     5.50                
 &rst
  ixpk= 0, nxpk= 0, iat=  96, 115, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   7 TYR  HB3     8 PRO  HD2     5.50                
 &rst
  ixpk= 0, nxpk= 0, iat=  97, 114, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   7 TYR  HB3     8 PRO  HD3     5.50                
 &rst
  ixpk= 0, nxpk= 0, iat=  97, 115, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   7 TYR  QD      8 PRO  HD2     7.64                
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 114, r1= 1.30, r2= 1.80, r3= 8.58, r4= 9.08,
 igr1= 100, 109,
 &end
#
#   7 TYR  QD      8 PRO  HD3     7.64                
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 115, r1= 1.30, r2= 1.80, r3= 8.58, r4= 9.08,
 igr1= 100, 109,
 &end
#
#   8 PRO  HA      9 GLY  HN      3.36                
 &rst
  ixpk= 0, nxpk= 0, iat= 123, 127, r1= 1.30, r2= 1.80, r3= 3.36, r4= 3.86,  &end
#
#   9 GLY  HN     10 ASP- HN      3.55                
 &rst
  ixpk= 0, nxpk= 0, iat= 127, 134, r1= 1.30, r2= 1.80, r3= 3.55, r4= 4.05,  &end
#
#  10 ASP- HN     10 ASP- HB2     3.98                
 &rst
  ixpk= 0, nxpk= 0, iat= 134, 138, r1= 1.30, r2= 1.80, r3= 3.98, r4= 4.48,  &end
#
#  10 ASP- HN     10 ASP- HB3     3.98                
 &rst
  ixpk= 0, nxpk= 0, iat= 134, 139, r1= 1.30, r2= 1.80, r3= 3.98, r4= 4.48,  &end
#
#  10 ASP- HN     10 ASP- QB      3.79                
 &rst
  ixpk= 0, nxpk= 0, iat= 134,  -1, r1= 1.30, r2= 1.80, r3= 4.25, r4= 4.75,
 igr2= 138, 139,
 &end
#
#  10 ASP- HN     11 ASN  HN      5.50                
 &rst
  ixpk= 0, nxpk= 0, iat= 134, 146, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#  10 ASP- HA     11 ASN  HN      3.36                
 &rst
  ixpk= 0, nxpk= 0, iat= 136, 146, r1= 1.30, r2= 1.80, r3= 3.36, r4= 3.86,  &end
#
#  11 ASN  HN     11 ASN  HB2     4.11                
 &rst
  ixpk= 0, nxpk= 0, iat= 146, 150, r1= 1.30, r2= 1.80, r3= 4.11, r4= 4.61,  &end
#
#  11 ASN  HN     11 ASN  HB3     4.11                
 &rst
  ixpk= 0, nxpk= 0, iat= 146, 151, r1= 1.30, r2= 1.80, r3= 4.11, r4= 4.61,  &end
#
#  11 ASN  HN     11 ASN  QB      3.75                
 &rst
  ixpk= 0, nxpk= 0, iat= 146,  -1, r1= 1.30, r2= 1.80, r3= 4.21, r4= 4.71,
 igr2= 150, 151,
 &end
#
#  11 ASN  HN     12 ALA  HN      3.70                
 &rst
  ixpk= 0, nxpk= 0, iat= 146, 160, r1= 1.30, r2= 1.80, r3= 3.70, r4= 4.20,  &end
#
#  11 ASN  HA     12 ALA  HN      3.42                
 &rst
  ixpk= 0, nxpk= 0, iat= 148, 160, r1= 1.30, r2= 1.80, r3= 3.42, r4= 3.92,  &end
#
#  12 ALA  HA     13 THR  HN      3.05                
 &rst
  ixpk= 0, nxpk= 0, iat= 162, 170, r1= 1.30, r2= 1.80, r3= 3.05, r4= 3.55,  &end
#
#  12 ALA  QB     14 PRO  QD      7.40                
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 9.98, r4=10.48,
 igr1= 164, 165, 166,
 igr2= 185, 186,
 &end
#
#  12 ALA  QB     16 GLN  QB      7.40                
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 9.98, r4=10.48,
 igr1= 164, 165, 166,
 igr2= 217, 218,
 &end
#
#  12 ALA  QB     16 GLN  QG      7.40                
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 9.98, r4=10.48,
 igr1= 164, 165, 166,
 igr2= 220, 221,
 &end
#
#  12 ALA  QB     17 MET  HG2     6.53                
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 237, r1= 1.30, r2= 1.80, r3= 7.84, r4= 8.34,
 igr1= 164, 165, 166,
 &end
#
#  12 ALA  QB     17 MET  HG3     6.53                
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 238, r1= 1.30, r2= 1.80, r3= 7.84, r4= 8.34,
 igr1= 164, 165, 166,
 &end
#
#  13 THR  HN     13 THR  HB      4.07                
 &rst
  ixpk= 0, nxpk= 0, iat= 170, 174, r1= 1.30, r2= 1.80, r3= 4.07, r4= 4.57,  &end
#
#  13 THR  HN     14 PRO  HD2     5.34                
 &rst
  ixpk= 0, nxpk= 0, iat= 170, 185, r1= 1.30, r2= 1.80, r3= 5.34, r4= 5.84,  &end
#
#  13 THR  HN     14 PRO  HD3     5.34                
 &rst
  ixpk= 0, nxpk= 0, iat= 170, 186, r1= 1.30, r2= 1.80, r3= 5.34, r4= 5.84,  &end
#
#  13 THR  HN     14 PRO  QD      5.07                
 &rst
  ixpk= 0, nxpk= 0, iat= 170,  -1, r1= 1.30, r2= 1.80, r3= 5.69, r4= 6.19,
 igr2= 185, 186,
 &end
#
#  13 THR  HA     14 PRO  HG2     5.50                
 &rst
  ixpk= 0, nxpk= 0, iat= 172, 188, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#  13 THR  HA     14 PRO  HG3     5.50                
 &rst
  ixpk= 0, nxpk= 0, iat= 172, 189, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#  13 THR  HA     14 PRO  HD2     3.95                
 &rst
  ixpk= 0, nxpk= 0, iat= 172, 185, r1= 1.30, r2= 1.80, r3= 3.95, r4= 4.45,  &end
#
#  13 THR  HA     14 PRO  HD3     3.95                
 &rst
  ixpk= 0, nxpk= 0, iat= 172, 186, r1= 1.30, r2= 1.80, r3= 3.95, r4= 4.45,  &end
#
#  13 THR  HA     14 PRO  QD      3.73                
 &rst
  ixpk= 0, nxpk= 0, iat= 172,  -1, r1= 1.30, r2= 1.80, r3= 4.19, r4= 4.69,
 igr2= 185, 186,
 &end
#
#  13 THR  HA     16 GLN  QB      6.00                
 &rst
  ixpk= 0, nxpk= 0, iat= 172,  -1, r1= 1.30, r2= 1.80, r3= 6.73, r4= 7.23,
 igr2= 217, 218,
 &end
#
#  13 THR  HB     14 PRO  HD2     4.14                
 &rst
  ixpk= 0, nxpk= 0, iat= 174, 185, r1= 1.30, r2= 1.80, r3= 4.14, r4= 4.64,  &end
#
#  13 THR  HB     14 PRO  HD3     4.14                
 &rst
  ixpk= 0, nxpk= 0, iat= 174, 186, r1= 1.30, r2= 1.80, r3= 4.14, r4= 4.64,  &end
#
#  13 THR  HB     14 PRO  QD      3.96                
 &rst
  ixpk= 0, nxpk= 0, iat= 174,  -1, r1= 1.30, r2= 1.80, r3= 4.44, r4= 4.94,
 igr2= 185, 186,
 &end
#
#  13 THR  QG2    14 PRO  HD2     6.53                
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 185, r1= 1.30, r2= 1.80, r3= 7.84, r4= 8.34,
 igr1= 176, 177, 178,
 &end
#
#  13 THR  QG2    14 PRO  HD3     6.53                
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 186, r1= 1.30, r2= 1.80, r3= 7.84, r4= 8.34,
 igr1= 176, 177, 178,
 &end
#
#  13 THR  QG2    16 GLN  HN      5.75                
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 213, r1= 1.30, r2= 1.80, r3= 6.91, r4= 7.41,
 igr1= 176, 177, 178,
 &end
#
#  13 THR  QG2    16 GLN  QB      7.40                
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 9.98, r4=10.48,
 igr1= 176, 177, 178,
 igr2= 217, 218,
 &end
#
#  13 THR  QG2    16 GLN  QG      7.40                
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 9.98, r4=10.48,
 igr1= 176, 177, 178,
 igr2= 220, 221,
 &end
#
#  13 THR  QG2    17 MET  HG2     6.53                
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 237, r1= 1.30, r2= 1.80, r3= 7.84, r4= 8.34,
 igr1= 176, 177, 178,
 &end
#
#  13 THR  QG2    17 MET  HG3     6.53                
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 238, r1= 1.30, r2= 1.80, r3= 7.84, r4= 8.34,
 igr1= 176, 177, 178,
 &end
#
#  14 PRO  HA     17 MET  HN      4.07                
 &rst
  ixpk= 0, nxpk= 0, iat= 194, 230, r1= 1.30, r2= 1.80, r3= 4.07, r4= 4.57,  &end
#
#  14 PRO  HA     17 MET  HG2     5.50                
 &rst
  ixpk= 0, nxpk= 0, iat= 194, 237, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#  14 PRO  HA     17 MET  HG3     5.50                
 &rst
  ixpk= 0, nxpk= 0, iat= 194, 238, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#  15 GLU- HN     15 GLU- HB2     3.27                
 &rst
  ixpk= 0, nxpk= 0, iat= 198, 202, r1= 1.30, r2= 1.80, r3= 3.27, r4= 3.77,  &end
#
#  15 GLU- HN     15 GLU- HB3     3.27                
 &rst
  ixpk= 0, nxpk= 0, iat= 198, 203, r1= 1.30, r2= 1.80, r3= 3.27, r4= 3.77,  &end
#
#  15 GLU- HN     15 GLU- QG      6.38                
 &rst
  ixpk= 0, nxpk= 0, iat= 198,  -1, r1= 1.30, r2= 1.80, r3= 7.16, r4= 7.66,
 igr2= 205, 206,
 &end
#
#  15 GLU- HN     16 GLN  HN      3.39                
 &rst
  ixpk= 0, nxpk= 0, iat= 198, 213, r1= 1.30, r2= 1.80, r3= 3.39, r4= 3.89,  &end
#
#  15 GLU- HN     17 MET  HN      3.86                
 &rst
  ixpk= 0, nxpk= 0, iat= 198, 230, r1= 1.30, r2= 1.80, r3= 3.86, r4= 4.36,  &end
#
#  15 GLU- HA     16 GLN  HN      3.36                
 &rst
  ixpk= 0, nxpk= 0, iat= 200, 213, r1= 1.30, r2= 1.80, r3= 3.36, r4= 3.86,  &end
#
#  15 GLU- HA     18 ALA  HN      3.76                
 &rst
  ixpk= 0, nxpk= 0, iat= 200, 247, r1= 1.30, r2= 1.80, r3= 3.76, r4= 4.26,  &end
#
#  15 GLU- HA     18 ALA  QB      4.45                
 &rst
  ixpk= 0, nxpk= 0, iat= 200,  -1, r1= 1.30, r2= 1.80, r3= 5.34, r4= 5.84,
 igr2= 251, 252, 253,
 &end
#
#  16 GLN  HN     16 GLN  HB2     3.21                
 &rst
  ixpk= 0, nxpk= 0, iat= 213, 217, r1= 1.30, r2= 1.80, r3= 3.21, r4= 3.71,  &end
#
#  16 GLN  HN     16 GLN  HB3     3.21                
 &rst
  ixpk= 0, nxpk= 0, iat= 213, 218, r1= 1.30, r2= 1.80, r3= 3.21, r4= 3.71,  &end
#
#  16 GLN  HN     16 GLN  QG      5.60                
 &rst
  ixpk= 0, nxpk= 0, iat= 213,  -1, r1= 1.30, r2= 1.80, r3= 6.29, r4= 6.79,
 igr2= 220, 221,
 &end
#
#  16 GLN  HN     17 MET  HN      2.52                
 &rst
  ixpk= 0, nxpk= 0, iat= 213, 230, r1= 1.30, r2= 1.80, r3= 2.52, r4= 3.02,  &end
#
#  16 GLN  HA     19 ARG+ HN      4.07                
 &rst
  ixpk= 0, nxpk= 0, iat= 215, 257, r1= 1.30, r2= 1.80, r3= 4.07, r4= 4.57,  &end
#
#  16 GLN  HA     19 ARG+ HB2     4.29                
 &rst
  ixpk= 0, nxpk= 0, iat= 215, 261, r1= 1.30, r2= 1.80, r3= 4.29, r4= 4.79,  &end
#
#  16 GLN  HA     19 ARG+ HB3     4.29                
 &rst
  ixpk= 0, nxpk= 0, iat= 215, 262, r1= 1.30, r2= 1.80, r3= 4.29, r4= 4.79,  &end
#
#  16 GLN  HA     19 ARG+ QB      3.98                
 &rst
  ixpk= 0, nxpk= 0, iat= 215,  -1, r1= 1.30, r2= 1.80, r3= 4.47, r4= 4.97,
 igr2= 261, 262,
 &end
#
#  16 GLN  HA     20 TYR  HN      4.51                
 &rst
  ixpk= 0, nxpk= 0, iat= 215, 281, r1= 1.30, r2= 1.80, r3= 4.51, r4= 5.01,  &end
#
#  16 GLN  QG     20 TYR  QE      8.51                
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3=10.72, r4=11.22,
 igr1= 220, 221,
 igr2= 291, 296,
 &end
#
#  17 MET  HN     17 MET  HB2     3.21                
 &rst
  ixpk= 0, nxpk= 0, iat= 230, 234, r1= 1.30, r2= 1.80, r3= 3.21, r4= 3.71,  &end
#
#  17 MET  HN     17 MET  HB3     3.21                
 &rst
  ixpk= 0, nxpk= 0, iat= 230, 235, r1= 1.30, r2= 1.80, r3= 3.21, r4= 3.71,  &end
#
#  17 MET  HN     17 MET  QB      3.02                
 &rst
  ixpk= 0, nxpk= 0, iat= 230,  -1, r1= 1.30, r2= 1.80, r3= 3.39, r4= 3.89,
 igr2= 234, 235,
 &end
#
#  17 MET  HN     17 MET  HG2     4.69                
 &rst
  ixpk= 0, nxpk= 0, iat= 230, 237, r1= 1.30, r2= 1.80, r3= 4.69, r4= 5.19,  &end
#
#  17 MET  HN     17 MET  HG3     4.69                
 &rst
  ixpk= 0, nxpk= 0, iat= 230, 238, r1= 1.30, r2= 1.80, r3= 4.69, r4= 5.19,  &end
#
#  17 MET  HN     17 MET  QG      4.46                
 &rst
  ixpk= 0, nxpk= 0, iat= 230,  -1, r1= 1.30, r2= 1.80, r3= 5.01, r4= 5.51,
 igr2= 237, 238,
 &end
#
#  17 MET  HN     18 ALA  HN      3.17                
 &rst
  ixpk= 0, nxpk= 0, iat= 230, 247, r1= 1.30, r2= 1.80, r3= 3.17, r4= 3.67,  &end
#
#  17 MET  HN     18 ALA  QB      5.69                
 &rst
  ixpk= 0, nxpk= 0, iat= 230,  -1, r1= 1.30, r2= 1.80, r3= 6.83, r4= 7.33,
 igr2= 251, 252, 253,
 &end
#
#  17 MET  HN     19 ARG+ HN      3.67                
 &rst
  ixpk= 0, nxpk= 0, iat= 230, 257, r1= 1.30, r2= 1.80, r3= 3.67, r4= 4.17,  &end
#
#  17 MET  HA     20 TYR  HN      3.73                
 &rst
  ixpk= 0, nxpk= 0, iat= 232, 281, r1= 1.30, r2= 1.80, r3= 3.73, r4= 4.23,  &end
#
#  17 MET  HA     20 TYR  HB2     3.92                
 &rst
  ixpk= 0, nxpk= 0, iat= 232, 285, r1= 1.30, r2= 1.80, r3= 3.92, r4= 4.42,  &end
#
#  17 MET  HA     20 TYR  HB3     3.92                
 &rst
  ixpk= 0, nxpk= 0, iat= 232, 286, r1= 1.30, r2= 1.80, r3= 3.92, r4= 4.42,  &end
#
#  17 MET  HA     20 TYR  QB      3.68                
 &rst
  ixpk= 0, nxpk= 0, iat= 232,  -1, r1= 1.30, r2= 1.80, r3= 4.13, r4= 4.63,
 igr2= 285, 286,
 &end
#
#  17 MET  HA     20 TYR  QD      7.64                
 &rst
  ixpk= 0, nxpk= 0, iat= 232,  -1, r1= 1.30, r2= 1.80, r3= 8.58, r4= 9.08,
 igr2= 289, 298,
 &end
#
#  17 MET  HA     20 TYR  QE      7.63                
 &rst
  ixpk= 0, nxpk= 0, iat= 232,  -1, r1= 1.30, r2= 1.80, r3= 8.56, r4= 9.06,
 igr2= 291, 296,
 &end
#
#  17 MET  HA     21 TYR  HN      5.19                
 &rst
  ixpk= 0, nxpk= 0, iat= 232, 302, r1= 1.30, r2= 1.80, r3= 5.19, r4= 5.69,  &end
#
#  17 MET  HA     21 TYR  QD      7.64                
 &rst
  ixpk= 0, nxpk= 0, iat= 232,  -1, r1= 1.30, r2= 1.80, r3= 8.58, r4= 9.08,
 igr2= 310, 319,
 &end
#
#  17 MET  HB2    18 ALA  HN      3.52                
 &rst
  ixpk= 0, nxpk= 0, iat= 234, 247, r1= 1.30, r2= 1.80, r3= 3.52, r4= 4.02,  &end
#
#  17 MET  HB3    18 ALA  HN      3.52                
 &rst
  ixpk= 0, nxpk= 0, iat= 235, 247, r1= 1.30, r2= 1.80, r3= 3.52, r4= 4.02,  &end
#
#  17 MET  QB     18 ALA  HN      3.31                
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 247, r1= 1.30, r2= 1.80, r3= 3.72, r4= 4.22,
 igr1= 234, 235,
 &end
#
#  17 MET  QB     20 TYR  QD      8.52                
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3=10.73, r4=11.23,
 igr1= 234, 235,
 igr2= 289, 298,
 &end
#
#  17 MET  QB     20 TYR  QE      8.51                
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3=10.72, r4=11.22,
 igr1= 234, 235,
 igr2= 291, 296,
 &end
#
#  18 ALA  HN     19 ARG+ HN      3.52                
 &rst
  ixpk= 0, nxpk= 0, iat= 247, 257, r1= 1.30, r2= 1.80, r3= 3.52, r4= 4.02,  &end
#
#  18 ALA  HA     19 ARG+ HN      3.39                
 &rst
  ixpk= 0, nxpk= 0, iat= 249, 257, r1= 1.30, r2= 1.80, r3= 3.39, r4= 3.89,  &end
#
#  18 ALA  HA     21 TYR  HN      3.83                
 &rst
  ixpk= 0, nxpk= 0, iat= 249, 302, r1= 1.30, r2= 1.80, r3= 3.83, r4= 4.33,  &end
#
#  18 ALA  HA     21 TYR  QB      4.73                
 &rst
  ixpk= 0, nxpk= 0, iat= 249,  -1, r1= 1.30, r2= 1.80, r3= 5.31, r4= 5.81,
 igr2= 306, 307,
 &end
#
#  18 ALA  HA     22 SER  HN      4.17                
 &rst
  ixpk= 0, nxpk= 0, iat= 249, 323, r1= 1.30, r2= 1.80, r3= 4.17, r4= 4.67,  &end
#
#  18 ALA  QB     19 ARG+ QD      7.37                
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 9.93, r4=10.43,
 igr1= 251, 252, 253,
 igr2= 267, 268,
 &end
#
#  18 ALA  QB     22 SER  QB      7.40                
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 9.98, r4=10.48,
 igr1= 251, 252, 253,
 igr2= 327, 328,
 &end
#
#  19 ARG+ HN     19 ARG+ HB2     3.21                
 &rst
  ixpk= 0, nxpk= 0, iat= 257, 261, r1= 1.30, r2= 1.80, r3= 3.21, r4= 3.71,  &end
#
#  19 ARG+ HN     19 ARG+ HB3     3.21                
 &rst
  ixpk= 0, nxpk= 0, iat= 257, 262, r1= 1.30, r2= 1.80, r3= 3.21, r4= 3.71,  &end
#
#  19 ARG+ HN     19 ARG+ QB      2.96                
 &rst
  ixpk= 0, nxpk= 0, iat= 257,  -1, r1= 1.30, r2= 1.80, r3= 3.32, r4= 3.82,
 igr2= 261, 262,
 &end
#
#  19 ARG+ HN     19 ARG+ QG      4.95                
 &rst
  ixpk= 0, nxpk= 0, iat= 257,  -1, r1= 1.30, r2= 1.80, r3= 5.56, r4= 6.06,
 igr2= 264, 265,
 &end
#
#  19 ARG+ HN     20 TYR  HN      3.11                
 &rst
  ixpk= 0, nxpk= 0, iat= 257, 281, r1= 1.30, r2= 1.80, r3= 3.11, r4= 3.61,  &end
#
#  19 ARG+ HA     19 ARG+ QD      6.35                
 &rst
  ixpk= 0, nxpk= 0, iat= 259,  -1, r1= 1.30, r2= 1.80, r3= 7.13, r4= 7.63,
 igr2= 267, 268,
 &end
#
#  19 ARG+ HA     21 TYR  QD      7.58                
 &rst
  ixpk= 0, nxpk= 0, iat= 259,  -1, r1= 1.30, r2= 1.80, r3= 8.51, r4= 9.01,
 igr2= 310, 319,
 &end
#
#  19 ARG+ HA     22 SER  HN      3.95                
 &rst
  ixpk= 0, nxpk= 0, iat= 259, 323, r1= 1.30, r2= 1.80, r3= 3.95, r4= 4.45,  &end
#
#  19 ARG+ HA     22 SER  QB      4.73                
 &rst
  ixpk= 0, nxpk= 0, iat= 259,  -1, r1= 1.30, r2= 1.80, r3= 5.31, r4= 5.81,
 igr2= 327, 328,
 &end
#
#  19 ARG+ HB2    20 TYR  HN      3.67                
 &rst
  ixpk= 0, nxpk= 0, iat= 261, 281, r1= 1.30, r2= 1.80, r3= 3.67, r4= 4.17,  &end
#
#  19 ARG+ HB3    20 TYR  HN      3.67                
 &rst
  ixpk= 0, nxpk= 0, iat= 262, 281, r1= 1.30, r2= 1.80, r3= 3.67, r4= 4.17,  &end
#
#  19 ARG+ QB     20 TYR  HN      3.36                
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 281, r1= 1.30, r2= 1.80, r3= 3.77, r4= 4.27,
 igr1= 261, 262,
 &end
#
#  19 ARG+ QB     20 TYR  QD      8.52                
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3=10.73, r4=11.23,
 igr1= 261, 262,
 igr2= 289, 298,
 &end
#
#  20 TYR  HN     20 TYR  HB2     3.27                
 &rst
  ixpk= 0, nxpk= 0, iat= 281, 285, r1= 1.30, r2= 1.80, r3= 3.27, r4= 3.77,  &end
#
#  20 TYR  HN     20 TYR  HB3     3.27                
 &rst
  ixpk= 0, nxpk= 0, iat= 281, 286, r1= 1.30, r2= 1.80, r3= 3.27, r4= 3.77,  &end
#
#  20 TYR  HN     20 TYR  QB      3.04                
 &rst
  ixpk= 0, nxpk= 0, iat= 281,  -1, r1= 1.30, r2= 1.80, r3= 3.41, r4= 3.91,
 igr2= 285, 286,
 &end
#
#  20 TYR  HN     21 TYR  HN      3.39                
 &rst
  ixpk= 0, nxpk= 0, iat= 281, 302, r1= 1.30, r2= 1.80, r3= 3.39, r4= 3.89,  &end
#
#  20 TYR  HN     22 SER  HN      4.26                
 &rst
  ixpk= 0, nxpk= 0, iat= 281, 323, r1= 1.30, r2= 1.80, r3= 4.26, r4= 4.76,  &end
#
#  20 TYR  HA     23 ALA  HN      3.86                
 &rst
  ixpk= 0, nxpk= 0, iat= 283, 334, r1= 1.30, r2= 1.80, r3= 3.86, r4= 4.36,  &end
#
#  20 TYR  HA     23 ALA  QB      5.13                
 &rst
  ixpk= 0, nxpk= 0, iat= 283,  -1, r1= 1.30, r2= 1.80, r3= 6.16, r4= 6.66,
 igr2= 338, 339, 340,
 &end
#
#  20 TYR  HA     24 LEU  HN      5.50                
 &rst
  ixpk= 0, nxpk= 0, iat= 283, 344, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#  20 TYR  HB2    21 TYR  HN      3.61                
 &rst
  ixpk= 0, nxpk= 0, iat= 285, 302, r1= 1.30, r2= 1.80, r3= 3.61, r4= 4.11,  &end
#
#  20 TYR  HB3    21 TYR  HN      3.61                
 &rst
  ixpk= 0, nxpk= 0, iat= 286, 302, r1= 1.30, r2= 1.80, r3= 3.61, r4= 4.11,  &end
#
#  20 TYR  QB     21 TYR  HN      3.34                
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 302, r1= 1.30, r2= 1.80, r3= 3.75, r4= 4.25,
 igr1= 285, 286,
 &end
#
#  21 TYR  HN     22 SER  HN      3.55                
 &rst
  ixpk= 0, nxpk= 0, iat= 302, 323, r1= 1.30, r2= 1.80, r3= 3.55, r4= 4.05,  &end
#
#  21 TYR  HA     24 LEU  HN      4.32                
 &rst
  ixpk= 0, nxpk= 0, iat= 304, 344, r1= 1.30, r2= 1.80, r3= 4.32, r4= 4.82,  &end
#
#  21 TYR  HA     24 LEU  QB      5.07                
 &rst
  ixpk= 0, nxpk= 0, iat= 304,  -1, r1= 1.30, r2= 1.80, r3= 5.69, r4= 6.19,
 igr2= 348, 349,
 &end
#
#  21 TYR  HA     24 LEU  HG      4.57                
 &rst
  ixpk= 0, nxpk= 0, iat= 304, 351, r1= 1.30, r2= 1.80, r3= 4.57, r4= 5.07,  &end
#
#  21 TYR  HA     25 ARG+ HN      4.57                
 &rst
  ixpk= 0, nxpk= 0, iat= 304, 363, r1= 1.30, r2= 1.80, r3= 4.57, r4= 5.07,  &end
#
#  21 TYR  QB     22 SER  HN      4.45                
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 323, r1= 1.30, r2= 1.80, r3= 4.99, r4= 5.49,
 igr1= 306, 307,
 &end
#
#  21 TYR  QD     22 SER  HN      7.64                
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 323, r1= 1.30, r2= 1.80, r3= 8.58, r4= 9.08,
 igr1= 310, 319,
 &end
#
#  21 TYR  QD     22 SER  HA      7.64                
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 325, r1= 1.30, r2= 1.80, r3= 8.58, r4= 9.08,
 igr1= 310, 319,
 &end
#
#  21 TYR  QD     23 ALA  QB      8.67                
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3=11.69, r4=12.19,
 igr1= 310, 319,
 igr2= 338, 339, 340,
 &end
#
#  21 TYR  QD     24 LEU  QD1     8.67                
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3=11.69, r4=12.19,
 igr1= 310, 319,
 igr2= 353, 354, 355,
 &end
#
#  21 TYR  QD     24 LEU  QD2     8.67                
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3=11.69, r4=12.19,
 igr1= 310, 319,
 igr2= 357, 358, 359,
 &end
#
#  21 TYR  QE     24 LEU  QD1     8.66                
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3=11.67, r4=12.17,
 igr1= 312, 317,
 igr2= 353, 354, 355,
 &end
#
#  21 TYR  QE     24 LEU  QD2     8.66                
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3=11.67, r4=12.17,
 igr1= 312, 317,
 igr2= 357, 358, 359,
 &end
#
#  22 SER  HN     22 SER  HA      2.87                
 &rst
  ixpk= 0, nxpk= 0, iat= 323, 325, r1= 1.30, r2= 1.80, r3= 2.87, r4= 3.37,  &end
#
#  22 SER  HN     23 ALA  HN      3.48                
 &rst
  ixpk= 0, nxpk= 0, iat= 323, 334, r1= 1.30, r2= 1.80, r3= 3.48, r4= 3.98,  &end
#
#  22 SER  HN     24 LEU  HN      4.07                
 &rst
  ixpk= 0, nxpk= 0, iat= 323, 344, r1= 1.30, r2= 1.80, r3= 4.07, r4= 4.57,  &end
#
#  22 SER  HA     23 ALA  HN      3.58                
 &rst
  ixpk= 0, nxpk= 0, iat= 325, 334, r1= 1.30, r2= 1.80, r3= 3.58, r4= 4.08,  &end
#
#  22 SER  HA     25 ARG+ HN      3.36                
 &rst
  ixpk= 0, nxpk= 0, iat= 325, 363, r1= 1.30, r2= 1.80, r3= 3.36, r4= 3.86,  &end
#
#  23 ALA  HN     24 LEU  HN      3.11                
 &rst
  ixpk= 0, nxpk= 0, iat= 334, 344, r1= 1.30, r2= 1.80, r3= 3.11, r4= 3.61,  &end
#
#  23 ALA  HA     26 ARG+ HN      3.42                
 &rst
  ixpk= 0, nxpk= 0, iat= 336, 387, r1= 1.30, r2= 1.80, r3= 3.42, r4= 3.92,  &end
#
#  23 ALA  QB     25 ARG+ HN      6.53                
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 363, r1= 1.30, r2= 1.80, r3= 7.84, r4= 8.34,
 igr1= 338, 339, 340,
 &end
#
#  23 ALA  QB     27 TYR  QD      8.67                
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3=11.69, r4=12.19,
 igr1= 338, 339, 340,
 igr2= 419, 428,
 &end
#
#  23 ALA  QB     27 TYR  QE      8.66                
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3=11.67, r4=12.17,
 igr1= 338, 339, 340,
 igr2= 421, 426,
 &end
#
#  24 LEU  HN     24 LEU  HG      4.01                
 &rst
  ixpk= 0, nxpk= 0, iat= 344, 351, r1= 1.30, r2= 1.80, r3= 4.01, r4= 4.51,  &end
#
#  24 LEU  HN     24 LEU  QD1     6.53                
 &rst
  ixpk= 0, nxpk= 0, iat= 344,  -1, r1= 1.30, r2= 1.80, r3= 7.84, r4= 8.34,
 igr2= 353, 354, 355,
 &end
#
#  24 LEU  HN     24 LEU  QD2     6.53                
 &rst
  ixpk= 0, nxpk= 0, iat= 344,  -1, r1= 1.30, r2= 1.80, r3= 7.84, r4= 8.34,
 igr2= 357, 358, 359,
 &end
#
#  24 LEU  HA     24 LEU  HG      3.39                
 &rst
  ixpk= 0, nxpk= 0, iat= 346, 351, r1= 1.30, r2= 1.80, r3= 3.39, r4= 3.89,  &end
#
#  24 LEU  HA     24 LEU  QD1     5.57                
 &rst
  ixpk= 0, nxpk= 0, iat= 346,  -1, r1= 1.30, r2= 1.80, r3= 6.69, r4= 7.19,
 igr2= 353, 354, 355,
 &end
#
#  24 LEU  HA     24 LEU  QD2     5.57                
 &rst
  ixpk= 0, nxpk= 0, iat= 346,  -1, r1= 1.30, r2= 1.80, r3= 6.69, r4= 7.19,
 igr2= 357, 358, 359,
 &end
#
#  24 LEU  HA     25 ARG+ HN      3.61                
 &rst
  ixpk= 0, nxpk= 0, iat= 346, 363, r1= 1.30, r2= 1.80, r3= 3.61, r4= 4.11,  &end
#
#  24 LEU  HA     27 TYR  HN      3.55                
 &rst
  ixpk= 0, nxpk= 0, iat= 346, 411, r1= 1.30, r2= 1.80, r3= 3.55, r4= 4.05,  &end
#
#  24 LEU  HA     27 TYR  QB      4.89                
 &rst
  ixpk= 0, nxpk= 0, iat= 346,  -1, r1= 1.30, r2= 1.80, r3= 5.49, r4= 5.99,
 igr2= 415, 416,
 &end
#
#  24 LEU  HA     27 TYR  QD      7.21                
 &rst
  ixpk= 0, nxpk= 0, iat= 346,  -1, r1= 1.30, r2= 1.80, r3= 8.09, r4= 8.59,
 igr2= 419, 428,
 &end
#
#  24 LEU  HA     27 TYR  QE      7.63                
 &rst
  ixpk= 0, nxpk= 0, iat= 346,  -1, r1= 1.30, r2= 1.80, r3= 8.56, r4= 9.06,
 igr2= 421, 426,
 &end
#
#  24 LEU  HA     28 ILE  HN      4.35                
 &rst
  ixpk= 0, nxpk= 0, iat= 346, 432, r1= 1.30, r2= 1.80, r3= 4.35, r4= 4.85,  &end
#
#  24 LEU  QD1    25 ARG+ HN      6.53                
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 363, r1= 1.30, r2= 1.80, r3= 7.84, r4= 8.34,
 igr1= 353, 354, 355,
 &end
#
#  24 LEU  QD1    25 ARG+ QD      7.40                
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 9.98, r4=10.48,
 igr1= 353, 354, 355,
 igr2= 373, 374,
 &end
#
#  24 LEU  QD1    27 TYR  QD      8.67                
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3=11.69, r4=12.19,
 igr1= 353, 354, 355,
 igr2= 419, 428,
 &end
#
#  24 LEU  QD2    25 ARG+ HN      6.53                
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 363, r1= 1.30, r2= 1.80, r3= 7.84, r4= 8.34,
 igr1= 357, 358, 359,
 &end
#
#  24 LEU  QD2    25 ARG+ QD      7.40                
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 9.98, r4=10.48,
 igr1= 357, 358, 359,
 igr2= 373, 374,
 &end
#
#  24 LEU  QD2    27 TYR  QD      8.67                
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3=11.69, r4=12.19,
 igr1= 357, 358, 359,
 igr2= 419, 428,
 &end
#
#  25 ARG+ HN     25 ARG+ HB2     3.24                
 &rst
  ixpk= 0, nxpk= 0, iat= 363, 367, r1= 1.30, r2= 1.80, r3= 3.24, r4= 3.74,  &end
#
#  25 ARG+ HN     25 ARG+ HB3     3.24                
 &rst
  ixpk= 0, nxpk= 0, iat= 363, 368, r1= 1.30, r2= 1.80, r3= 3.24, r4= 3.74,  &end
#
#  25 ARG+ HN     25 ARG+ QB      2.91                
 &rst
  ixpk= 0, nxpk= 0, iat= 363,  -1, r1= 1.30, r2= 1.80, r3= 3.27, r4= 3.77,
 igr2= 367, 368,
 &end
#
#  25 ARG+ HN     25 ARG+ HG2     5.44                
 &rst
  ixpk= 0, nxpk= 0, iat= 363, 370, r1= 1.30, r2= 1.80, r3= 5.44, r4= 5.94,  &end
#
#  25 ARG+ HN     25 ARG+ HG3     5.44                
 &rst
  ixpk= 0, nxpk= 0, iat= 363, 371, r1= 1.30, r2= 1.80, r3= 5.44, r4= 5.94,  &end
#
#  25 ARG+ HN     26 ARG+ HN      3.30                
 &rst
  ixpk= 0, nxpk= 0, iat= 363, 387, r1= 1.30, r2= 1.80, r3= 3.30, r4= 3.80,  &end
#
#  25 ARG+ HA     25 ARG+ QD      6.38                
 &rst
  ixpk= 0, nxpk= 0, iat= 365,  -1, r1= 1.30, r2= 1.80, r3= 7.16, r4= 7.66,
 igr2= 373, 374,
 &end
#
#  25 ARG+ HA     28 ILE  HN      4.29                
 &rst
  ixpk= 0, nxpk= 0, iat= 365, 432, r1= 1.30, r2= 1.80, r3= 4.29, r4= 4.79,  &end
#
#  25 ARG+ HA     28 ILE  HB      3.21                
 &rst
  ixpk= 0, nxpk= 0, iat= 365, 436, r1= 1.30, r2= 1.80, r3= 3.21, r4= 3.71,  &end
#
#  25 ARG+ HA     28 ILE  QG2     5.13                
 &rst
  ixpk= 0, nxpk= 0, iat= 365,  -1, r1= 1.30, r2= 1.80, r3= 6.16, r4= 6.66,
 igr2= 438, 439, 440,
 &end
#
#  25 ARG+ HA     28 ILE  HG12    5.50                
 &rst
  ixpk= 0, nxpk= 0, iat= 365, 442, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#  25 ARG+ HA     28 ILE  HG13    5.50                
 &rst
  ixpk= 0, nxpk= 0, iat= 365, 443, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#  25 ARG+ HA     28 ILE  QD1     5.91                
 &rst
  ixpk= 0, nxpk= 0, iat= 365,  -1, r1= 1.30, r2= 1.80, r3= 7.10, r4= 7.60,
 igr2= 445, 446, 447,
 &end
#
#  25 ARG+ HA     29 ASN  HN      4.51                
 &rst
  ixpk= 0, nxpk= 0, iat= 365, 451, r1= 1.30, r2= 1.80, r3= 4.51, r4= 5.01,  &end
#
#  25 ARG+ QB     26 ARG+ HA      4.76                
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 389, r1= 1.30, r2= 1.80, r3= 5.34, r4= 5.84,
 igr1= 367, 368,
 &end
#
#  25 ARG+ QD     26 ARG+ HA      6.38                
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 389, r1= 1.30, r2= 1.80, r3= 7.16, r4= 7.66,
 igr1= 373, 374,
 &end
#
#  26 ARG+ HN     26 ARG+ HB2     3.02                
 &rst
  ixpk= 0, nxpk= 0, iat= 387, 391, r1= 1.30, r2= 1.80, r3= 3.02, r4= 3.52,  &end
#
#  26 ARG+ HN     26 ARG+ HB3     3.02                
 &rst
  ixpk= 0, nxpk= 0, iat= 387, 392, r1= 1.30, r2= 1.80, r3= 3.02, r4= 3.52,  &end
#
#  26 ARG+ HN     26 ARG+ HG2     5.50                
 &rst
  ixpk= 0, nxpk= 0, iat= 387, 394, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#  26 ARG+ HN     26 ARG+ HG3     5.50                
 &rst
  ixpk= 0, nxpk= 0, iat= 387, 395, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#  26 ARG+ HN     26 ARG+ QG      4.90                
 &rst
  ixpk= 0, nxpk= 0, iat= 387,  -1, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,
 igr2= 394, 395,
 &end
#
#  26 ARG+ HN     27 TYR  HN      3.05                
 &rst
  ixpk= 0, nxpk= 0, iat= 387, 411, r1= 1.30, r2= 1.80, r3= 3.05, r4= 3.55,  &end
#
#  26 ARG+ HA     26 ARG+ QD      6.38                
 &rst
  ixpk= 0, nxpk= 0, iat= 389,  -1, r1= 1.30, r2= 1.80, r3= 7.16, r4= 7.66,
 igr2= 397, 398,
 &end
#
#  26 ARG+ HA     29 ASN  HN      4.01                
 &rst
  ixpk= 0, nxpk= 0, iat= 389, 451, r1= 1.30, r2= 1.80, r3= 4.01, r4= 4.51,  &end
#
#  26 ARG+ HA     29 ASN  HB2     4.04                
 &rst
  ixpk= 0, nxpk= 0, iat= 389, 455, r1= 1.30, r2= 1.80, r3= 4.04, r4= 4.54,  &end
#
#  26 ARG+ HA     29 ASN  HB3     4.04                
 &rst
  ixpk= 0, nxpk= 0, iat= 389, 456, r1= 1.30, r2= 1.80, r3= 4.04, r4= 4.54,  &end
#
#  26 ARG+ HA     29 ASN  QB      3.81                
 &rst
  ixpk= 0, nxpk= 0, iat= 389,  -1, r1= 1.30, r2= 1.80, r3= 4.28, r4= 4.78,
 igr2= 455, 456,
 &end
#
#  26 ARG+ HA     30 MET  HN      4.14                
 &rst
  ixpk= 0, nxpk= 0, iat= 389, 465, r1= 1.30, r2= 1.80, r3= 4.14, r4= 4.64,  &end
#
#  26 ARG+ HB2    27 TYR  HN      3.76                
 &rst
  ixpk= 0, nxpk= 0, iat= 391, 411, r1= 1.30, r2= 1.80, r3= 3.76, r4= 4.26,  &end
#
#  26 ARG+ HB3    27 TYR  HN      3.76                
 &rst
  ixpk= 0, nxpk= 0, iat= 392, 411, r1= 1.30, r2= 1.80, r3= 3.76, r4= 4.26,  &end
#
#  26 ARG+ QB     27 TYR  HN      3.50                
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 411, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1= 391, 392,
 &end
#
#  27 TYR  HN     28 ILE  HN      3.17                
 &rst
  ixpk= 0, nxpk= 0, iat= 411, 432, r1= 1.30, r2= 1.80, r3= 3.17, r4= 3.67,  &end
#
#  27 TYR  HA     30 MET  HN      3.45                
 &rst
  ixpk= 0, nxpk= 0, iat= 413, 465, r1= 1.30, r2= 1.80, r3= 3.45, r4= 3.95,  &end
#
#  27 TYR  HA     30 MET  HB2     4.26                
 &rst
  ixpk= 0, nxpk= 0, iat= 413, 469, r1= 1.30, r2= 1.80, r3= 4.26, r4= 4.76,  &end
#
#  27 TYR  HA     30 MET  HB3     4.26                
 &rst
  ixpk= 0, nxpk= 0, iat= 413, 470, r1= 1.30, r2= 1.80, r3= 4.26, r4= 4.76,  &end
#
#  27 TYR  HA     30 MET  HG2     5.50                
 &rst
  ixpk= 0, nxpk= 0, iat= 413, 472, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#  27 TYR  HA     30 MET  HG3     5.50                
 &rst
  ixpk= 0, nxpk= 0, iat= 413, 473, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#  27 TYR  HA     30 MET  QE      6.53                
 &rst
  ixpk= 0, nxpk= 0, iat= 413,  -1, r1= 1.30, r2= 1.80, r3= 7.84, r4= 8.34,
 igr2= 476, 477, 478,
 &end
#
#  27 TYR  HA     31 LEU  HN      5.50                
 &rst
  ixpk= 0, nxpk= 0, iat= 413, 482, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#  27 TYR  QD     30 MET  QE      8.67                
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3=11.69, r4=12.19,
 igr1= 419, 428,
 igr2= 476, 477, 478,
 &end
#
#  27 TYR  QE     28 ILE  QG2     8.66                
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3=11.67, r4=12.17,
 igr1= 421, 426,
 igr2= 438, 439, 440,
 &end
#
#  27 TYR  QE     30 MET  QE      8.66                
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3=11.67, r4=12.17,
 igr1= 421, 426,
 igr2= 476, 477, 478,
 &end
#
#  27 TYR  QE     31 LEU  QD1     8.66                
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3=11.67, r4=12.17,
 igr1= 421, 426,
 igr2= 491, 492, 493,
 &end
#
#  27 TYR  QE     31 LEU  QD2     8.66                
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3=11.67, r4=12.17,
 igr1= 421, 426,
 igr2= 495, 496, 497,
 &end
#
#  28 ILE  HN     28 ILE  HB      3.05                
 &rst
  ixpk= 0, nxpk= 0, iat= 432, 436, r1= 1.30, r2= 1.80, r3= 3.05, r4= 3.55,  &end
#
#  28 ILE  HN     28 ILE  HG12    4.32                
 &rst
  ixpk= 0, nxpk= 0, iat= 432, 442, r1= 1.30, r2= 1.80, r3= 4.32, r4= 4.82,  &end
#
#  28 ILE  HN     28 ILE  HG13    4.32                
 &rst
  ixpk= 0, nxpk= 0, iat= 432, 443, r1= 1.30, r2= 1.80, r3= 4.32, r4= 4.82,  &end
#
#  28 ILE  HN     28 ILE  QG1     3.94                
 &rst
  ixpk= 0, nxpk= 0, iat= 432,  -1, r1= 1.30, r2= 1.80, r3= 4.42, r4= 4.92,
 igr2= 442, 443,
 &end
#
#  28 ILE  HN     28 ILE  QD1     6.53                
 &rst
  ixpk= 0, nxpk= 0, iat= 432,  -1, r1= 1.30, r2= 1.80, r3= 7.84, r4= 8.34,
 igr2= 445, 446, 447,
 &end
#
#  28 ILE  HN     29 ASN  HN      3.27                
 &rst
  ixpk= 0, nxpk= 0, iat= 432, 451, r1= 1.30, r2= 1.80, r3= 3.27, r4= 3.77,  &end
#
#  28 ILE  HA     30 MET  HN      4.91                
 &rst
  ixpk= 0, nxpk= 0, iat= 434, 465, r1= 1.30, r2= 1.80, r3= 4.91, r4= 5.41,  &end
#
#  28 ILE  HA     31 LEU  HN      4.11                
 &rst
  ixpk= 0, nxpk= 0, iat= 434, 482, r1= 1.30, r2= 1.80, r3= 4.11, r4= 4.61,  &end
#
#  28 ILE  HA     31 LEU  HB2     3.98                
 &rst
  ixpk= 0, nxpk= 0, iat= 434, 486, r1= 1.30, r2= 1.80, r3= 3.98, r4= 4.48,  &end
#
#  28 ILE  HA     31 LEU  HB3     3.98                
 &rst
  ixpk= 0, nxpk= 0, iat= 434, 487, r1= 1.30, r2= 1.80, r3= 3.98, r4= 4.48,  &end
#
#  28 ILE  HA     31 LEU  HG      5.50                
 &rst
  ixpk= 0, nxpk= 0, iat= 434, 489, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#  28 ILE  HA     31 LEU  QD1     6.53                
 &rst
  ixpk= 0, nxpk= 0, iat= 434,  -1, r1= 1.30, r2= 1.80, r3= 7.84, r4= 8.34,
 igr2= 491, 492, 493,
 &end
#
#  28 ILE  HA     31 LEU  QD2     6.53                
 &rst
  ixpk= 0, nxpk= 0, iat= 434,  -1, r1= 1.30, r2= 1.80, r3= 7.84, r4= 8.34,
 igr2= 495, 496, 497,
 &end
#
#  28 ILE  HA     31 LEU  QQD     5.98                
 &rst
  ixpk= 0, nxpk= 0, iat= 434, 488, r1= 1.30, r2= 1.80, r3= 5.98, r4= 6.48,  &end
#
#  28 ILE  HA     32 THR  HN      4.76                
 &rst
  ixpk= 0, nxpk= 0, iat= 434, 501, r1= 1.30, r2= 1.80, r3= 4.76, r4= 5.26,  &end
#
#  28 ILE  HB     29 ASN  HN      3.45                
 &rst
  ixpk= 0, nxpk= 0, iat= 436, 451, r1= 1.30, r2= 1.80, r3= 3.45, r4= 3.95,  &end
#
#  28 ILE  QG2    29 ASN  HN      6.34                
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 451, r1= 1.30, r2= 1.80, r3= 7.61, r4= 8.11,
 igr1= 438, 439, 440,
 &end
#
#  28 ILE  QG2    29 ASN  HA      6.53                
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 453, r1= 1.30, r2= 1.80, r3= 7.84, r4= 8.34,
 igr1= 438, 439, 440,
 &end
#
#  29 ASN  HN     29 ASN  HB2     3.48                
 &rst
  ixpk= 0, nxpk= 0, iat= 451, 455, r1= 1.30, r2= 1.80, r3= 3.48, r4= 3.98,  &end
#
#  29 ASN  HN     29 ASN  HB3     3.48                
 &rst
  ixpk= 0, nxpk= 0, iat= 451, 456, r1= 1.30, r2= 1.80, r3= 3.48, r4= 3.98,  &end
#
#  29 ASN  HN     29 ASN  QB      3.17                
 &rst
  ixpk= 0, nxpk= 0, iat= 451,  -1, r1= 1.30, r2= 1.80, r3= 3.56, r4= 4.06,
 igr2= 455, 456,
 &end
#
#  29 ASN  HN     30 MET  HN      2.99                
 &rst
  ixpk= 0, nxpk= 0, iat= 451, 465, r1= 1.30, r2= 1.80, r3= 2.99, r4= 3.49,  &end
#
#  29 ASN  HA     31 LEU  HN      5.50                
 &rst
  ixpk= 0, nxpk= 0, iat= 453, 482, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#  29 ASN  HA     32 THR  HN      4.51                
 &rst
  ixpk= 0, nxpk= 0, iat= 453, 501, r1= 1.30, r2= 1.80, r3= 4.51, r4= 5.01,  &end
#
#  29 ASN  HA     32 THR  QG2     6.43                
 &rst
  ixpk= 0, nxpk= 0, iat= 453,  -1, r1= 1.30, r2= 1.80, r3= 7.72, r4= 8.22,
 igr2= 507, 508, 509,
 &end
#
#  29 ASN  HB2    30 MET  HN      4.26                
 &rst
  ixpk= 0, nxpk= 0, iat= 455, 465, r1= 1.30, r2= 1.80, r3= 4.26, r4= 4.76,  &end
#
#  29 ASN  HB3    30 MET  HN      4.26                
 &rst
  ixpk= 0, nxpk= 0, iat= 456, 465, r1= 1.30, r2= 1.80, r3= 4.26, r4= 4.76,  &end
#
#  29 ASN  QB     30 MET  HN      4.06                
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 465, r1= 1.30, r2= 1.80, r3= 4.56, r4= 5.06,
 igr1= 455, 456,
 &end
#
#  30 MET  HN     30 MET  HB2     3.52                
 &rst
  ixpk= 0, nxpk= 0, iat= 465, 469, r1= 1.30, r2= 1.80, r3= 3.52, r4= 4.02,  &end
#
#  30 MET  HN     30 MET  HB3     3.52                
 &rst
  ixpk= 0, nxpk= 0, iat= 465, 470, r1= 1.30, r2= 1.80, r3= 3.52, r4= 4.02,  &end
#
#  30 MET  HN     30 MET  QB      3.26                
 &rst
  ixpk= 0, nxpk= 0, iat= 465,  -1, r1= 1.30, r2= 1.80, r3= 3.66, r4= 4.16,
 igr2= 469, 470,
 &end
#
#  30 MET  HN     30 MET  HG2     5.50                
 &rst
  ixpk= 0, nxpk= 0, iat= 465, 472, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#  30 MET  HN     30 MET  HG3     5.50                
 &rst
  ixpk= 0, nxpk= 0, iat= 465, 473, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#  30 MET  HN     30 MET  QG      4.84                
 &rst
  ixpk= 0, nxpk= 0, iat= 465,  -1, r1= 1.30, r2= 1.80, r3= 5.43, r4= 5.93,
 igr2= 472, 473,
 &end
#
#  30 MET  HN     31 LEU  HN      3.42                
 &rst
  ixpk= 0, nxpk= 0, iat= 465, 482, r1= 1.30, r2= 1.80, r3= 3.42, r4= 3.92,  &end
#
#  30 MET  HN     32 THR  HN      4.32                
 &rst
  ixpk= 0, nxpk= 0, iat= 465, 501, r1= 1.30, r2= 1.80, r3= 4.32, r4= 4.82,  &end
#
#  30 MET  HA     32 THR  HN      4.60                
 &rst
  ixpk= 0, nxpk= 0, iat= 467, 501, r1= 1.30, r2= 1.80, r3= 4.60, r4= 5.10,  &end
#
#  30 MET  HA     33 ARG+ HN      5.50                
 &rst
  ixpk= 0, nxpk= 0, iat= 467, 515, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#  30 MET  HA     33 ARG+ QB      6.22                
 &rst
  ixpk= 0, nxpk= 0, iat= 467,  -1, r1= 1.30, r2= 1.80, r3= 6.98, r4= 7.48,
 igr2= 519, 520,
 &end
#
#  30 MET  HB2    31 LEU  HN      4.14                
 &rst
  ixpk= 0, nxpk= 0, iat= 469, 482, r1= 1.30, r2= 1.80, r3= 4.14, r4= 4.64,  &end
#
#  30 MET  HB3    31 LEU  HN      4.14                
 &rst
  ixpk= 0, nxpk= 0, iat= 470, 482, r1= 1.30, r2= 1.80, r3= 4.14, r4= 4.64,  &end
#
#  31 LEU  HN     31 LEU  HB2     3.33                
 &rst
  ixpk= 0, nxpk= 0, iat= 482, 486, r1= 1.30, r2= 1.80, r3= 3.33, r4= 3.83,  &end
#
#  31 LEU  HN     31 LEU  HB3     3.33                
 &rst
  ixpk= 0, nxpk= 0, iat= 482, 487, r1= 1.30, r2= 1.80, r3= 3.33, r4= 3.83,  &end
#
#  31 LEU  HN     31 LEU  QB      3.09                
 &rst
  ixpk= 0, nxpk= 0, iat= 482,  -1, r1= 1.30, r2= 1.80, r3= 3.47, r4= 3.97,
 igr2= 486, 487,
 &end
#
#  31 LEU  HN     31 LEU  HG      3.80                
 &rst
  ixpk= 0, nxpk= 0, iat= 482, 489, r1= 1.30, r2= 1.80, r3= 3.80, r4= 4.30,  &end
#
#  31 LEU  HN     31 LEU  QD1     6.53                
 &rst
  ixpk= 0, nxpk= 0, iat= 482,  -1, r1= 1.30, r2= 1.80, r3= 7.84, r4= 8.34,
 igr2= 491, 492, 493,
 &end
#
#  31 LEU  HN     31 LEU  QD2     6.53                
 &rst
  ixpk= 0, nxpk= 0, iat= 482,  -1, r1= 1.30, r2= 1.80, r3= 7.84, r4= 8.34,
 igr2= 495, 496, 497,
 &end
#
#  31 LEU  HN     32 THR  HN      3.42                
 &rst
  ixpk= 0, nxpk= 0, iat= 482, 501, r1= 1.30, r2= 1.80, r3= 3.42, r4= 3.92,  &end
#
#  31 LEU  HA     31 LEU  HG      3.95                
 &rst
  ixpk= 0, nxpk= 0, iat= 484, 489, r1= 1.30, r2= 1.80, r3= 3.95, r4= 4.45,  &end
#
#  31 LEU  HA     31 LEU  QD1     6.31                
 &rst
  ixpk= 0, nxpk= 0, iat= 484,  -1, r1= 1.30, r2= 1.80, r3= 7.58, r4= 8.08,
 igr2= 491, 492, 493,
 &end
#
#  31 LEU  HA     31 LEU  QD2     6.31                
 &rst
  ixpk= 0, nxpk= 0, iat= 484,  -1, r1= 1.30, r2= 1.80, r3= 7.58, r4= 8.08,
 igr2= 495, 496, 497,
 &end
#
#  31 LEU  HA     32 THR  HN      3.45                
 &rst
  ixpk= 0, nxpk= 0, iat= 484, 501, r1= 1.30, r2= 1.80, r3= 3.45, r4= 3.95,  &end
#
#  31 LEU  HB2    32 THR  HN      3.83                
 &rst
  ixpk= 0, nxpk= 0, iat= 486, 501, r1= 1.30, r2= 1.80, r3= 3.83, r4= 4.33,  &end
#
#  31 LEU  HB3    32 THR  HN      3.83                
 &rst
  ixpk= 0, nxpk= 0, iat= 487, 501, r1= 1.30, r2= 1.80, r3= 3.83, r4= 4.33,  &end
#
#  31 LEU  QB     32 THR  HN      3.46                
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 501, r1= 1.30, r2= 1.80, r3= 3.88, r4= 4.38,
 igr1= 486, 487,
 &end
#
#  31 LEU  HG     32 THR  HN      4.82                
 &rst
  ixpk= 0, nxpk= 0, iat= 489, 501, r1= 1.30, r2= 1.80, r3= 4.82, r4= 5.32,  &end
#
#  31 LEU  QD1    32 THR  HN      6.53                
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 501, r1= 1.30, r2= 1.80, r3= 7.84, r4= 8.34,
 igr1= 491, 492, 493,
 &end
#
#  31 LEU  QD2    32 THR  HN      6.53                
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 501, r1= 1.30, r2= 1.80, r3= 7.84, r4= 8.34,
 igr1= 495, 496, 497,
 &end
#
#  32 THR  HN     32 THR  HB      3.98                
 &rst
  ixpk= 0, nxpk= 0, iat= 501, 505, r1= 1.30, r2= 1.80, r3= 3.98, r4= 4.48,  &end
#
#  32 THR  HN     33 ARG+ HN      3.24                
 &rst
  ixpk= 0, nxpk= 0, iat= 501, 515, r1= 1.30, r2= 1.80, r3= 3.24, r4= 3.74,  &end
#
#  32 THR  HA     33 ARG+ HN      3.36                
 &rst
  ixpk= 0, nxpk= 0, iat= 503, 515, r1= 1.30, r2= 1.80, r3= 3.36, r4= 3.86,  &end
#
#  32 THR  HA     35 ARG+ QB      6.38                
 &rst
  ixpk= 0, nxpk= 0, iat= 503,  -1, r1= 1.30, r2= 1.80, r3= 7.16, r4= 7.66,
 igr2= 557, 558,
 &end
#
#  32 THR  HB     33 ARG+ HN      4.29                
 &rst
  ixpk= 0, nxpk= 0, iat= 505, 515, r1= 1.30, r2= 1.80, r3= 4.29, r4= 4.79,  &end
#
#  32 THR  QG2    33 ARG+ HN      6.53                
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 515, r1= 1.30, r2= 1.80, r3= 7.84, r4= 8.34,
 igr1= 507, 508, 509,
 &end
#
#  33 ARG+ HN     33 ARG+ HB2     3.67                
 &rst
  ixpk= 0, nxpk= 0, iat= 515, 519, r1= 1.30, r2= 1.80, r3= 3.67, r4= 4.17,  &end
#
#  33 ARG+ HN     33 ARG+ HB3     3.67                
 &rst
  ixpk= 0, nxpk= 0, iat= 515, 520, r1= 1.30, r2= 1.80, r3= 3.67, r4= 4.17,  &end
#
#  33 ARG+ HN     33 ARG+ QB      3.29                
 &rst
  ixpk= 0, nxpk= 0, iat= 515,  -1, r1= 1.30, r2= 1.80, r3= 3.69, r4= 4.19,
 igr2= 519, 520,
 &end
#
#  33 ARG+ HN     34 PRO  QD      6.38                
 &rst
  ixpk= 0, nxpk= 0, iat= 515,  -1, r1= 1.30, r2= 1.80, r3= 7.16, r4= 7.66,
 igr2= 540, 541,
 &end
#
#  33 ARG+ HB2    34 PRO  HD2     5.50                
 &rst
  ixpk= 0, nxpk= 0, iat= 519, 540, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#  33 ARG+ HB2    34 PRO  HD3     5.50                
 &rst
  ixpk= 0, nxpk= 0, iat= 519, 541, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#  33 ARG+ HB3    34 PRO  HD2     5.50                
 &rst
  ixpk= 0, nxpk= 0, iat= 520, 540, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#  33 ARG+ HB3    34 PRO  HD3     5.50                
 &rst
  ixpk= 0, nxpk= 0, iat= 520, 541, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#  33 ARG+ QB     34 PRO  QD      5.18                
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.53, r4= 7.03,
 igr1= 519, 520,
 igr2= 540, 541,
 &end
#
#  33 ARG+ QG     34 PRO  QD      7.25                
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 9.13, r4= 9.63,
 igr1= 522, 523,
 igr2= 540, 541,
 &end
#
#  34 PRO  HA     35 ARG+ HN      3.08                
 &rst
  ixpk= 0, nxpk= 0, iat= 549, 553, r1= 1.30, r2= 1.80, r3= 3.08, r4= 3.58,  &end
#
#  35 ARG+ HN     36 TYR  HN      3.21                
 &rst
  ixpk= 0, nxpk= 0, iat= 553, 577, r1= 1.30, r2= 1.80, r3= 3.21, r4= 3.71,  &end
#
#  35 ARG+ HA     35 ARG+ QD      6.38                
 &rst
  ixpk= 0, nxpk= 0, iat= 555,  -1, r1= 1.30, r2= 1.80, r3= 7.16, r4= 7.66,
 igr2= 563, 564,
 &end
#
#  35 ARG+ HA     36 TYR  HN      3.48                
 &rst
  ixpk= 0, nxpk= 0, iat= 555, 577, r1= 1.30, r2= 1.80, r3= 3.48, r4= 3.98,  &end
#
#  36 TYR  HN     36 TYR  HB2     3.95                
 &rst
  ixpk= 0, nxpk= 0, iat= 577, 581, r1= 1.30, r2= 1.80, r3= 3.95, r4= 4.45,  &end
#
#  36 TYR  HN     36 TYR  HB3     3.95                
 &rst
  ixpk= 0, nxpk= 0, iat= 577, 582, r1= 1.30, r2= 1.80, r3= 3.95, r4= 4.45,  &end
#
#  36 TYR  HN     36 TYR  QB      3.67                
 &rst
  ixpk= 0, nxpk= 0, iat= 577,  -1, r1= 1.30, r2= 1.80, r3= 4.12, r4= 4.62,
 igr2= 581, 582,
 &end
# 2945 atoms read from pdb file ../step3/PC1.pdb.
# 1 ALA PSI:  (1 ALA N)-(1 ALA CA)-(1 ALA C)-(2 PRO N) -305.0 -45.0
 &rst     iat =     1,     5,    11,    13,
	  r1 = -306.0, r2 = -305.0, r3 = -45.0, r4 = -44.0,
	  rk2 =   2.0, rk3 =   2.0,				&end

# 1 ALA PSI:  (1 ALA N)-(1 ALA CA)-(1 ALA C)-(2 PRO N) -65.0 195.0
 &rst     iat =     1,     5,    11,    13,
	  r1 = -66.0, r2 = -65.0, r3 = 195.0, r4 = 196.0,
	&end

# 2 PRO PSI:  (2 PRO N)-(2 PRO CA)-(2 PRO C)-(3 LEU N) -315.0  15.0
 &rst     iat =    13,    23,    25,    27,
	  r1 = -316.0, r2 = -315.0, r3 =  15.0, r4 =  16.0,
	&end

# 2 PRO PSI:  (2 PRO N)-(2 PRO CA)-(2 PRO C)-(3 LEU N) -95.0 205.0
 &rst     iat =    13,    23,    25,    27,
	  r1 = -96.0, r2 = -95.0, r3 = 205.0, r4 = 206.0,
	&end

# 3 LEU PHI:  (2 PRO C)-(3 LEU N)-(3 LEU CA)-(3 LEU C)  25.0 335.0
 &rst     iat =    25,    27,    29,    44,
	  r1 =  24.0, r2 =  25.0, r3 = 335.0, r4 = 336.0,
	&end

# 3 LEU PHI:  (2 PRO C)-(3 LEU N)-(3 LEU CA)-(3 LEU C) -205.0  95.0
 &rst     iat =    25,    27,    29,    44,
	  r1 = -206.0, r2 = -205.0, r3 =  95.0, r4 =  96.0,
	&end

# 3 LEU PSI:  (3 LEU N)-(3 LEU CA)-(3 LEU C)-(4 GLU N) -35.0 275.0
 &rst     iat =    27,    29,    44,    46,
	  r1 = -36.0, r2 = -35.0, r3 = 275.0, r4 = 276.0,
	&end

# 4 GLU PHI:  (3 LEU C)-(4 GLU N)-(4 GLU CA)-(4 GLU C)  25.0 335.0
 &rst     iat =    44,    46,    48,    59,
	  r1 =  24.0, r2 =  25.0, r3 = 335.0, r4 = 336.0,
	&end

# 4 GLU PHI:  (3 LEU C)-(4 GLU N)-(4 GLU CA)-(4 GLU C) -205.0  95.0
 &rst     iat =    44,    46,    48,    59,
	  r1 = -206.0, r2 = -205.0, r3 =  95.0, r4 =  96.0,
	&end

# 4 GLU CHI1:  (4 GLU N)-(4 GLU CA)-(4 GLU CB)-(4 GLU CG) -345.0   5.0
 &rst     iat =    46,    48,    50,    53,
	  r1 = -346.0, r2 = -345.0, r3 =   5.0, r4 =   6.0,
	&end

# 4 GLU CHI1:  (4 GLU N)-(4 GLU CA)-(4 GLU CB)-(4 GLU CG) -225.0 115.0
 &rst     iat =    46,    48,    50,    53,
	  r1 = -226.0, r2 = -225.0, r3 = 115.0, r4 = 116.0,
	&end

# 4 GLU CHI2:  (4 GLU CA)-(4 GLU CB)-(4 GLU CG)-(4 GLU CD)  15.0 345.0
 &rst     iat =    48,    50,    53,    56,
	  r1 =  14.0, r2 =  15.0, r3 = 345.0, r4 = 346.0,
	&end

# 4 GLU PSI:  (4 GLU N)-(4 GLU CA)-(4 GLU C)-(5 PRO N) -305.0 -45.0
 &rst     iat =    46,    48,    59,    61,
	  r1 = -306.0, r2 = -305.0, r3 = -45.0, r4 = -44.0,
	&end

# 4 GLU PSI:  (4 GLU N)-(4 GLU CA)-(4 GLU C)-(5 PRO N) -65.0 185.0
 &rst     iat =    46,    48,    59,    61,
	  r1 = -66.0, r2 = -65.0, r3 = 185.0, r4 = 186.0,
	&end

# 5 PRO PSI:  (5 PRO N)-(5 PRO CA)-(5 PRO C)-(6 VAL N) -315.0  15.0
 &rst     iat =    61,    71,    73,    75,
	  r1 = -316.0, r2 = -315.0, r3 =  15.0, r4 =  16.0,
	&end

# 5 PRO PSI:  (5 PRO N)-(5 PRO CA)-(5 PRO C)-(6 VAL N)  -5.0 205.0
 &rst     iat =    61,    71,    73,    75,
	  r1 =  -6.0, r2 =  -5.0, r3 = 205.0, r4 = 206.0,
	&end

# 6 VAL PHI:  (5 PRO C)-(6 VAL N)-(6 VAL CA)-(6 VAL C) -325.0 -25.0
 &rst     iat =    73,    75,    77,    89,
	  r1 = -326.0, r2 = -325.0, r3 = -25.0, r4 = -24.0,
	&end

# 6 VAL PHI:  (5 PRO C)-(6 VAL N)-(6 VAL CA)-(6 VAL C) -205.0  95.0
 &rst     iat =    73,    75,    77,    89,
	  r1 = -206.0, r2 = -205.0, r3 =  95.0, r4 =  96.0,
	&end

# 6 VAL CHI1:  (6 VAL N)-(6 VAL CA)-(6 VAL CB)-(6 VAL CG1)   5.0 355.0
 &rst     iat =    75,    77,    79,    81,
	  r1 =   4.0, r2 =   5.0, r3 = 355.0, r4 = 356.0,
	&end

# 6 VAL PSI:  (6 VAL N)-(6 VAL CA)-(6 VAL C)-(7 TYR N) -285.0  35.0
 &rst     iat =    75,    77,    89,    91,
	  r1 = -286.0, r2 = -285.0, r3 =  35.0, r4 =  36.0,
	&end

# 6 VAL PSI:  (6 VAL N)-(6 VAL CA)-(6 VAL C)-(7 TYR N) -25.0 265.0
 &rst     iat =    75,    77,    89,    91,
	  r1 = -26.0, r2 = -25.0, r3 = 265.0, r4 = 266.0,
	&end

# 7 TYR PHI:  (6 VAL C)-(7 TYR N)-(7 TYR CA)-(7 TYR C)  25.0 335.0
 &rst     iat =    89,    91,    93,   110,
	  r1 =  24.0, r2 =  25.0, r3 = 335.0, r4 = 336.0,
	&end

# 7 TYR PHI:  (6 VAL C)-(7 TYR N)-(7 TYR CA)-(7 TYR C) -205.0  85.0
 &rst     iat =    89,    91,    93,   110,
	  r1 = -206.0, r2 = -205.0, r3 =  85.0, r4 =  86.0,
	&end

# 7 TYR PSI:  (7 TYR N)-(7 TYR CA)-(7 TYR C)-(8 PRO N) -305.0 -45.0
 &rst     iat =    91,    93,   110,   112,
	  r1 = -306.0, r2 = -305.0, r3 = -45.0, r4 = -44.0,
	&end

# 7 TYR PSI:  (7 TYR N)-(7 TYR CA)-(7 TYR C)-(8 PRO N) -55.0 185.0
 &rst     iat =    91,    93,   110,   112,
	  r1 = -56.0, r2 = -55.0, r3 = 185.0, r4 = 186.0,
	&end

# 8 PRO PSI:  (8 PRO N)-(8 PRO CA)-(8 PRO C)-(9 GLY N) -315.0  15.0
 &rst     iat =   112,   122,   124,   126,
	  r1 = -316.0, r2 = -315.0, r3 =  15.0, r4 =  16.0,
	&end

# 8 PRO PSI:  (8 PRO N)-(8 PRO CA)-(8 PRO C)-(9 GLY N) -95.0 205.0
 &rst     iat =   112,   122,   124,   126,
	  r1 = -96.0, r2 = -95.0, r3 = 205.0, r4 = 206.0,
	&end

# 9 GLY PHI:  (8 PRO C)-(9 GLY N)-(9 GLY CA)-(9 GLY C)  25.0 335.0
 &rst     iat =   124,   126,   128,   131,
	  r1 =  24.0, r2 =  25.0, r3 = 335.0, r4 = 336.0,
	&end

# 9 GLY PSI:  (9 GLY N)-(9 GLY CA)-(9 GLY C)-(10 ASP N) -125.0 125.0
 &rst     iat =   126,   128,   131,   133,
	  r1 = -126.0, r2 = -125.0, r3 = 125.0, r4 = 126.0,
	&end

# 10 ASP PHI:  (9 GLY C)-(10 ASP N)-(10 ASP CA)-(10 ASP C)  25.0 335.0
 &rst     iat =   131,   133,   135,   143,
	  r1 =  24.0, r2 =  25.0, r3 = 335.0, r4 = 336.0,
	&end

# 10 ASP PHI:  (9 GLY C)-(10 ASP N)-(10 ASP CA)-(10 ASP C) -215.0  95.0
 &rst     iat =   131,   133,   135,   143,
	  r1 = -216.0, r2 = -215.0, r3 =  95.0, r4 =  96.0,
	&end

# 10 ASP PSI:  (10 ASP N)-(10 ASP CA)-(10 ASP C)-(11 ASN N) -35.0 215.0
 &rst     iat =   133,   135,   143,   145,
	  r1 = -36.0, r2 = -35.0, r3 = 215.0, r4 = 216.0,
	&end

# 11 ASN PHI:  (10 ASP C)-(11 ASN N)-(11 ASN CA)-(11 ASN C)  25.0 325.0
 &rst     iat =   143,   145,   147,   157,
	  r1 =  24.0, r2 =  25.0, r3 = 325.0, r4 = 326.0,
	&end

# 11 ASN PHI:  (10 ASP C)-(11 ASN N)-(11 ASN CA)-(11 ASN C) -215.0  95.0
 &rst     iat =   143,   145,   147,   157,
	  r1 = -216.0, r2 = -215.0, r3 =  95.0, r4 =  96.0,
	&end

# 11 ASN CHI1:  (11 ASN N)-(11 ASN CA)-(11 ASN CB)-(11 ASN CG) -215.0  95.0
 &rst     iat =   145,   147,   149,   152,
	  r1 = -216.0, r2 = -215.0, r3 =  95.0, r4 =  96.0,
	&end

# 11 ASN CHI2:  (11 ASN CA)-(11 ASN CB)-(11 ASN CG)-(11 ASN OD1) -165.0 155.0
 &rst     iat =   147,   149,   152,   153,
	  r1 = -166.0, r2 = -165.0, r3 = 155.0, r4 = 156.0,
	&end

# 11 ASN PSI:  (11 ASN N)-(11 ASN CA)-(11 ASN C)-(12 ALA N) -95.0 135.0
 &rst     iat =   145,   147,   157,   159,
	  r1 = -96.0, r2 = -95.0, r3 = 135.0, r4 = 136.0,
	&end

# 11 ASN PSI:  (11 ASN N)-(11 ASN CA)-(11 ASN C)-(12 ALA N) -45.0 285.0
 &rst     iat =   145,   147,   157,   159,
	  r1 = -46.0, r2 = -45.0, r3 = 285.0, r4 = 286.0,
	&end

# 12 ALA PHI:  (11 ASN C)-(12 ALA N)-(12 ALA CA)-(12 ALA C)  25.0 335.0
 &rst     iat =   157,   159,   161,   167,
	  r1 =  24.0, r2 =  25.0, r3 = 335.0, r4 = 336.0,
	&end

# 12 ALA PHI:  (11 ASN C)-(12 ALA N)-(12 ALA CA)-(12 ALA C) -205.0  95.0
 &rst     iat =   157,   159,   161,   167,
	  r1 = -206.0, r2 = -205.0, r3 =  95.0, r4 =  96.0,
	&end

# 12 ALA PSI:  (12 ALA N)-(12 ALA CA)-(12 ALA C)-(13 THR N)   5.0 225.0
 &rst     iat =   159,   161,   167,   169,
	  r1 =   4.0, r2 =   5.0, r3 = 225.0, r4 = 226.0,
	&end

# 13 THR PHI:  (12 ALA C)-(13 THR N)-(13 THR CA)-(13 THR C)  45.0 305.0
 &rst     iat =   167,   169,   171,   181,
	  r1 =  44.0, r2 =  45.0, r3 = 305.0, r4 = 306.0,
	&end

# 13 THR PHI:  (12 ALA C)-(13 THR N)-(13 THR CA)-(13 THR C) -185.0  85.0
 &rst     iat =   167,   169,   171,   181,
	  r1 = -186.0, r2 = -185.0, r3 =  85.0, r4 =  86.0,
	&end

# 13 THR PHI:  (12 ALA C)-(13 THR N)-(13 THR CA)-(13 THR C) -85.0 215.0
 &rst     iat =   167,   169,   171,   181,
	  r1 = -86.0, r2 = -85.0, r3 = 215.0, r4 = 216.0,
	&end

# 13 THR CHI1:  (13 THR N)-(13 THR CA)-(13 THR CB)-(13 THR OG1)   5.0 355.0
 &rst     iat =   169,   171,   173,   179,
	  r1 =   4.0, r2 =   5.0, r3 = 355.0, r4 = 356.0,
	&end

# 13 THR CHI1:  (13 THR N)-(13 THR CA)-(13 THR CB)-(13 THR OG1) -235.0 105.0
 &rst     iat =   169,   171,   173,   179,
	  r1 = -236.0, r2 = -235.0, r3 = 105.0, r4 = 106.0,
	&end

# 13 THR CHI1:  (13 THR N)-(13 THR CA)-(13 THR CB)-(13 THR OG1) -135.0 185.0
 &rst     iat =   169,   171,   173,   179,
	  r1 = -136.0, r2 = -135.0, r3 = 185.0, r4 = 186.0,
	&end

# 13 THR CHI1:  (13 THR N)-(13 THR CA)-(13 THR CB)-(13 THR OG1) -35.0 235.0
 &rst     iat =   169,   171,   173,   179,
	  r1 = -36.0, r2 = -35.0, r3 = 235.0, r4 = 236.0,
	&end

# 13 THR CHI21:  (13 THR CA)-(13 THR CB)-(13 THR CG2)-(13 THR 1HG2)  15.0 345.0
 &rst     iat =   171,   173,   175,   176,
	  r1 =  14.0, r2 =  15.0, r3 = 345.0, r4 = 346.0,
	&end

# 13 THR CHI21:  (13 THR CA)-(13 THR CB)-(13 THR CG2)-(13 THR 1HG2) -105.0 225.0
 &rst     iat =   171,   173,   175,   176,
	  r1 = -106.0, r2 = -105.0, r3 = 225.0, r4 = 226.0,
	&end

# 13 THR PSI:  (13 THR N)-(13 THR CA)-(13 THR C)-(14 PRO N) 105.0 185.0
 &rst     iat =   169,   171,   181,   183,
	  r1 = 104.0, r2 = 105.0, r3 = 185.0, r4 = 186.0,
	&end

# 14 PRO PSI:  (14 PRO N)-(14 PRO CA)-(14 PRO C)-(15 GLU N) -315.0  15.0
 &rst     iat =   183,   193,   195,   197,
	  r1 = -316.0, r2 = -315.0, r3 =  15.0, r4 =  16.0,
	&end

# 14 PRO PSI:  (14 PRO N)-(14 PRO CA)-(14 PRO C)-(15 GLU N) -95.0 205.0
 &rst     iat =   183,   193,   195,   197,
	  r1 = -96.0, r2 = -95.0, r3 = 205.0, r4 = 206.0,
	&end

# 15 GLU PHI:  (14 PRO C)-(15 GLU N)-(15 GLU CA)-(15 GLU C)  25.0 325.0
 &rst     iat =   195,   197,   199,   210,
	  r1 =  24.0, r2 =  25.0, r3 = 325.0, r4 = 326.0,
	&end

# 15 GLU PHI:  (14 PRO C)-(15 GLU N)-(15 GLU CA)-(15 GLU C) -185.0  65.0
 &rst     iat =   195,   197,   199,   210,
	  r1 = -186.0, r2 = -185.0, r3 =  65.0, r4 =  66.0,
	&end

# 15 GLU CHI1:  (15 GLU N)-(15 GLU CA)-(15 GLU CB)-(15 GLU CG) -225.0 -85.0
 &rst     iat =   197,   199,   201,   204,
	  r1 = -226.0, r2 = -225.0, r3 = -85.0, r4 = -84.0,
	&end

# 15 GLU CHI2:  (15 GLU CA)-(15 GLU CB)-(15 GLU CG)-(15 GLU CD)  15.0 345.0
 &rst     iat =   199,   201,   204,   207,
	  r1 =  14.0, r2 =  15.0, r3 = 345.0, r4 = 346.0,
	&end

# 15 GLU PSI:  (15 GLU N)-(15 GLU CA)-(15 GLU C)-(16 GLN N) -115.0 105.0
 &rst     iat =   197,   199,   210,   212,
	  r1 = -116.0, r2 = -115.0, r3 = 105.0, r4 = 106.0,
	&end

# 15 GLU PSI:  (15 GLU N)-(15 GLU CA)-(15 GLU C)-(16 GLN N) -35.0 265.0
 &rst     iat =   197,   199,   210,   212,
	  r1 = -36.0, r2 = -35.0, r3 = 265.0, r4 = 266.0,
	&end

# 16 GLN PHI:  (15 GLU C)-(16 GLN N)-(16 GLN CA)-(16 GLN C) -175.0 -55.0
 &rst     iat =   210,   212,   214,   227,
	  r1 = -176.0, r2 = -175.0, r3 = -55.0, r4 = -54.0,
	&end

# 16 GLN CHI1:  (16 GLN N)-(16 GLN CA)-(16 GLN CB)-(16 GLN CG) -225.0 -95.0
 &rst     iat =   212,   214,   216,   219,
	  r1 = -226.0, r2 = -225.0, r3 = -95.0, r4 = -94.0,
	&end

# 16 GLN CHI2:  (16 GLN CA)-(16 GLN CB)-(16 GLN CG)-(16 GLN CD)  15.0 345.0
 &rst     iat =   214,   216,   219,   222,
	  r1 =  14.0, r2 =  15.0, r3 = 345.0, r4 = 346.0,
	&end

# 16 GLN PSI:  (16 GLN N)-(16 GLN CA)-(16 GLN C)-(17 MET N) -85.0  65.0
 &rst     iat =   212,   214,   227,   229,
	  r1 = -86.0, r2 = -85.0, r3 =  65.0, r4 =  66.0,
	&end

# 17 MET PHI:  (16 GLN C)-(17 MET N)-(17 MET CA)-(17 MET C) -85.0 -45.0
 &rst     iat =   227,   229,   231,   244,
	  r1 = -86.0, r2 = -85.0, r3 = -45.0, r4 = -44.0,
	&end

# 17 MET CHI1:  (17 MET N)-(17 MET CA)-(17 MET CB)-(17 MET CG) -205.0 -85.0
 &rst     iat =   229,   231,   233,   236,
	  r1 = -206.0, r2 = -205.0, r3 = -85.0, r4 = -84.0,
	&end

# 17 MET CHI2:  (17 MET CA)-(17 MET CB)-(17 MET CG)-(17 MET SD)  35.0 325.0
 &rst     iat =   231,   233,   236,   239,
	  r1 =  34.0, r2 =  35.0, r3 = 325.0, r4 = 326.0,
	&end

# 17 MET PSI:  (17 MET N)-(17 MET CA)-(17 MET C)-(18 ALA N) -95.0 -15.0
 &rst     iat =   229,   231,   244,   246,
	  r1 = -96.0, r2 = -95.0, r3 = -15.0, r4 = -14.0,
	&end

# 18 ALA PHI:  (17 MET C)-(18 ALA N)-(18 ALA CA)-(18 ALA C)  25.0 315.0
 &rst     iat =   244,   246,   248,   254,
	  r1 =  24.0, r2 =  25.0, r3 = 315.0, r4 = 316.0,
	&end

# 18 ALA PHI:  (17 MET C)-(18 ALA N)-(18 ALA CA)-(18 ALA C) -185.0  95.0
 &rst     iat =   244,   246,   248,   254,
	  r1 = -186.0, r2 = -185.0, r3 =  95.0, r4 =  96.0,
	&end

# 18 ALA PHI:  (17 MET C)-(18 ALA N)-(18 ALA CA)-(18 ALA C) -85.0 205.0
 &rst     iat =   244,   246,   248,   254,
	  r1 = -86.0, r2 = -85.0, r3 = 205.0, r4 = 206.0,
	&end

# 18 ALA PSI:  (18 ALA N)-(18 ALA CA)-(18 ALA C)-(19 ARG N) -125.0 125.0
 &rst     iat =   246,   248,   254,   256,
	  r1 = -126.0, r2 = -125.0, r3 = 125.0, r4 = 126.0,
	&end

# 18 ALA PSI:  (18 ALA N)-(18 ALA CA)-(18 ALA C)-(19 ARG N) -45.0 275.0
 &rst     iat =   246,   248,   254,   256,
	  r1 = -46.0, r2 = -45.0, r3 = 275.0, r4 = 276.0,
	&end

# 19 ARG PHI:  (18 ALA C)-(19 ARG N)-(19 ARG CA)-(19 ARG C) -95.0 -55.0
 &rst     iat =   254,   256,   258,   278,
	  r1 = -96.0, r2 = -95.0, r3 = -55.0, r4 = -54.0,
	&end

# 19 ARG CHI1:  (19 ARG N)-(19 ARG CA)-(19 ARG CB)-(19 ARG CG) -215.0 -95.0
 &rst     iat =   256,   258,   260,   263,
	  r1 = -216.0, r2 = -215.0, r3 = -95.0, r4 = -94.0,
	&end

# 19 ARG CHI1:  (19 ARG N)-(19 ARG CA)-(19 ARG CB)-(19 ARG CG) -165.0 175.0
 &rst     iat =   256,   258,   260,   263,
	  r1 = -166.0, r2 = -165.0, r3 = 175.0, r4 = 176.0,
	&end

# 19 ARG CHI2:  (19 ARG CA)-(19 ARG CB)-(19 ARG CG)-(19 ARG CD) -325.0 -15.0
 &rst     iat =   258,   260,   263,   266,
	  r1 = -326.0, r2 = -325.0, r3 = -15.0, r4 = -14.0,
	&end

# 19 ARG PSI:  (19 ARG N)-(19 ARG CA)-(19 ARG C)-(20 TYR N) -95.0 -15.0
 &rst     iat =   256,   258,   278,   280,
	  r1 = -96.0, r2 = -95.0, r3 = -15.0, r4 = -14.0,
	&end

# 20 TYR PHI:  (19 ARG C)-(20 TYR N)-(20 TYR CA)-(20 TYR C) -185.0 -35.0
 &rst     iat =   278,   280,   282,   299,
	  r1 = -186.0, r2 = -185.0, r3 = -35.0, r4 = -34.0,
	&end

# 20 TYR PHI:  (19 ARG C)-(20 TYR N)-(20 TYR CA)-(20 TYR C) -75.0 195.0
 &rst     iat =   278,   280,   282,   299,
	  r1 = -76.0, r2 = -75.0, r3 = 195.0, r4 = 196.0,
	&end

# 20 TYR CHI1:  (20 TYR N)-(20 TYR CA)-(20 TYR CB)-(20 TYR CG) -225.0 -35.0
 &rst     iat =   280,   282,   284,   287,
	  r1 = -226.0, r2 = -225.0, r3 = -35.0, r4 = -34.0,
	&end

# 20 TYR PSI:  (20 TYR N)-(20 TYR CA)-(20 TYR C)-(21 TYR N) -95.0  -5.0
 &rst     iat =   280,   282,   299,   301,
	  r1 = -96.0, r2 = -95.0, r3 =  -5.0, r4 =  -4.0,
	&end

# 21 TYR PHI:  (20 TYR C)-(21 TYR N)-(21 TYR CA)-(21 TYR C)  25.0 315.0
 &rst     iat =   299,   301,   303,   320,
	  r1 =  24.0, r2 =  25.0, r3 = 315.0, r4 = 316.0,
	&end

# 21 TYR PHI:  (20 TYR C)-(21 TYR N)-(21 TYR CA)-(21 TYR C) -295.0  55.0
 &rst     iat =   299,   301,   303,   320,
	  r1 = -296.0, r2 = -295.0, r3 =  55.0, r4 =  56.0,
	&end

# 21 TYR PHI:  (20 TYR C)-(21 TYR N)-(21 TYR CA)-(21 TYR C) -195.0  85.0
 &rst     iat =   299,   301,   303,   320,
	  r1 = -196.0, r2 = -195.0, r3 =  85.0, r4 =  86.0,
	&end

# 21 TYR PHI:  (20 TYR C)-(21 TYR N)-(21 TYR CA)-(21 TYR C) -85.0 205.0
 &rst     iat =   299,   301,   303,   320,
	  r1 = -86.0, r2 = -85.0, r3 = 205.0, r4 = 206.0,
	&end

# 21 TYR PSI:  (21 TYR N)-(21 TYR CA)-(21 TYR C)-(22 SER N) -95.0 115.0
 &rst     iat =   301,   303,   320,   322,
	  r1 = -96.0, r2 = -95.0, r3 = 115.0, r4 = 116.0,
	&end

# 22 SER PHI:  (21 TYR C)-(22 SER N)-(22 SER CA)-(22 SER C)  25.0 305.0
 &rst     iat =   320,   322,   324,   331,
	  r1 =  24.0, r2 =  25.0, r3 = 305.0, r4 = 306.0,
	&end

# 22 SER PHI:  (21 TYR C)-(22 SER N)-(22 SER CA)-(22 SER C) -185.0  95.0
 &rst     iat =   320,   322,   324,   331,
	  r1 = -186.0, r2 = -185.0, r3 =  95.0, r4 =  96.0,
	&end

# 22 SER PHI:  (21 TYR C)-(22 SER N)-(22 SER CA)-(22 SER C) -85.0 205.0
 &rst     iat =   320,   322,   324,   331,
	  r1 = -86.0, r2 = -85.0, r3 = 205.0, r4 = 206.0,
	&end

# 22 SER PSI:  (22 SER N)-(22 SER CA)-(22 SER C)-(23 ALA N) -115.0 125.0
 &rst     iat =   322,   324,   331,   333,
	  r1 = -116.0, r2 = -115.0, r3 = 125.0, r4 = 126.0,
	&end

# 23 ALA PHI:  (22 SER C)-(23 ALA N)-(23 ALA CA)-(23 ALA C)  25.0 315.0
 &rst     iat =   331,   333,   335,   341,
	  r1 =  24.0, r2 =  25.0, r3 = 315.0, r4 = 316.0,
	&end

# 23 ALA PHI:  (22 SER C)-(23 ALA N)-(23 ALA CA)-(23 ALA C) -285.0  45.0
 &rst     iat =   331,   333,   335,   341,
	  r1 = -286.0, r2 = -285.0, r3 =  45.0, r4 =  46.0,
	&end

# 23 ALA PHI:  (22 SER C)-(23 ALA N)-(23 ALA CA)-(23 ALA C) -195.0  95.0
 &rst     iat =   331,   333,   335,   341,
	  r1 = -196.0, r2 = -195.0, r3 =  95.0, r4 =  96.0,
	&end

# 23 ALA PHI:  (22 SER C)-(23 ALA N)-(23 ALA CA)-(23 ALA C) -75.0 205.0
 &rst     iat =   331,   333,   335,   341,
	  r1 = -76.0, r2 = -75.0, r3 = 205.0, r4 = 206.0,
	&end

# 23 ALA PSI:  (23 ALA N)-(23 ALA CA)-(23 ALA C)-(24 LEU N) -105.0 105.0
 &rst     iat =   333,   335,   341,   343,
	  r1 = -106.0, r2 = -105.0, r3 = 105.0, r4 = 106.0,
	&end

# 24 LEU PHI:  (23 ALA C)-(24 LEU N)-(24 LEU CA)-(24 LEU C)  25.0 305.0
 &rst     iat =   341,   343,   345,   360,
	  r1 =  24.0, r2 =  25.0, r3 = 305.0, r4 = 306.0,
	&end

# 24 LEU PHI:  (23 ALA C)-(24 LEU N)-(24 LEU CA)-(24 LEU C) -185.0  95.0
 &rst     iat =   341,   343,   345,   360,
	  r1 = -186.0, r2 = -185.0, r3 =  95.0, r4 =  96.0,
	&end

# 24 LEU PHI:  (23 ALA C)-(24 LEU N)-(24 LEU CA)-(24 LEU C) -85.0 215.0
 &rst     iat =   341,   343,   345,   360,
	  r1 = -86.0, r2 = -85.0, r3 = 215.0, r4 = 216.0,
	&end

# 24 LEU CHI1:  (24 LEU N)-(24 LEU CA)-(24 LEU CB)-(24 LEU CG) -285.0  55.0
 &rst     iat =   343,   345,   347,   350,
	  r1 = -286.0, r2 = -285.0, r3 =  55.0, r4 =  56.0,
	&end

# 24 LEU CHI1:  (24 LEU N)-(24 LEU CA)-(24 LEU CB)-(24 LEU CG) -165.0 165.0
 &rst     iat =   343,   345,   347,   350,
	  r1 = -166.0, r2 = -165.0, r3 = 165.0, r4 = 166.0,
	&end

# 24 LEU CHI2:  (24 LEU CA)-(24 LEU CB)-(24 LEU CG)-(24 LEU CD1) -55.0 285.0
 &rst     iat =   345,   347,   350,   352,
	  r1 = -56.0, r2 = -55.0, r3 = 285.0, r4 = 286.0,
	&end

# 25 ARG PHI:  (24 LEU C)-(25 ARG N)-(25 ARG CA)-(25 ARG C)  25.0 305.0
 &rst     iat =   360,   362,   364,   384,
	  r1 =  24.0, r2 =  25.0, r3 = 305.0, r4 = 306.0,
	&end

# 25 ARG PHI:  (24 LEU C)-(25 ARG N)-(25 ARG CA)-(25 ARG C) -85.0  45.0
 &rst     iat =   360,   362,   364,   384,
	  r1 = -86.0, r2 = -85.0, r3 =  45.0, r4 =  46.0,
	&end

# 25 ARG CHI1:  (25 ARG N)-(25 ARG CA)-(25 ARG CB)-(25 ARG CG) -215.0 -85.0
 &rst     iat =   362,   364,   366,   369,
	  r1 = -216.0, r2 = -215.0, r3 = -85.0, r4 = -84.0,
	&end

# 25 ARG CHI2:  (25 ARG CA)-(25 ARG CB)-(25 ARG CG)-(25 ARG CD)  15.0 345.0
 &rst     iat =   364,   366,   369,   372,
	  r1 =  14.0, r2 =  15.0, r3 = 345.0, r4 = 346.0,
	&end

# 25 ARG PSI:  (25 ARG N)-(25 ARG CA)-(25 ARG C)-(26 ARG N) -325.0  15.0
 &rst     iat =   362,   364,   384,   386,
	  r1 = -326.0, r2 = -325.0, r3 =  15.0, r4 =  16.0,
	&end

# 25 ARG PSI:  (25 ARG N)-(25 ARG CA)-(25 ARG C)-(26 ARG N) -105.0  75.0
 &rst     iat =   362,   364,   384,   386,
	  r1 = -106.0, r2 = -105.0, r3 =  75.0, r4 =  76.0,
	&end

# 26 ARG PHI:  (25 ARG C)-(26 ARG N)-(26 ARG CA)-(26 ARG C) -85.0 -45.0
 &rst     iat =   384,   386,   388,   408,
	  r1 = -86.0, r2 = -85.0, r3 = -45.0, r4 = -44.0,
	&end

# 26 ARG CHI1:  (26 ARG N)-(26 ARG CA)-(26 ARG CB)-(26 ARG CG) -215.0 -115.0
 &rst     iat =   386,   388,   390,   393,
	  r1 = -216.0, r2 = -215.0, r3 = -115.0, r4 = -114.0,
	&end

# 26 ARG CHI2:  (26 ARG CA)-(26 ARG CB)-(26 ARG CG)-(26 ARG CD)  15.0 345.0
 &rst     iat =   388,   390,   393,   396,
	  r1 =  14.0, r2 =  15.0, r3 = 345.0, r4 = 346.0,
	&end

# 26 ARG PSI:  (26 ARG N)-(26 ARG CA)-(26 ARG C)-(27 TYR N) -95.0  -5.0
 &rst     iat =   386,   388,   408,   410,
	  r1 = -96.0, r2 = -95.0, r3 =  -5.0, r4 =  -4.0,
	&end

# 27 TYR PHI:  (26 ARG C)-(27 TYR N)-(27 TYR CA)-(27 TYR C)  25.0 335.0
 &rst     iat =   408,   410,   412,   429,
	  r1 =  24.0, r2 =  25.0, r3 = 335.0, r4 = 336.0,
	&end

# 27 TYR PHI:  (26 ARG C)-(27 TYR N)-(27 TYR CA)-(27 TYR C) -205.0  85.0
 &rst     iat =   408,   410,   412,   429,
	  r1 = -206.0, r2 = -205.0, r3 =  85.0, r4 =  86.0,
	&end

# 27 TYR PSI:  (27 TYR N)-(27 TYR CA)-(27 TYR C)-(28 ILE N) -95.0 105.0
 &rst     iat =   410,   412,   429,   431,
	  r1 = -96.0, r2 = -95.0, r3 = 105.0, r4 = 106.0,
	&end

# 28 ILE PHI:  (27 TYR C)-(28 ILE N)-(28 ILE CA)-(28 ILE C) -165.0 -25.0
 &rst     iat =   429,   431,   433,   448,
	  r1 = -166.0, r2 = -165.0, r3 = -25.0, r4 = -24.0,
	&end

# 28 ILE CHI1:  (28 ILE N)-(28 ILE CA)-(28 ILE CB)-(28 ILE CG1) -145.0   5.0
 &rst     iat =   431,   433,   435,   441,
	  r1 = -146.0, r2 = -145.0, r3 =   5.0, r4 =   6.0,
	&end

# 28 ILE CHI21:  (28 ILE CA)-(28 ILE CB)-(28 ILE CG1)-(28 ILE CD1)  15.0 345.0
 &rst     iat =   433,   435,   441,   444,
	  r1 =  14.0, r2 =  15.0, r3 = 345.0, r4 = 346.0,
	&end

# 28 ILE PSI:  (28 ILE N)-(28 ILE CA)-(28 ILE C)-(29 ASN N) -115.0  -5.0
 &rst     iat =   431,   433,   448,   450,
	  r1 = -116.0, r2 = -115.0, r3 =  -5.0, r4 =  -4.0,
	&end

# 29 ASN PHI:  (28 ILE C)-(29 ASN N)-(29 ASN CA)-(29 ASN C) -185.0 -55.0
 &rst     iat =   448,   450,   452,   462,
	  r1 = -186.0, r2 = -185.0, r3 = -55.0, r4 = -54.0,
	&end

# 29 ASN PHI:  (28 ILE C)-(29 ASN N)-(29 ASN CA)-(29 ASN C) -85.0 205.0
 &rst     iat =   448,   450,   452,   462,
	  r1 = -86.0, r2 = -85.0, r3 = 205.0, r4 = 206.0,
	&end

# 29 ASN CHI1:  (29 ASN N)-(29 ASN CA)-(29 ASN CB)-(29 ASN CG) -335.0 -15.0
 &rst     iat =   450,   452,   454,   457,
	  r1 = -336.0, r2 = -335.0, r3 = -15.0, r4 = -14.0,
	&end

# 29 ASN CHI1:  (29 ASN N)-(29 ASN CA)-(29 ASN CB)-(29 ASN CG) -215.0  95.0
 &rst     iat =   450,   452,   454,   457,
	  r1 = -216.0, r2 = -215.0, r3 =  95.0, r4 =  96.0,
	&end

# 29 ASN CHI2:  (29 ASN CA)-(29 ASN CB)-(29 ASN CG)-(29 ASN OD1) -165.0 155.0
 &rst     iat =   452,   454,   457,   458,
	  r1 = -166.0, r2 = -165.0, r3 = 155.0, r4 = 156.0,
	&end

# 29 ASN PSI:  (29 ASN N)-(29 ASN CA)-(29 ASN C)-(30 MET N) -95.0  15.0
 &rst     iat =   450,   452,   462,   464,
	  r1 = -96.0, r2 = -95.0, r3 =  15.0, r4 =  16.0,
	&end

# 30 MET PHI:  (29 ASN C)-(30 MET N)-(30 MET CA)-(30 MET C) -195.0 -25.0
 &rst     iat =   462,   464,   466,   479,
	  r1 = -196.0, r2 = -195.0, r3 = -25.0, r4 = -24.0,
	&end

# 30 MET CHI1:  (30 MET N)-(30 MET CA)-(30 MET CB)-(30 MET CG) -215.0  95.0
 &rst     iat =   464,   466,   468,   471,
	  r1 = -216.0, r2 = -215.0, r3 =  95.0, r4 =  96.0,
	&end

# 30 MET CHI2:  (30 MET CA)-(30 MET CB)-(30 MET CG)-(30 MET SD)  35.0 325.0
 &rst     iat =   466,   468,   471,   474,
	  r1 =  34.0, r2 =  35.0, r3 = 325.0, r4 = 326.0,
	&end

# 30 MET PSI:  (30 MET N)-(30 MET CA)-(30 MET C)-(31 LEU N) -105.0  25.0
 &rst     iat =   464,   466,   479,   481,
	  r1 = -106.0, r2 = -105.0, r3 =  25.0, r4 =  26.0,
	&end

# 31 LEU PHI:  (30 MET C)-(31 LEU N)-(31 LEU CA)-(31 LEU C) -85.0 -45.0
 &rst     iat =   479,   481,   483,   498,
	  r1 = -86.0, r2 = -85.0, r3 = -45.0, r4 = -44.0,
	&end

# 31 LEU CHI1:  (31 LEU N)-(31 LEU CA)-(31 LEU CB)-(31 LEU CG) -225.0 -65.0
 &rst     iat =   481,   483,   485,   488,
	  r1 = -226.0, r2 = -225.0, r3 = -65.0, r4 = -64.0,
	&end

# 31 LEU CHI1:  (31 LEU N)-(31 LEU CA)-(31 LEU CB)-(31 LEU CG) -135.0 155.0
 &rst     iat =   481,   483,   485,   488,
	  r1 = -136.0, r2 = -135.0, r3 = 155.0, r4 = 156.0,
	&end

# 31 LEU CHI2:  (31 LEU CA)-(31 LEU CB)-(31 LEU CG)-(31 LEU CD1)  35.0 305.0
 &rst     iat =   483,   485,   488,   490,
	  r1 =  34.0, r2 =  35.0, r3 = 305.0, r4 = 306.0,
	&end

# 31 LEU PSI:  (31 LEU N)-(31 LEU CA)-(31 LEU C)-(32 THR N) -115.0 -15.0
 &rst     iat =   481,   483,   498,   500,
	  r1 = -116.0, r2 = -115.0, r3 = -15.0, r4 = -14.0,
	&end

# 32 THR PHI:  (31 LEU C)-(32 THR N)-(32 THR CA)-(32 THR C)  25.0 325.0
 &rst     iat =   498,   500,   502,   512,
	  r1 =  24.0, r2 =  25.0, r3 = 325.0, r4 = 326.0,
	&end

# 32 THR PHI:  (31 LEU C)-(32 THR N)-(32 THR CA)-(32 THR C) -195.0  95.0
 &rst     iat =   498,   500,   502,   512,
	  r1 = -196.0, r2 = -195.0, r3 =  95.0, r4 =  96.0,
	&end

# 32 THR CHI1:  (32 THR N)-(32 THR CA)-(32 THR CB)-(32 THR OG1)   5.0 355.0
 &rst     iat =   500,   502,   504,   510,
	  r1 =   4.0, r2 =   5.0, r3 = 355.0, r4 = 356.0,
	&end

# 32 THR CHI1:  (32 THR N)-(32 THR CA)-(32 THR CB)-(32 THR OG1) -225.0  95.0
 &rst     iat =   500,   502,   504,   510,
	  r1 = -226.0, r2 = -225.0, r3 =  95.0, r4 =  96.0,
	&end

# 32 THR CHI21:  (32 THR CA)-(32 THR CB)-(32 THR CG2)-(32 THR 1HG2)  15.0 345.0
 &rst     iat =   502,   504,   506,   507,
	  r1 =  14.0, r2 =  15.0, r3 = 345.0, r4 = 346.0,
	&end

# 32 THR CHI21:  (32 THR CA)-(32 THR CB)-(32 THR CG2)-(32 THR 1HG2) -105.0 225.0
 &rst     iat =   502,   504,   506,   507,
	  r1 = -106.0, r2 = -105.0, r3 = 225.0, r4 = 226.0,
	&end

# 32 THR PSI:  (32 THR N)-(32 THR CA)-(32 THR C)-(33 ARG N) -115.0 105.0
 &rst     iat =   500,   502,   512,   514,
	  r1 = -116.0, r2 = -115.0, r3 = 105.0, r4 = 106.0,
	&end

# 32 THR PSI:  (32 THR N)-(32 THR CA)-(32 THR C)-(33 ARG N) -35.0 275.0
 &rst     iat =   500,   502,   512,   514,
	  r1 = -36.0, r2 = -35.0, r3 = 275.0, r4 = 276.0,
	&end

# 33 ARG PHI:  (32 THR C)-(33 ARG N)-(33 ARG CA)-(33 ARG C)  25.0 305.0
 &rst     iat =   512,   514,   516,   536,
	  r1 =  24.0, r2 =  25.0, r3 = 305.0, r4 = 306.0,
	&end

# 33 ARG PHI:  (32 THR C)-(33 ARG N)-(33 ARG CA)-(33 ARG C) -185.0  75.0
 &rst     iat =   512,   514,   516,   536,
	  r1 = -186.0, r2 = -185.0, r3 =  75.0, r4 =  76.0,
	&end

# 33 ARG PHI:  (32 THR C)-(33 ARG N)-(33 ARG CA)-(33 ARG C) -95.0 215.0
 &rst     iat =   512,   514,   516,   536,
	  r1 = -96.0, r2 = -95.0, r3 = 215.0, r4 = 216.0,
	&end

# 33 ARG CHI1:  (33 ARG N)-(33 ARG CA)-(33 ARG CB)-(33 ARG CG) -335.0 -15.0
 &rst     iat =   514,   516,   518,   521,
	  r1 = -336.0, r2 = -335.0, r3 = -15.0, r4 = -14.0,
	&end

# 33 ARG CHI1:  (33 ARG N)-(33 ARG CA)-(33 ARG CB)-(33 ARG CG) -215.0 105.0
 &rst     iat =   514,   516,   518,   521,
	  r1 = -216.0, r2 = -215.0, r3 = 105.0, r4 = 106.0,
	&end

# 33 ARG CHI2:  (33 ARG CA)-(33 ARG CB)-(33 ARG CG)-(33 ARG CD)  15.0 345.0
 &rst     iat =   516,   518,   521,   524,
	  r1 =  14.0, r2 =  15.0, r3 = 345.0, r4 = 346.0,
	&end

# 33 ARG PSI:  (33 ARG N)-(33 ARG CA)-(33 ARG C)-(34 PRO N) -305.0 -45.0
 &rst     iat =   514,   516,   536,   538,
	  r1 = -306.0, r2 = -305.0, r3 = -45.0, r4 = -44.0,
	&end

# 33 ARG PSI:  (33 ARG N)-(33 ARG CA)-(33 ARG C)-(34 PRO N) -55.0 175.0
 &rst     iat =   514,   516,   536,   538,
	  r1 = -56.0, r2 = -55.0, r3 = 175.0, r4 = 176.0,
	&end

# 34 PRO PSI:  (34 PRO N)-(34 PRO CA)-(34 PRO C)-(35 ARG N) -315.0  15.0
 &rst     iat =   538,   548,   550,   552,
	  r1 = -316.0, r2 = -315.0, r3 =  15.0, r4 =  16.0,
	&end

# 34 PRO PSI:  (34 PRO N)-(34 PRO CA)-(34 PRO C)-(35 ARG N)  -5.0 205.0
 &rst     iat =   538,   548,   550,   552,
	  r1 =  -6.0, r2 =  -5.0, r3 = 205.0, r4 = 206.0,
	&end

# 35 ARG PHI:  (34 PRO C)-(35 ARG N)-(35 ARG CA)-(35 ARG C)  25.0 335.0
 &rst     iat =   550,   552,   554,   574,
	  r1 =  24.0, r2 =  25.0, r3 = 335.0, r4 = 336.0,
	&end

# 35 ARG PHI:  (34 PRO C)-(35 ARG N)-(35 ARG CA)-(35 ARG C) -215.0  95.0
 &rst     iat =   550,   552,   554,   574,
	  r1 = -216.0, r2 = -215.0, r3 =  95.0, r4 =  96.0,
	&end

# 35 ARG CHI1:  (35 ARG N)-(35 ARG CA)-(35 ARG CB)-(35 ARG CG) -215.0 105.0
 &rst     iat =   552,   554,   556,   559,
	  r1 = -216.0, r2 = -215.0, r3 = 105.0, r4 = 106.0,
	&end

# 35 ARG CHI2:  (35 ARG CA)-(35 ARG CB)-(35 ARG CG)-(35 ARG CD)  15.0 345.0
 &rst     iat =   554,   556,   559,   562,
	  r1 =  14.0, r2 =  15.0, r3 = 345.0, r4 = 346.0,
	&end

# 35 ARG PSI:  (35 ARG N)-(35 ARG CA)-(35 ARG C)-(36 TYR N) -105.0 105.0
 &rst     iat =   552,   554,   574,   576,
	  r1 = -106.0, r2 = -105.0, r3 = 105.0, r4 = 106.0,
	&end

# 36 TYR PHI:  (35 ARG C)-(36 TYR N)-(36 TYR CA)-(36 TYR C)  25.0 335.0
 &rst     iat =   574,   576,   578,   595,
	  r1 =  24.0, r2 =  25.0, r3 = 335.0, r4 = 336.0,
	&end

# 36 TYR PHI:  (35 ARG C)-(36 TYR N)-(36 TYR CA)-(36 TYR C) -205.0  85.0
 &rst     iat =   574,   576,   578,   595,
	  r1 = -206.0, r2 = -205.0, r3 =  85.0, r4 =  86.0,
	&end

# 36 TYR PSI:  (36 TYR N)-(36 TYR CA)-(36 TYR C)-(37 NHE N) -95.0 225.0
 &rst     iat =   576,   578,   595,   597,
	  r1 = -96.0, r2 = -95.0, r3 = 225.0, r4 = 226.0,
	&end

  Entry H atom name         Submitted Coord H atom name
  Start of MODEL    1
    1   1H    ALA   1          1H        ALA   1 -19.866  13.368  -4.708
    2   2H    ALA   1          2H        ALA   1 -20.569  12.288  -3.695
    3   3H    ALA   1          3H        ALA   1 -21.439  12.928  -4.951
    4    HA   ALA   1           HA       ALA   1 -20.576  14.217  -2.465
    5   1HB   ALA   1          1HB       ALA   1 -21.402  15.609  -5.043
    6   2HB   ALA   1          2HB       ALA   1 -21.211  16.397  -3.462
    7   3HB   ALA   1          3HB       ALA   1 -19.806  15.672  -4.259
    8    HA   PRO   2           HA       PRO   2 -25.014  12.772  -2.803
    9   1HB   PRO   2          1HB       PRO   2 -25.147  11.190  -0.537
   10   2HB   PRO   2          2HB       PRO   2 -24.645  10.620  -2.142
   11   1HG   PRO   2          1HG       PRO   2 -22.944  11.242   0.243
   12   2HG   PRO   2          2HG       PRO   2 -22.681  10.048  -1.058
   13   1HD   PRO   2          1HD       PRO   2 -21.477  12.598  -0.847
   14   2HD   PRO   2          2HD       PRO   2 -21.507  11.555  -2.300
   15    H    LEU   3           H        LEU   3 -23.566  13.318   0.422
   16    HA   LEU   3           HA       LEU   3 -24.702  15.878   0.827
   17   1HB   LEU   3          1HB       LEU   3 -26.187  15.417   2.684
   18   2HB   LEU   3          2HB       LEU   3 -26.814  14.819   1.181
   19    HG   LEU   3           HG       LEU   3 -25.359  12.685   2.650
   20   1HD1  LEU   3          1HD1      LEU   3 -25.991  13.669   4.670
   21   2HD1  LEU   3          2HD1      LEU   3 -27.565  14.222   4.048
   22   3HD1  LEU   3          3HD1      LEU   3 -27.284  12.498   4.358
   23   1HD2  LEU   3          1HD2      LEU   3 -27.573  11.521   2.334
   24   2HD2  LEU   3          2HD2      LEU   3 -28.103  12.950   1.426
   25   3HD2  LEU   3          3HD2      LEU   3 -26.707  12.007   0.875
   26    H    GLU   4           H        GLU   4 -22.563  16.413   1.366
   27    HA   GLU   4           HA       GLU   4 -21.691  15.397   4.029
   28   1HB   GLU   4          1HB       GLU   4 -20.423  14.457   2.001
   29   2HB   GLU   4          2HB       GLU   4 -19.662  16.040   1.882
   30   1HG   GLU   4          1HG       GLU   4 -18.641  15.801   4.042
   31   2HG   GLU   4          2HG       GLU   4 -19.758  14.527   4.527
   32    HA   PRO   5           HA       PRO   5 -22.132  19.980   4.170
   33   1HB   PRO   5          1HB       PRO   5 -23.577  20.107   6.504
   34   2HB   PRO   5          2HB       PRO   5 -24.331  19.897   4.901
   35   1HG   PRO   5          1HG       PRO   5 -23.864  17.855   7.053
   36   2HG   PRO   5          2HG       PRO   5 -25.181  17.953   5.847
   37   1HD   PRO   5          1HD       PRO   5 -22.874  16.321   5.703
   38   2HD   PRO   5          2HD       PRO   5 -23.996  16.677   4.357
   39    H    VAL   6           H        VAL   6 -21.007  21.353   5.526
   40    HA   VAL   6           HA       VAL   6 -19.320  22.083   6.864
   41    HB   VAL   6           HB       VAL   6 -19.973  19.652   8.590
   42   1HG1  VAL   6          1HG1      VAL   6 -17.710  20.306   9.134
   43   2HG1  VAL   6          2HG1      VAL   6 -18.215  22.005   9.322
   44   3HG1  VAL   6          3HG1      VAL   6 -18.816  20.739  10.415
   45   1HG2  VAL   6          1HG2      VAL   6 -21.148  21.228  10.010
   46   2HG2  VAL   6          2HG2      VAL   6 -20.655  22.594   8.981
   47   3HG2  VAL   6          3HG2      VAL   6 -21.797  21.372   8.381
   48    H    TYR   7           H        TYR   7 -17.029  21.826   7.132
   49    HA   TYR   7           HA       TYR   7 -14.960  21.126   6.540
   50   1HB   TYR   7          1HB       TYR   7 -15.988  19.263   8.101
   51   2HB   TYR   7          2HB       TYR   7 -15.850  18.252   6.699
   52    HD1  TYR   7           1HD      TYR   7 -14.103  20.239   9.250
   53    HD2  TYR   7           2HD      TYR   7 -13.587  17.651   5.834
   54    HE1  TYR   7           1HE      TYR   7 -11.703  19.940   9.848
   55    HE2  TYR   7           2HE      TYR   7 -11.189  17.343   6.437
   56    HH   TYR   7           HH       TYR   7  -9.460  18.461   7.656
   57    HA   PRO   8           HA       PRO   8 -16.158  20.442   2.134
   58   1HB   PRO   8          1HB       PRO   8 -14.609  22.443   0.995
   59   2HB   PRO   8          2HB       PRO   8 -16.255  22.665   1.642
   60   1HG   PRO   8          1HG       PRO   8 -13.633  23.405   2.885
   61   2HG   PRO   8          2HG       PRO   8 -15.217  24.213   3.025
   62   1HD   PRO   8          1HD       PRO   8 -14.051  22.468   4.908
   63   2HD   PRO   8          2HD       PRO   8 -15.771  22.934   4.863
   64    H    GLY   9           H        GLY   9 -14.732  20.125   0.126
   65   1HA   GLY   9          1HA       GLY   9 -12.218  18.662   0.847
   66   2HA   GLY   9          2HA       GLY   9 -13.472  17.955  -0.175
   67    H    ASP  10           H        ASP  10 -11.498  20.916   0.094
   68    HA   ASP  10           HA       ASP  10 -10.927  20.856  -2.824
   69   1HB   ASP  10          1HB       ASP  10 -11.295  23.340  -1.102
   70   2HB   ASP  10          2HB       ASP  10 -10.812  23.305  -2.788
   71    H    ASN  11           H        ASN  11  -8.838  21.722  -3.342
   72    HA   ASN  11           HA       ASN  11  -6.603  21.954  -3.194
   73   1HB   ASN  11          1HB       ASN  11  -7.457  23.653  -1.323
   74   2HB   ASN  11          2HB       ASN  11  -6.622  22.544  -0.251
   75   1HD2  ASN  11          1HD2      ASN  11  -6.245  24.931  -2.829
   76   2HD2  ASN  11          2HD2      ASN  11  -4.487  25.040  -2.612
   77    H    ALA  12           H        ALA  12  -5.752  20.032  -3.630
   78    HA   ALA  12           HA       ALA  12  -5.622  17.835  -1.705
   79   1HB   ALA  12          1HB       ALA  12  -4.684  18.293  -4.557
   80   2HB   ALA  12          2HB       ALA  12  -4.088  16.909  -3.627
   81   3HB   ALA  12          3HB       ALA  12  -5.821  17.087  -3.908
   82    H    THR  13           H        THR  13  -3.254  16.800  -1.625
   83    HA   THR  13           HA       THR  13  -1.204  18.773  -0.910
   84    HB   THR  13           HB       THR  13  -2.084  18.904   1.193
   85    HG1  THR  13           1HG      THR  13  -1.145  16.443   1.894
   86   1HG2  THR  13          1HG2      THR  13  -3.145  16.830   2.385
   87   2HG2  THR  13          2HG2      THR  13  -4.090  17.700   1.167
   88   3HG2  THR  13          3HG2      THR  13  -3.296  16.190   0.728
   89    HA   PRO  14           HA       PRO  14   1.292  15.408  -2.345
   90   1HB   PRO  14          1HB       PRO  14   3.729  16.000  -1.162
   91   2HB   PRO  14          2HB       PRO  14   3.069  16.782  -2.626
   92   1HG   PRO  14          1HG       PRO  14   3.176  17.833   0.177
   93   2HG   PRO  14          2HG       PRO  14   3.236  18.724  -1.372
   94   1HD   PRO  14          1HD       PRO  14   1.002  18.455   0.301
   95   2HD   PRO  14          2HD       PRO  14   0.950  18.953  -1.413
   96    H    GLU  15           H        GLU  15   1.249  16.121   1.127
   97    HA   GLU  15           HA       GLU  15   2.303  13.607   2.008
   98   1HB   GLU  15          1HB       GLU  15   1.242  16.091   3.232
   99   2HB   GLU  15          2HB       GLU  15   0.601  14.692   4.038
  100   1HG   GLU  15          1HG       GLU  15   2.460  14.942   5.288
  101   2HG   GLU  15          2HG       GLU  15   3.140  13.867   4.072
  102    H    GLN  16           H        GLN  16  -0.742  14.432   0.766
  103    HA   GLN  16           HA       GLN  16  -1.994  11.972   1.906
  104   1HB   GLN  16          1HB       GLN  16  -3.095  14.380   1.970
  105   2HB   GLN  16          2HB       GLN  16  -3.514  14.003   0.286
  106   1HG   GLN  16          1HG       GLN  16  -5.390  13.401   1.609
  107   2HG   GLN  16          2HG       GLN  16  -4.599  11.867   1.210
  108   1HE2  GLN  16          1HE2      GLN  16  -5.810  13.796   3.845
  109   2HE2  GLN  16          2HE2      GLN  16  -4.903  12.881   5.082
  110    H    MET  17           H        MET  17  -0.860  13.523  -1.064
  111    HA   MET  17           HA       MET  17  -2.025  11.611  -2.909
  112   1HB   MET  17          1HB       MET  17  -0.237  13.966  -2.975
  113   2HB   MET  17          2HB       MET  17   0.278  12.725  -4.075
  114   1HG   MET  17          1HG       MET  17  -2.656  13.290  -4.080
  115   2HG   MET  17          2HG       MET  17  -1.641  14.619  -4.602
  116   1HE   MET  17          1HE       MET  17   0.509  13.988  -6.529
  117   2HE   MET  17          2HE       MET  17  -0.441  13.815  -8.024
  118    H    ALA  18           H        ALA  18   1.194  11.904  -1.274
  119    HA   ALA  18           HA       ALA  18   2.197   9.494  -2.476
  120   1HB   ALA  18          1HB       ALA  18   3.053  10.552   0.237
  121   2HB   ALA  18          2HB       ALA  18   4.032   9.770  -1.013
  122   3HB   ALA  18          3HB       ALA  18   3.457  11.429  -1.250
  123    H    ARG  19           H        ARG  19   0.045  10.079   0.169
  124    HA   ARG  19           HA       ARG  19   0.284   7.399   1.328
  125   1HB   ARG  19          1HB       ARG  19  -0.866   9.930   2.134
  126   2HB   ARG  19          2HB       ARG  19  -2.138   8.730   2.168
  127   1HG   ARG  19          1HG       ARG  19   0.576   8.451   3.535
  128   2HG   ARG  19          2HG       ARG  19  -0.928   8.937   4.314
  129   1HD   ARG  19          1HD       ARG  19  -1.895   6.679   3.452
  130   2HD   ARG  19          2HD       ARG  19  -0.205   6.229   3.150
  131    HE   ARG  19           HE       ARG  19  -0.702   7.278   5.820
  132   1HH1  ARG  19          2HH2      ARG  19  -0.753   4.326   3.970
  133   2HH1  ARG  19          1HH2      ARG  19  -0.695   3.289   5.371
  134   1HH2  ARG  19          2HH1      ARG  19  -0.536   5.961   7.611
  135   2HH2  ARG  19          1HH1      ARG  19  -0.447   4.244   7.429
  136    H    TYR  20           H        TYR  20  -2.173   9.085  -0.690
  137    HA   TYR  20           HA       TYR  20  -4.068   7.060  -0.980
  138   1HB   TYR  20          1HB       TYR  20  -3.118   9.455  -2.498
  139   2HB   TYR  20          2HB       TYR  20  -3.926   8.258  -3.451
  140    HD1  TYR  20           1HD      TYR  20  -6.070   8.990  -3.965
  141    HD2  TYR  20           2HD      TYR  20  -4.585   9.574   0.041
  142    HE1  TYR  20           1HE      TYR  20  -8.291   9.840  -3.275
  143    HE2  TYR  20           2HE      TYR  20  -6.819  10.436   0.727
  144    HH   TYR  20           HH       TYR  20  -9.537  10.723  -1.533
  145    H    TYR  21           H        TYR  21  -1.131   7.594  -2.989
  146    HA   TYR  21           HA       TYR  21  -1.451   5.186  -4.523
  147   1HB   TYR  21          1HB       TYR  21   0.813   7.130  -3.991
  148   2HB   TYR  21          2HB       TYR  21   1.103   5.658  -4.905
  149    HD1  TYR  21           1HD      TYR  21  -0.753   5.141  -6.770
  150    HD2  TYR  21           2HD      TYR  21   0.349   9.055  -5.337
  151    HE1  TYR  21           1HE      TYR  21  -1.536   6.121  -8.902
  152    HE2  TYR  21           2HE      TYR  21  -0.399  10.045  -7.500
  153    HH   TYR  21           HH       TYR  21  -1.716   7.989 -10.114
  154    H    SER  22           H        SER  22   0.461   5.852  -1.582
  155    HA   SER  22           HA       SER  22   1.753   3.296  -1.431
  156   1HB   SER  22          1HB       SER  22   2.473   5.306  -0.173
  157   2HB   SER  22          2HB       SER  22   0.972   5.266   0.770
  158    HG   SER  22           HG       SER  22   3.179   3.548   0.816
  159    H    ALA  23           H        ALA  23  -1.356   4.468  -0.078
  160    HA   ALA  23           HA       ALA  23  -2.122   2.039   1.201
  161   1HB   ALA  23          1HB       ALA  23  -3.237   4.148   1.700
  162   2HB   ALA  23          2HB       ALA  23  -3.740   4.338   0.005
  163   3HB   ALA  23          3HB       ALA  23  -4.426   3.033   0.996
  164    H    LEU  24           H        LEU  24  -2.650   3.193  -2.222
  165    HA   LEU  24           HA       LEU  24  -4.172   0.953  -3.063
  166   1HB   LEU  24          1HB       LEU  24  -4.154   2.765  -4.532
  167   2HB   LEU  24          2HB       LEU  24  -2.449   3.055  -4.319
  168    HG   LEU  24           HG       LEU  24  -1.988   0.950  -5.634
  169   1HD1  LEU  24          1HD1      LEU  24  -4.961   1.256  -6.239
  170   2HD1  LEU  24          2HD1      LEU  24  -3.853   0.315  -7.236
  171   3HD1  LEU  24          3HD1      LEU  24  -4.151  -0.162  -5.549
  172   1HD2  LEU  24          1HD2      LEU  24  -3.369   2.687  -7.581
  173   2HD2  LEU  24          2HD2      LEU  24  -2.256   3.515  -6.491
  174   3HD2  LEU  24          3HD2      LEU  24  -1.672   2.163  -7.465
  175    H    ARG  25           H        ARG  25  -0.603   1.364  -2.970
  176    HA   ARG  25           HA       ARG  25   0.055  -1.202  -4.052
  177   1HB   ARG  25          1HB       ARG  25   1.669   0.719  -3.551
  178   2HB   ARG  25          2HB       ARG  25   1.555   0.295  -1.856
  179   1HG   ARG  25          1HG       ARG  25   3.433  -0.857  -2.343
  180   2HG   ARG  25          2HG       ARG  25   2.285  -2.137  -2.666
  181   1HD   ARG  25          1HD       ARG  25   2.732  -2.165  -4.905
  182   2HD   ARG  25          2HD       ARG  25   2.817  -0.414  -5.038
  183    HE   ARG  25           HE       ARG  25   5.030  -2.241  -4.643
  184   1HH1  ARG  25          2HH2      ARG  25   4.028   1.046  -4.063
  185   2HH1  ARG  25          1HH2      ARG  25   5.660   1.667  -3.940
  186   1HH2  ARG  25          2HH1      ARG  25   7.123  -1.427  -4.406
  187   2HH2  ARG  25          1HH1      ARG  25   7.424   0.262  -4.141
  188    H    ARG  26           H        ARG  26  -0.301  -0.290  -0.599
  189    HA   ARG  26           HA       ARG  26   0.067  -2.977   0.375
  190   1HB   ARG  26          1HB       ARG  26   0.329  -0.847   1.671
  191   2HB   ARG  26          2HB       ARG  26  -1.423  -0.686   1.738
  192   1HG   ARG  26          1HG       ARG  26  -1.669  -2.301   3.326
  193   2HG   ARG  26          2HG       ARG  26  -0.481  -3.376   2.597
  194   1HD   ARG  26          1HD       ARG  26   0.753  -0.970   3.801
  195   2HD   ARG  26          2HD       ARG  26  -0.170  -1.934   4.958
  196    HE   ARG  26           HE       ARG  26   1.292  -3.837   3.648
  197   1HH1  ARG  26          2HH2      ARG  26   2.279  -0.929   5.301
  198   2HH1  ARG  26          1HH2      ARG  26   3.794  -1.592   5.842
  199   1HH2  ARG  26          2HH1      ARG  26   3.225  -4.705   4.411
  200   2HH2  ARG  26          1HH1      ARG  26   4.289  -3.727   5.370
  201    H    TYR  27           H        TYR  27  -2.851  -1.154  -0.451
  202    HA   TYR  27           HA       TYR  27  -4.826  -3.001   0.354
  203   1HB   TYR  27          1HB       TYR  27  -5.259  -0.667  -0.277
  204   2HB   TYR  27          2HB       TYR  27  -4.770  -1.000  -1.938
  205    HD1  TYR  27           1HD      TYR  27  -6.585  -0.983  -3.399
  206    HD2  TYR  27           2HD      TYR  27  -7.082  -2.635   0.559
  207    HE1  TYR  27           1HE      TYR  27  -8.959  -1.540  -3.923
  208    HE2  TYR  27           2HE      TYR  27  -9.443  -3.199   0.022
  209    HH   TYR  27           HH       TYR  27 -10.692  -3.317  -3.037
  210    H    ILE  28           H        ILE  28  -3.283  -2.642  -2.913
  211    HA   ILE  28           HA       ILE  28  -4.469  -4.936  -4.106
  212    HB   ILE  28           HB       ILE  28  -1.814  -3.539  -4.558
  213   2HG1  ILE  28          2HG1      ILE  28  -4.106  -2.512  -5.197
  214   1HG2  ILE  28          1HG2      ILE  28  -1.825  -4.986  -6.754
  215   2HG2  ILE  28          2HG2      ILE  28  -1.256  -5.726  -5.265
  216   3HG2  ILE  28          3HG2      ILE  28  -2.897  -6.063  -5.866
  217   1HD1  ILE  28          1HD1      ILE  28  -2.099  -1.613  -6.208
  218   2HD1  ILE  28          2HD1      ILE  28  -2.015  -2.948  -7.376
  219   3HD1  ILE  28          3HD1      ILE  28  -3.348  -1.815  -7.464
  220    H    ASN  29           H        ASN  29  -1.402  -4.706  -2.223
  221    HA   ASN  29           HA       ASN  29  -0.781  -7.455  -2.337
  222   1HB   ASN  29          1HB       ASN  29   0.481  -5.299  -1.351
  223   2HB   ASN  29          2HB       ASN  29  -0.177  -5.890   0.168
  224   1HD2  ASN  29          1HD2      ASN  29   1.254  -7.276   1.241
  225   2HD2  ASN  29          2HD2      ASN  29   2.474  -8.194   0.351
  226    H    MET  30           H        MET  30  -2.747  -5.745   0.117
  227    HA   MET  30           HA       MET  30  -3.450  -7.990   1.722
  228   1HB   MET  30          1HB       MET  30  -3.738  -5.578   2.334
  229   2HB   MET  30          2HB       MET  30  -5.037  -5.456   1.145
  230   1HG   MET  30          1HG       MET  30  -6.165  -7.392   2.492
  231   2HG   MET  30          2HG       MET  30  -4.981  -6.996   3.742
  232   1HE   MET  30          1HE       MET  30  -6.967  -7.032   5.058
  233   2HE   MET  30          2HE       MET  30  -7.341  -5.433   5.734
  234    H    LEU  31           H        LEU  31  -5.125  -6.602  -1.187
  235    HA   LEU  31           HA       LEU  31  -7.287  -8.466  -1.226
  236   1HB   LEU  31          1HB       LEU  31  -5.894  -6.632  -3.199
  237   2HB   LEU  31          2HB       LEU  31  -7.163  -7.699  -3.738
  238    HG   LEU  31           HG       LEU  31  -7.558  -5.654  -1.501
  239   1HD1  LEU  31          1HD1      LEU  31  -7.215  -4.236  -3.244
  240   2HD1  LEU  31          2HD1      LEU  31  -7.609  -5.424  -4.495
  241   3HD1  LEU  31          3HD1      LEU  31  -8.904  -4.624  -3.609
  242   1HD2  LEU  31          1HD2      LEU  31  -9.221  -7.353  -1.331
  243   2HD2  LEU  31          2HD2      LEU  31  -9.990  -6.012  -2.175
  244   3HD2  LEU  31          3HD2      LEU  31  -9.440  -7.437  -3.096
  245    H    THR  32           H        THR  32  -3.976  -8.746  -2.270
  246    HA   THR  32           HA       THR  32  -4.488 -11.457  -3.415
  247    HB   THR  32           HB       THR  32  -1.924  -9.840  -3.601
  248    HG1  THR  32           1HG      THR  32  -4.267  -9.873  -5.142
  249   1HG2  THR  32          1HG2      THR  32  -1.577 -11.180  -5.658
  250   2HG2  THR  32          2HG2      THR  32  -1.726 -12.266  -4.274
  251   3HG2  THR  32          3HG2      THR  32  -3.100 -12.049  -5.378
  252    H    ARG  33           H        ARG  33  -4.674 -10.913  -0.557
  253    HA   ARG  33           HA       ARG  33  -2.444 -11.896   0.841
  254   1HB   ARG  33          1HB       ARG  33  -5.347 -11.530   1.406
  255   2HB   ARG  33          2HB       ARG  33  -4.704 -12.945   2.189
  256   1HG   ARG  33          1HG       ARG  33  -2.710 -11.271   2.887
  257   2HG   ARG  33          2HG       ARG  33  -3.964 -10.059   2.636
  258   1HD   ARG  33          1HD       ARG  33  -5.421 -11.228   4.252
  259   2HD   ARG  33          2HD       ARG  33  -4.233 -12.544   4.380
  260    HE   ARG  33           HE       ARG  33  -3.079  -9.974   5.020
  261   1HH1  ARG  33          2HH2      ARG  33  -4.968 -12.558   6.435
  262   2HH1  ARG  33          1HH2      ARG  33  -4.461 -12.217   8.058
  263   1HH2  ARG  33          2HH1      ARG  33  -2.450  -9.537   7.117
  264   2HH2  ARG  33          1HH1      ARG  33  -3.085 -10.506   8.425
  265    HA   PRO  34           HA       PRO  34  -2.164 -16.193   0.021
  266   1HB   PRO  34          1HB       PRO  34  -1.450 -17.297   2.454
  267   2HB   PRO  34          2HB       PRO  34  -0.364 -16.349   1.400
  268   1HG   PRO  34          1HG       PRO  34  -1.744 -15.500   3.921
  269   2HG   PRO  34          2HG       PRO  34  -0.180 -14.957   3.242
  270   1HD   PRO  34          1HD       PRO  34  -2.652 -13.631   3.080
  271   2HD   PRO  34          2HD       PRO  34  -1.198 -13.247   2.106
  272    H    ARG  35           H        ARG  35  -4.243 -16.667  -0.584
  273    HA   ARG  35           HA       ARG  35  -5.843 -18.222   1.410
  274   1HB   ARG  35          1HB       ARG  35  -6.681 -15.827   1.003
  275   2HB   ARG  35          2HB       ARG  35  -7.120 -16.352  -0.617
  276   1HG   ARG  35          1HG       ARG  35  -8.112 -18.341   1.254
  277   2HG   ARG  35          2HG       ARG  35  -8.486 -16.749   1.920
  278   1HD   ARG  35          1HD       ARG  35  -9.479 -16.173  -0.373
  279   2HD   ARG  35          2HD       ARG  35  -9.282 -17.892  -0.778
  280    HE   ARG  35           HE       ARG  35 -10.676 -17.419   1.748
  281   1HH1  ARG  35          2HH2      ARG  35 -11.199 -17.746  -1.669
  282   2HH1  ARG  35          1HH2      ARG  35 -12.919 -18.037  -1.512
  283   1HH2  ARG  35          2HH1      ARG  35 -12.864 -17.829   1.950
  284   2HH2  ARG  35          1HH1      ARG  35 -13.813 -18.168   0.533
  285    H    TYR  36           H        TYR  36  -4.376 -19.760   0.150
  286    HA   TYR  36           HA       TYR  36  -5.219 -20.532  -2.518
  287   1HB   TYR  36          1HB       TYR  36  -3.533 -22.117  -2.440
  288   2HB   TYR  36          2HB       TYR  36  -2.892 -20.796  -1.490
  289    HD1  TYR  36           1HD      TYR  36  -3.800 -24.293  -1.561
  290    HD2  TYR  36           2HD      TYR  36  -2.898 -21.014   1.090
  291    HE1  TYR  36           1HE      TYR  36  -3.492 -25.897   0.331
  292    HE2  TYR  36           2HE      TYR  36  -2.647 -22.600   2.978
  293    HH   TYR  36           HH       TYR  36  -3.229 -24.816   3.646
  294   1HN   NH2  37          1HN       NH2  37  -6.697 -22.212  -3.146
  295   2HN   NH2  37          2HN       NH2  37  -7.617 -23.042  -1.885
  Start of MODEL    2
    1   1H    ALA   1          1H        ALA   1   3.352  24.775  17.695
    2   2H    ALA   1          2H        ALA   1   4.314  24.214  18.912
    3   3H    ALA   1          3H        ALA   1   4.800  25.489  18.003
    4    HA   ALA   1           HA       ALA   1   5.378  24.269  16.226
    5   1HB   ALA   1          1HB       ALA   1   6.086  21.855  17.419
    6   2HB   ALA   1          2HB       ALA   1   7.076  23.316  17.322
    7   3HB   ALA   1          3HB       ALA   1   6.101  22.999  18.772
    8    HA   PRO   2           HA       PRO   2   2.606  20.531  15.613
    9   1HB   PRO   2          1HB       PRO   2   0.773  19.719  17.521
   10   2HB   PRO   2          2HB       PRO   2   2.458  19.125  17.414
   11   1HG   PRO   2          1HG       PRO   2   1.277  21.110  19.327
   12   2HG   PRO   2          2HG       PRO   2   2.624  19.958  19.573
   13   1HD   PRO   2          1HD       PRO   2   2.835  22.706  19.016
   14   2HD   PRO   2          2HD       PRO   2   4.156  21.511  18.898
   15    H    LEU   3           H        LEU   3   1.004  23.039  17.583
   16    HA   LEU   3           HA       LEU   3  -1.503  23.051  16.252
   17   1HB   LEU   3          1HB       LEU   3  -0.911  24.096  18.457
   18   2HB   LEU   3          2HB       LEU   3  -0.092  25.397  17.603
   19    HG   LEU   3           HG       LEU   3  -3.017  24.710  17.058
   20   1HD1  LEU   3          1HD1      LEU   3  -1.925  26.524  19.244
   21   2HD1  LEU   3          2HD1      LEU   3  -3.623  26.442  18.736
   22   3HD1  LEU   3          3HD1      LEU   3  -2.855  25.023  19.447
   23   1HD2  LEU   3          1HD2      LEU   3  -2.352  26.258  15.428
   24   2HD2  LEU   3          2HD2      LEU   3  -3.012  27.309  16.683
   25   3HD2  LEU   3          3HD2      LEU   3  -1.253  27.119  16.527
   26    H    GLU   4           H        GLU   4  -1.796  23.323  14.153
   27    HA   GLU   4           HA       GLU   4  -0.145  25.293  12.687
   28   1HB   GLU   4          1HB       GLU   4  -1.015  22.533  11.984
   29   2HB   GLU   4          2HB       GLU   4  -1.315  23.722  10.723
   30   1HG   GLU   4          1HG       GLU   4   1.174  24.500  11.237
   31   2HG   GLU   4          2HG       GLU   4   1.333  22.904  11.955
   32    HA   PRO   5           HA       PRO   5  -3.798  27.606  11.885
   33   1HB   PRO   5          1HB       PRO   5  -3.062  29.047   9.649
   34   2HB   PRO   5          2HB       PRO   5  -2.392  29.295  11.274
   35   1HG   PRO   5          1HG       PRO   5  -1.162  27.856   8.932
   36   2HG   PRO   5          2HG       PRO   5  -0.386  28.868  10.192
   37   1HD   PRO   5          1HD       PRO   5  -0.494  26.057  10.150
   38   2HD   PRO   5          2HD       PRO   5  -0.102  27.074  11.567
   39    H    VAL   6           H        VAL   6  -4.371  25.129  11.323
   40    HA   VAL   6           HA       VAL   6  -5.781  23.688  10.238
   41    HB   VAL   6           HB       VAL   6  -6.622  26.179   8.719
   42   1HG1  VAL   6          1HG1      VAL   6  -8.014  23.490   8.623
   43   2HG1  VAL   6          2HG1      VAL   6  -8.616  25.042   7.993
   44   3HG1  VAL   6          3HG1      VAL   6  -7.199  24.313   7.268
   45   1HG2  VAL   6          1HG2      VAL   6  -7.080  25.678  11.331
   46   2HG2  VAL   6          2HG2      VAL   6  -8.256  26.456  10.277
   47   3HG2  VAL   6          3HG2      VAL   6  -8.396  24.724  10.647
   48    H    TYR   7           H        TYR   7  -5.942  22.327   8.307
   49    HA   TYR   7           HA       TYR   7  -3.777  22.839   6.328
   50   1HB   TYR   7          1HB       TYR   7  -3.358  21.168   8.375
   51   2HB   TYR   7          2HB       TYR   7  -4.125  20.036   7.288
   52    HD1  TYR   7           1HD      TYR   7  -1.553  22.805   7.260
   53    HD2  TYR   7           2HD      TYR   7  -2.626  18.854   5.875
   54    HE1  TYR   7           1HE      TYR   7   0.674  22.571   6.245
   55    HE2  TYR   7           2HE      TYR   7  -0.340  18.605   4.881
   56    HH   TYR   7           HH       TYR   7   2.144  21.060   5.352
   57    HA   PRO   8           HA       PRO   8  -7.670  21.842   4.107
   58   1HB   PRO   8          1HB       PRO   8  -7.356  23.673   2.060
   59   2HB   PRO   8          2HB       PRO   8  -8.127  24.026   3.629
   60   1HG   PRO   8          1HG       PRO   8  -5.405  24.793   2.667
   61   2HG   PRO   8          2HG       PRO   8  -6.480  25.639   3.811
   62   1HD   PRO   8          1HD       PRO   8  -4.267  23.988   4.456
   63   2HD   PRO   8          2HD       PRO   8  -5.510  24.566   5.595
   64    H    GLY   9           H        GLY   9  -4.370  21.618   3.464
   65   1HA   GLY   9          1HA       GLY   9  -3.477  19.682   2.421
   66   2HA   GLY   9          2HA       GLY   9  -4.778  19.692   1.230
   67    H    ASP  10           H        ASP  10  -4.696  22.418   0.488
   68    HA   ASP  10           HA       ASP  10  -3.695  23.868  -0.953
   69   1HB   ASP  10          1HB       ASP  10  -1.963  24.023   0.891
   70   2HB   ASP  10          2HB       ASP  10  -0.970  22.896  -0.031
   71    H    ASN  11           H        ASN  11  -4.544  22.875  -2.759
   72    HA   ASN  11           HA       ASN  11  -4.689  21.637  -4.685
   73   1HB   ASN  11          1HB       ASN  11  -1.763  22.419  -4.809
   74   2HB   ASN  11          2HB       ASN  11  -2.740  21.903  -6.182
   75   1HD2  ASN  11          1HD2      ASN  11  -1.491  24.598  -4.782
   76   2HD2  ASN  11          2HD2      ASN  11  -2.717  25.736  -5.317
   77    H    ALA  12           H        ALA  12  -4.751  19.817  -2.854
   78    HA   ALA  12           HA       ALA  12  -4.460  17.661  -2.275
   79   1HB   ALA  12          1HB       ALA  12  -4.607  17.507  -4.929
   80   2HB   ALA  12          2HB       ALA  12  -2.954  16.924  -4.752
   81   3HB   ALA  12          3HB       ALA  12  -4.280  16.091  -3.914
   82    H    THR  13           H        THR  13  -3.169  18.088  -0.486
   83    HA   THR  13           HA       THR  13  -0.544  18.807  -0.405
   84    HB   THR  13           HB       THR  13  -1.665  18.793   1.667
   85    HG1  THR  13           1HG      THR  13  -0.202  17.930   2.919
   86   1HG2  THR  13          1HG2      THR  13  -1.736  15.835   1.782
   87   2HG2  THR  13          2HG2      THR  13  -2.550  16.976   2.847
   88   3HG2  THR  13          3HG2      THR  13  -3.148  16.735   1.194
   89    HA   PRO  14           HA       PRO  14   1.747  15.393  -2.009
   90   1HB   PRO  14          1HB       PRO  14   4.275  15.958  -1.007
   91   2HB   PRO  14          2HB       PRO  14   3.519  16.741  -2.423
   92   1HG   PRO  14          1HG       PRO  14   3.854  17.817   0.344
   93   2HG   PRO  14          2HG       PRO  14   3.805  18.693  -1.212
   94   1HD   PRO  14          1HD       PRO  14   1.714  18.445   0.628
   95   2HD   PRO  14          2HD       PRO  14   1.518  18.971  -1.054
   96    H    GLU  15           H        GLU  15   1.233  15.939   1.360
   97    HA   GLU  15           HA       GLU  15   2.435  13.376   2.183
   98   1HB   GLU  15          1HB       GLU  15   1.831  15.874   3.496
   99   2HB   GLU  15          2HB       GLU  15   0.778  14.668   4.214
  100   1HG   GLU  15          1HG       GLU  15   2.924  13.216   4.462
  101   2HG   GLU  15          2HG       GLU  15   3.811  14.688   4.064
  102    H    GLN  16           H        GLN  16  -0.549  14.369   0.941
  103    HA   GLN  16           HA       GLN  16  -1.977  11.985   2.059
  104   1HB   GLN  16          1HB       GLN  16  -3.068  14.222   2.242
  105   2HB   GLN  16          2HB       GLN  16  -3.070  14.345   0.474
  106   1HG   GLN  16          1HG       GLN  16  -5.236  13.719   1.074
  107   2HG   GLN  16          2HG       GLN  16  -4.516  12.212   0.514
  108   1HE2  GLN  16          1HE2      GLN  16  -6.258  13.681   3.073
  109   2HE2  GLN  16          2HE2      GLN  16  -5.820  12.487   4.311
  110    H    MET  17           H        MET  17  -0.817  13.503  -0.951
  111    HA   MET  17           HA       MET  17  -2.014  11.589  -2.752
  112   1HB   MET  17          1HB       MET  17  -0.233  13.934  -2.861
  113   2HB   MET  17          2HB       MET  17   0.279  12.688  -3.974
  114   1HG   MET  17          1HG       MET  17  -2.653  13.382  -3.923
  115   2HG   MET  17          2HG       MET  17  -1.533  14.566  -4.564
  116   1HE   MET  17          1HE       MET  17  -3.558  11.587  -4.999
  117   2HE   MET  17          2HE       MET  17  -3.403  11.203  -6.724
  118    H    ALA  18           H        ALA  18   1.251  11.805  -1.168
  119    HA   ALA  18           HA       ALA  18   2.218   9.414  -2.427
  120   1HB   ALA  18          1HB       ALA  18   4.115   9.931  -1.316
  121   2HB   ALA  18          2HB       ALA  18   3.306  11.380  -0.748
  122   3HB   ALA  18          3HB       ALA  18   3.308   9.930   0.263
  123    H    ARG  19           H        ARG  19   0.000   9.966   0.128
  124    HA   ARG  19           HA       ARG  19   0.221   7.284   1.296
  125   1HB   ARG  19          1HB       ARG  19  -0.682   9.699   2.289
  126   2HB   ARG  19          2HB       ARG  19  -2.206   8.925   1.908
  127   1HG   ARG  19          1HG       ARG  19  -2.081   7.627   3.737
  128   2HG   ARG  19          2HG       ARG  19  -0.522   6.955   3.252
  129   1HD   ARG  19          1HD       ARG  19   0.697   8.774   4.255
  130   2HD   ARG  19          2HD       ARG  19  -0.797   9.697   4.504
  131    HE   ARG  19           HE       ARG  19  -0.742   7.114   5.877
  132   1HH1  ARG  19          2HH2      ARG  19  -0.034  10.535   6.166
  133   2HH1  ARG  19          1HH2      ARG  19  -0.098  10.532   7.907
  134   1HH2  ARG  19          2HH1      ARG  19  -0.804   7.146   8.163
  135   2HH2  ARG  19          1HH1      ARG  19  -0.540   8.652   8.993
  136    H    TYR  20           H        TYR  20  -2.213   9.025  -0.711
  137    HA   TYR  20           HA       TYR  20  -4.092   7.004  -1.088
  138   1HB   TYR  20          1HB       TYR  20  -3.119   9.421  -2.543
  139   2HB   TYR  20          2HB       TYR  20  -3.851   8.231  -3.569
  140    HD1  TYR  20           1HD      TYR  20  -4.495  10.961  -1.387
  141    HD2  TYR  20           2HD      TYR  20  -6.190   7.316  -2.938
  142    HE1  TYR  20           1HE      TYR  20  -6.789  11.816  -0.880
  143    HE2  TYR  20           2HE      TYR  20  -8.477   8.159  -2.432
  144    HH   TYR  20           HH       TYR  20  -9.686  10.038  -1.893
  145    H    TYR  21           H        TYR  21  -1.102   7.551  -2.970
  146    HA   TYR  21           HA       TYR  21  -1.360   5.211  -4.612
  147   1HB   TYR  21          1HB       TYR  21   0.018   7.288  -5.024
  148   2HB   TYR  21          2HB       TYR  21   1.169   6.725  -3.823
  149    HD1  TYR  21           1HD      TYR  21   2.081   4.205  -4.253
  150    HD2  TYR  21           2HD      TYR  21   0.402   6.807  -7.260
  151    HE1  TYR  21           1HE      TYR  21   3.132   2.824  -6.037
  152    HE2  TYR  21           2HE      TYR  21   1.509   5.467  -9.031
  153    HH   TYR  21           HH       TYR  21   2.880   3.756  -9.453
  154    H    SER  22           H        SER  22   0.495   5.796  -1.573
  155    HA   SER  22           HA       SER  22   1.716   3.192  -1.493
  156   1HB   SER  22          1HB       SER  22   1.228   5.351   0.564
  157   2HB   SER  22          2HB       SER  22   1.940   3.790   1.020
  158    HG   SER  22           HG       SER  22   3.063   5.869  -0.291
  159    H    ALA  23           H        ALA  23  -1.353   4.424  -0.173
  160    HA   ALA  23           HA       ALA  23  -2.157   2.044   1.176
  161   1HB   ALA  23          1HB       ALA  23  -3.145   4.349   1.492
  162   2HB   ALA  23          2HB       ALA  23  -3.908   4.188  -0.108
  163   3HB   ALA  23          3HB       ALA  23  -4.341   3.073   1.205
  164    H    LEU  24           H        LEU  24  -2.640   3.193  -2.258
  165    HA   LEU  24           HA       LEU  24  -4.209   0.988  -3.112
  166   1HB   LEU  24          1HB       LEU  24  -4.146   2.809  -4.569
  167   2HB   LEU  24          2HB       LEU  24  -2.439   3.069  -4.363
  168    HG   LEU  24           HG       LEU  24  -2.028   0.921  -5.675
  169   1HD1  LEU  24          1HD1      LEU  24  -3.904   0.389  -7.293
  170   2HD1  LEU  24          2HD1      LEU  24  -4.280  -0.045  -5.609
  171   3HD1  LEU  24          3HD1      LEU  24  -4.980   1.417  -6.336
  172   1HD2  LEU  24          1HD2      LEU  24  -1.636   3.174  -6.573
  173   2HD2  LEU  24          2HD2      LEU  24  -2.169   2.019  -7.801
  174   3HD2  LEU  24          3HD2      LEU  24  -3.315   3.219  -7.165
  175    H    ARG  25           H        ARG  25  -0.633   1.380  -3.029
  176    HA   ARG  25           HA       ARG  25  -0.024  -1.202  -4.067
  177   1HB   ARG  25          1HB       ARG  25   1.590   0.785  -3.570
  178   2HB   ARG  25          2HB       ARG  25   1.630   0.186  -1.916
  179   1HG   ARG  25          1HG       ARG  25   3.519  -0.761  -2.965
  180   2HG   ARG  25          2HG       ARG  25   2.363  -2.087  -2.872
  181   1HD   ARG  25          1HD       ARG  25   2.243  -2.294  -5.119
  182   2HD   ARG  25          2HD       ARG  25   2.053  -0.554  -5.372
  183    HE   ARG  25           HE       ARG  25   4.725  -0.846  -4.696
  184   1HH1  ARG  25          2HH2      ARG  25   2.750  -2.200  -7.225
  185   2HH1  ARG  25          1HH2      ARG  25   4.084  -2.355  -8.337
  186   1HH2  ARG  25          2HH1      ARG  25   6.411  -1.071  -6.122
  187   2HH2  ARG  25          1HH1      ARG  25   6.125  -1.661  -7.735
  188    H    ARG  26           H        ARG  26  -0.331  -0.224  -0.648
  189    HA   ARG  26           HA       ARG  26   0.025  -2.863   0.411
  190   1HB   ARG  26          1HB       ARG  26   0.063  -0.450   1.541
  191   2HB   ARG  26          2HB       ARG  26  -1.636  -0.809   1.888
  192   1HG   ARG  26          1HG       ARG  26  -0.947  -2.904   3.057
  193   2HG   ARG  26          2HG       ARG  26   0.735  -2.614   2.567
  194   1HD   ARG  26          1HD       ARG  26   0.826  -1.801   4.703
  195   2HD   ARG  26          2HD       ARG  26   0.448  -0.322   3.813
  196    HE   ARG  26           HE       ARG  26  -1.866  -1.834   4.824
  197   1HH1  ARG  26          2HH2      ARG  26   0.358   0.763   5.568
  198   2HH1  ARG  26          1HH2      ARG  26  -0.749   1.532   6.682
  199   1HH2  ARG  26          2HH1      ARG  26  -3.176  -0.906   6.420
  200   2HH2  ARG  26          1HH1      ARG  26  -2.678   0.582   7.164
  201    H    TYR  27           H        TYR  27  -2.939  -1.101  -0.469
  202    HA   TYR  27           HA       TYR  27  -4.860  -2.975   0.395
  203   1HB   TYR  27          1HB       TYR  27  -5.332  -0.639  -0.246
  204   2HB   TYR  27          2HB       TYR  27  -4.889  -0.994  -1.913
  205    HD1  TYR  27           1HD      TYR  27  -7.123  -2.573   0.689
  206    HD2  TYR  27           2HD      TYR  27  -6.745  -1.028  -3.324
  207    HE1  TYR  27           1HE      TYR  27  -9.516  -3.085   0.259
  208    HE2  TYR  27           2HE      TYR  27  -9.134  -1.515  -3.740
  209    HH   TYR  27           HH       TYR  27 -11.149  -2.084  -2.707
  210    H    ILE  28           H        ILE  28  -3.352  -2.603  -2.884
  211    HA   ILE  28           HA       ILE  28  -4.526  -4.922  -4.046
  212    HB   ILE  28           HB       ILE  28  -1.856  -3.571  -4.551
  213   2HG1  ILE  28          2HG1      ILE  28  -4.108  -2.362  -5.047
  214   1HG2  ILE  28          1HG2      ILE  28  -1.777  -5.986  -5.301
  215   2HG2  ILE  28          2HG2      ILE  28  -3.243  -5.704  -6.259
  216   3HG2  ILE  28          3HG2      ILE  28  -1.718  -4.879  -6.649
  217   1HD1  ILE  28          1HD1      ILE  28  -2.092  -2.872  -7.287
  218   2HD1  ILE  28          2HD1      ILE  28  -3.439  -1.753  -7.415
  219   3HD1  ILE  28          3HD1      ILE  28  -2.183  -1.498  -6.174
  220    H    ASN  29           H        ASN  29  -1.412  -4.612  -2.243
  221    HA   ASN  29           HA       ASN  29  -0.740  -7.345  -2.369
  222   1HB   ASN  29          1HB       ASN  29   0.431  -5.092  -1.321
  223   2HB   ASN  29          2HB       ASN  29  -0.046  -5.912   0.158
  224   1HD2  ASN  29          1HD2      ASN  29   1.924  -6.722   0.898
  225   2HD2  ASN  29          2HD2      ASN  29   2.983  -7.689  -0.137
  226    H    MET  30           H        MET  30  -2.766  -5.646   0.021
  227    HA   MET  30           HA       MET  30  -3.351  -7.905   1.680
  228   1HB   MET  30          1HB       MET  30  -3.638  -5.331   2.124
  229   2HB   MET  30          2HB       MET  30  -5.203  -5.544   1.335
  230   1HG   MET  30          1HG       MET  30  -5.098  -7.661   3.165
  231   2HG   MET  30          2HG       MET  30  -4.241  -6.378   4.006
  232   1HE   MET  30          1HE       MET  30  -7.072  -3.546   3.929
  233   2HE   MET  30          2HE       MET  30  -5.480  -3.921   4.605
  234    H    LEU  31           H        LEU  31  -4.942  -6.669  -1.304
  235    HA   LEU  31           HA       LEU  31  -7.170  -8.501  -1.192
  236   1HB   LEU  31          1HB       LEU  31  -5.834  -6.749  -3.280
  237   2HB   LEU  31          2HB       LEU  31  -7.119  -7.835  -3.723
  238    HG   LEU  31           HG       LEU  31  -7.429  -5.713  -1.555
  239   1HD1  LEU  31          1HD1      LEU  31  -6.889  -4.690  -3.746
  240   2HD1  LEU  31          2HD1      LEU  31  -8.241  -5.583  -4.492
  241   3HD1  LEU  31          3HD1      LEU  31  -8.549  -4.367  -3.243
  242   1HD2  LEU  31          1HD2      LEU  31  -9.137  -7.338  -1.274
  243   2HD2  LEU  31          2HD2      LEU  31  -9.900  -6.059  -2.231
  244   3HD2  LEU  31          3HD2      LEU  31  -9.351  -7.556  -3.027
  245    H    THR  32           H        THR  32  -3.863  -8.736  -2.323
  246    HA   THR  32           HA       THR  32  -4.324 -11.428  -3.481
  247    HB   THR  32           HB       THR  32  -1.960 -11.298  -4.148
  248    HG1  THR  32           1HG      THR  32  -1.511  -9.717  -2.295
  249   1HG2  THR  32          1HG2      THR  32  -4.074  -9.474  -5.065
  250   2HG2  THR  32          2HG2      THR  32  -2.468  -8.797  -5.331
  251   3HG2  THR  32          3HG2      THR  32  -2.871 -10.393  -5.990
  252    H    ARG  33           H        ARG  33  -3.550 -10.232  -0.428
  253    HA   ARG  33           HA       ARG  33  -1.934 -12.286   0.686
  254   1HB   ARG  33          1HB       ARG  33  -3.674 -10.128   1.687
  255   2HB   ARG  33          2HB       ARG  33  -3.831 -11.559   2.658
  256   1HG   ARG  33          1HG       ARG  33  -1.041 -11.235   2.370
  257   2HG   ARG  33          2HG       ARG  33  -1.665  -9.596   2.487
  258   1HD   ARG  33          1HD       ARG  33  -1.759  -9.835   4.708
  259   2HD   ARG  33          2HD       ARG  33  -3.068 -11.002   4.517
  260    HE   ARG  33           HE       ARG  33  -0.768 -12.483   4.085
  261   1HH1  ARG  33          2HH2      ARG  33  -1.847 -10.503   6.747
  262   2HH1  ARG  33          1HH2      ARG  33  -0.982 -11.406   7.953
  263   1HH2  ARG  33          2HH1      ARG  33   0.429 -13.585   5.604
  264   2HH2  ARG  33          1HH1      ARG  33   0.274 -13.186   7.287
  265    HA   PRO  34           HA       PRO  34  -5.707 -14.920   1.717
  266   1HB   PRO  34          1HB       PRO  34  -8.247 -14.340   0.793
  267   2HB   PRO  34          2HB       PRO  34  -7.550 -13.721   2.309
  268   1HG   PRO  34          1HG       PRO  34  -7.885 -12.295  -0.316
  269   2HG   PRO  34          2HG       PRO  34  -7.993 -11.654   1.353
  270   1HD   PRO  34          1HD       PRO  34  -5.783 -11.447  -0.350
  271   2HD   PRO  34          2HD       PRO  34  -5.759 -11.236   1.423
  272    H    ARG  35           H        ARG  35  -4.217 -15.896   0.158
  273    HA   ARG  35           HA       ARG  35  -5.592 -17.413  -1.884
  274   1HB   ARG  35          1HB       ARG  35  -4.305 -14.911  -2.668
  275   2HB   ARG  35          2HB       ARG  35  -3.496 -16.249  -3.461
  276   1HG   ARG  35          1HG       ARG  35  -6.532 -16.117  -3.446
  277   2HG   ARG  35          2HG       ARG  35  -5.603 -15.135  -4.563
  278   1HD   ARG  35          1HD       ARG  35  -4.676 -17.939  -4.526
  279   2HD   ARG  35          2HD       ARG  35  -6.400 -17.808  -4.884
  280    HE   ARG  35           HE       ARG  35  -4.694 -15.955  -6.380
  281   1HH1  ARG  35          2HH2      ARG  35  -6.035 -19.206  -6.468
  282   2HH1  ARG  35          1HH2      ARG  35  -6.144 -19.204  -8.209
  283   1HH2  ARG  35          2HH1      ARG  35  -4.847 -16.026  -8.618
  284   2HH2  ARG  35          1HH1      ARG  35  -5.359 -17.482  -9.398
  285    H    TYR  36           H        TYR  36  -4.914 -19.027  -0.628
  286    HA   TYR  36           HA       TYR  36  -2.058 -19.880  -0.908
  287   1HB   TYR  36          1HB       TYR  36  -3.752 -19.647   1.497
  288   2HB   TYR  36          2HB       TYR  36  -3.111 -21.259   1.309
  289    HD1  TYR  36           1HD      TYR  36  -0.450 -21.098   0.346
  290    HD2  TYR  36           2HD      TYR  36  -2.482 -18.444   3.078
  291    HE1  TYR  36           1HE      TYR  36   1.735 -20.445   1.350
  292    HE2  TYR  36           2HE      TYR  36  -0.304 -17.846   4.119
  293    HH   TYR  36           HH       TYR  36   2.089 -18.938   4.303
  294   1HN   NH2  37          1HN       NH2  37  -5.364 -21.399  -0.270
  295   2HN   NH2  37          2HN       NH2  37  -4.977 -22.715  -1.362
  Start of MODEL    3
    1   1H    ALA   1          1H        ALA   1 -22.976  29.736  11.822
    2   2H    ALA   1          2H        ALA   1 -23.690  31.184  12.111
    3   3H    ALA   1          3H        ALA   1 -24.318  29.817  12.776
    4    HA   ALA   1           HA       ALA   1 -25.217  29.068  10.849
    5   1HB   ALA   1          1HB       ALA   1 -26.751  30.711  10.954
    6   2HB   ALA   1          2HB       ALA   1 -25.532  31.988  11.219
    7   3HB   ALA   1          3HB       ALA   1 -25.897  31.417   9.575
    8    HA   PRO   2           HA       PRO   2 -22.598  30.247   7.119
    9   1HB   PRO   2          1HB       PRO   2 -20.630  32.139   7.212
   10   2HB   PRO   2          2HB       PRO   2 -22.343  32.528   6.862
   11   1HG   PRO   2          1HG       PRO   2 -20.807  32.968   9.398
   12   2HG   PRO   2          2HG       PRO   2 -22.155  33.915   8.704
   13   1HD   PRO   2          1HD       PRO   2 -22.281  31.927  10.734
   14   2HD   PRO   2          2HD       PRO   2 -23.674  32.701   9.908
   15    H    LEU   3           H        LEU   3 -22.245  28.208   8.358
   16    HA   LEU   3           HA       LEU   3 -19.856  27.560   9.760
   17   1HB   LEU   3          1HB       LEU   3 -21.602  25.988   7.816
   18   2HB   LEU   3          2HB       LEU   3 -20.122  25.313   8.441
   19    HG   LEU   3           HG       LEU   3 -21.452  26.335  10.737
   20   1HD1  LEU   3          1HD1      LEU   3 -23.630  25.592  10.760
   21   2HD1  LEU   3          2HD1      LEU   3 -23.521  26.221   9.109
   22   3HD1  LEU   3          3HD1      LEU   3 -23.399  24.474   9.400
   23   1HD2  LEU   3          1HD2      LEU   3 -21.114  23.500   9.682
   24   2HD2  LEU   3          2HD2      LEU   3 -20.022  24.382  10.759
   25   3HD2  LEU   3          3HD2      LEU   3 -21.635  23.905  11.329
   26    H    GLU   4           H        GLU   4 -17.856  26.781   9.090
   27    HA   GLU   4           HA       GLU   4 -16.464  28.361   7.359
   28   1HB   GLU   4          1HB       GLU   4 -14.687  26.663   7.446
   29   2HB   GLU   4          2HB       GLU   4 -15.422  26.926   9.026
   30   1HG   GLU   4          1HG       GLU   4 -16.708  24.829   8.803
   31   2HG   GLU   4          2HG       GLU   4 -16.096  24.598   7.158
   32    HA   PRO   5           HA       PRO   5 -17.435  27.039   3.282
   33   1HB   PRO   5          1HB       PRO   5 -15.100  27.622   1.868
   34   2HB   PRO   5          2HB       PRO   5 -16.326  28.809   2.378
   35   1HG   PRO   5          1HG       PRO   5 -13.634  28.270   3.560
   36   2HG   PRO   5          2HG       PRO   5 -14.598  29.780   3.548
   37   1HD   PRO   5          1HD       PRO   5 -14.330  27.936   5.680
   38   2HD   PRO   5          2HD       PRO   5 -15.521  29.269   5.579
   39    H    VAL   6           H        VAL   6 -15.603  25.263   5.196
   40    HA   VAL   6           HA       VAL   6 -14.523  23.264   5.271
   41    HB   VAL   6           HB       VAL   6 -16.428  22.634   2.977
   42   1HG1  VAL   6          1HG1      VAL   6 -14.927  20.851   4.927
   43   2HG1  VAL   6          2HG1      VAL   6 -16.422  20.325   4.124
   44   3HG1  VAL   6          3HG1      VAL   6 -15.018  20.731   3.151
   45   1HG2  VAL   6          1HG2      VAL   6 -17.605  23.598   4.939
   46   2HG2  VAL   6          2HG2      VAL   6 -17.981  21.901   4.744
   47   3HG2  VAL   6          3HG2      VAL   6 -16.822  22.411   6.001
   48    H    TYR   7           H        TYR   7 -13.606  25.379   3.303
   49    HA   TYR   7           HA       TYR   7 -11.416  23.933   1.953
   50   1HB   TYR   7          1HB       TYR   7 -13.646  25.478   0.601
   51   2HB   TYR   7          2HB       TYR   7 -12.068  25.322  -0.145
   52    HD1  TYR   7           1HD      TYR   7 -15.249  23.873  -0.102
   53    HD2  TYR   7           2HD      TYR   7 -11.068  22.788  -0.037
   54    HE1  TYR   7           1HE      TYR   7 -15.806  21.617  -1.019
   55    HE2  TYR   7           2HE      TYR   7 -11.641  20.535  -0.892
   56    HH   TYR   7           HH       TYR   7 -13.458  19.023  -1.117
   57    HA   PRO   8           HA       PRO   8 -10.010  27.958   3.692
   58   1HB   PRO   8          1HB       PRO   8  -7.527  27.024   4.505
   59   2HB   PRO   8          2HB       PRO   8  -9.006  27.077   5.499
   60   1HG   PRO   8          1HG       PRO   8  -7.703  24.723   4.221
   61   2HG   PRO   8          2HG       PRO   8  -8.770  24.797   5.652
   62   1HD   PRO   8          1HD       PRO   8  -9.460  24.030   3.004
   63   2HD   PRO   8          2HD       PRO   8 -10.587  24.318   4.358
   64    H    GLY   9           H        GLY   9  -9.113  25.950   1.140
   65   1HA   GLY   9          1HA       GLY   9  -8.539  27.369  -0.923
   66   2HA   GLY   9          2HA       GLY   9  -7.105  27.832  -0.005
   67    H    ASP  10           H        ASP  10  -8.270  25.703  -2.244
   68    HA   ASP  10           HA       ASP  10  -7.611  23.807  -3.242
   69   1HB   ASP  10          1HB       ASP  10  -5.409  25.030  -3.193
   70   2HB   ASP  10          2HB       ASP  10  -4.972  24.080  -1.766
   71    H    ASN  11           H        ASN  11  -6.685  21.503  -2.795
   72    HA   ASN  11           HA       ASN  11  -6.877  20.540  -0.052
   73   1HB   ASN  11          1HB       ASN  11  -9.251  20.566  -0.501
   74   2HB   ASN  11          2HB       ASN  11  -9.011  19.684  -2.022
   75   1HD2  ASN  11          1HD2      ASN  11 -10.263  17.820  -1.450
   76   2HD2  ASN  11          2HD2      ASN  11  -9.738  16.805  -0.104
   77    H    ALA  12           H        ALA  12  -4.619  20.341  -0.992
   78    HA   ALA  12           HA       ALA  12  -4.245  17.559  -1.722
   79   1HB   ALA  12          1HB       ALA  12  -2.995  17.956  -3.763
   80   2HB   ALA  12          2HB       ALA  12  -4.564  18.763  -3.945
   81   3HB   ALA  12          3HB       ALA  12  -3.120  19.724  -3.562
   82    H    THR  13           H        THR  13  -1.882  17.014  -1.678
   83    HA   THR  13           HA       THR  13   0.036  18.802  -0.583
   84    HB   THR  13           HB       THR  13  -1.007  18.882   1.479
   85    HG1  THR  13           1HG      THR  13   0.222  17.558   2.839
   86   1HG2  THR  13          1HG2      THR  13  -2.141  17.243   2.680
   87   2HG2  THR  13          2HG2      THR  13  -2.663  16.880   1.032
   88   3HG2  THR  13          3HG2      THR  13  -1.364  15.931   1.790
   89    HA   PRO  14           HA       PRO  14   2.446  15.358  -2.062
   90   1HB   PRO  14          1HB       PRO  14   4.900  15.929  -0.905
   91   2HB   PRO  14          2HB       PRO  14   4.251  16.695  -2.377
   92   1HG   PRO  14          1HG       PRO  14   4.443  17.816   0.382
   93   2HG   PRO  14          2HG       PRO  14   4.448  18.663  -1.191
   94   1HD   PRO  14          1HD       PRO  14   2.287  18.388   0.593
   95   2HD   PRO  14          2HD       PRO  14   2.180  18.960  -1.088
   96    H    GLU  15           H        GLU  15   1.650  15.910   1.225
   97    HA   GLU  15           HA       GLU  15   2.751  13.305   2.061
   98   1HB   GLU  15          1HB       GLU  15   2.527  15.796   3.342
   99   2HB   GLU  15          2HB       GLU  15   1.212  14.882   4.059
  100   1HG   GLU  15          1HG       GLU  15   2.630  13.454   5.176
  101   2HG   GLU  15          2HG       GLU  15   3.816  13.400   3.876
  102    H    GLN  16           H        GLN  16  -0.166  14.416   0.771
  103    HA   GLN  16           HA       GLN  16  -1.664  12.096   1.975
  104   1HB   GLN  16          1HB       GLN  16  -2.753  14.290   2.213
  105   2HB   GLN  16          2HB       GLN  16  -2.694  14.506   0.456
  106   1HG   GLN  16          1HG       GLN  16  -4.905  13.913   1.044
  107   2HG   GLN  16          2HG       GLN  16  -4.218  12.516   0.235
  108   1HE2  GLN  16          1HE2      GLN  16  -5.909  13.589   3.020
  109   2HE2  GLN  16          2HE2      GLN  16  -5.596  12.194   4.028
  110    H    MET  17           H        MET  17  -0.435  13.510  -1.036
  111    HA   MET  17           HA       MET  17  -1.720  11.671  -2.851
  112   1HB   MET  17          1HB       MET  17   0.216  13.901  -2.921
  113   2HB   MET  17          2HB       MET  17   0.719  12.608  -3.982
  114   1HG   MET  17          1HG       MET  17  -2.179  13.444  -4.033
  115   2HG   MET  17          2HG       MET  17  -0.983  14.510  -4.770
  116   1HE   MET  17          1HE       MET  17  -2.863  12.510  -7.695
  117   2HE   MET  17          2HE       MET  17  -3.512  13.035  -6.125
  118    H    ALA  18           H        ALA  18   1.502  11.670  -1.202
  119    HA   ALA  18           HA       ALA  18   2.328   9.206  -2.414
  120   1HB   ALA  18          1HB       ALA  18   4.235   9.601  -1.260
  121   2HB   ALA  18          2HB       ALA  18   3.520  11.150  -0.809
  122   3HB   ALA  18          3HB       ALA  18   3.401   9.768   0.294
  123    H    ARG  19           H        ARG  19   0.101   9.931   0.106
  124    HA   ARG  19           HA       ARG  19   0.164   7.227   1.306
  125   1HB   ARG  19          1HB       ARG  19  -0.610   9.667   2.419
  126   2HB   ARG  19          2HB       ARG  19  -2.153   8.994   1.950
  127   1HG   ARG  19          1HG       ARG  19  -1.749   8.201   4.174
  128   2HG   ARG  19          2HG       ARG  19  -1.523   6.828   3.095
  129   1HD   ARG  19          1HD       ARG  19   0.262   6.651   4.610
  130   2HD   ARG  19          2HD       ARG  19   1.022   7.353   3.197
  131    HE   ARG  19           HE       ARG  19   0.433   8.665   5.784
  132   1HH1  ARG  19          2HH2      ARG  19   1.588   9.214   2.549
  133   2HH1  ARG  19          1HH2      ARG  19   1.743  10.905   2.930
  134   1HH2  ARG  19          2HH1      ARG  19   1.262  10.729   6.235
  135   2HH2  ARG  19          1HH1      ARG  19   1.900  11.645   4.913
  136    H    TYR  20           H        TYR  20  -2.152   9.138  -0.665
  137    HA   TYR  20           HA       TYR  20  -4.150   7.246  -0.994
  138   1HB   TYR  20          1HB       TYR  20  -3.004   9.562  -2.519
  139   2HB   TYR  20          2HB       TYR  20  -3.909   8.449  -3.484
  140    HD1  TYR  20           1HD      TYR  20  -6.244   7.634  -2.185
  141    HD2  TYR  20           2HD      TYR  20  -4.243  11.447  -1.897
  142    HE1  TYR  20           1HE      TYR  20  -8.389   8.709  -1.592
  143    HE2  TYR  20           2HE      TYR  20  -6.433  12.532  -1.327
  144    HH   TYR  20           HH       TYR  20  -9.477  10.750  -1.366
  145    H    TYR  21           H        TYR  21  -1.132   7.554  -2.875
  146    HA   TYR  21           HA       TYR  21  -1.629   5.195  -4.497
  147   1HB   TYR  21          1HB       TYR  21   0.651   7.117  -4.039
  148   2HB   TYR  21          2HB       TYR  21   0.937   5.605  -4.882
  149    HD1  TYR  21           1HD      TYR  21   1.352   6.159  -7.075
  150    HD2  TYR  21           2HD      TYR  21  -2.073   7.940  -5.132
  151    HE1  TYR  21           1HE      TYR  21   0.642   7.197  -9.230
  152    HE2  TYR  21           2HE      TYR  21  -2.782   8.929  -7.269
  153    HH   TYR  21           HH       TYR  21  -2.154   9.376  -9.428
  154    H    SER  22           H        SER  22   0.414   5.822  -1.587
  155    HA   SER  22           HA       SER  22   1.596   3.215  -1.452
  156   1HB   SER  22          1HB       SER  22   0.992   5.331   0.625
  157   2HB   SER  22          2HB       SER  22   1.653   3.761   1.089
  158    HG   SER  22           HG       SER  22   2.757   5.690  -0.663
  159    H    ALA  23           H        ALA  23  -1.530   4.450  -0.184
  160    HA   ALA  23           HA       ALA  23  -2.287   2.018   1.112
  161   1HB   ALA  23          1HB       ALA  23  -3.314   4.400   1.340
  162   2HB   ALA  23          2HB       ALA  23  -4.243   3.985  -0.120
  163   3HB   ALA  23          3HB       ALA  23  -4.403   3.003   1.352
  164    H    LEU  24           H        LEU  24  -2.630   3.175  -2.279
  165    HA   LEU  24           HA       LEU  24  -4.245   0.998  -3.188
  166   1HB   LEU  24          1HB       LEU  24  -2.840   3.232  -4.355
  167   2HB   LEU  24          2HB       LEU  24  -2.336   1.805  -5.249
  168    HG   LEU  24           HG       LEU  24  -5.217   2.626  -4.728
  169   1HD1  LEU  24          1HD1      LEU  24  -3.784   4.156  -6.251
  170   2HD1  LEU  24          2HD1      LEU  24  -3.776   2.811  -7.402
  171   3HD1  LEU  24          3HD1      LEU  24  -5.303   3.549  -6.899
  172   1HD2  LEU  24          1HD2      LEU  24  -4.327   0.670  -6.880
  173   2HD2  LEU  24          2HD2      LEU  24  -4.638   0.103  -5.238
  174   3HD2  LEU  24          3HD2      LEU  24  -5.920   0.898  -6.144
  175    H    ARG  25           H        ARG  25  -0.681   1.350  -3.033
  176    HA   ARG  25           HA       ARG  25  -0.177  -1.293  -4.010
  177   1HB   ARG  25          1HB       ARG  25   1.460   0.820  -3.462
  178   2HB   ARG  25          2HB       ARG  25   1.736  -0.109  -1.989
  179   1HG   ARG  25          1HG       ARG  25   3.391  -0.697  -3.651
  180   2HG   ARG  25          2HG       ARG  25   2.348  -2.100  -3.392
  181   1HD   ARG  25          1HD       ARG  25   1.299  -1.867  -5.506
  182   2HD   ARG  25          2HD       ARG  25   1.643  -0.140  -5.592
  183    HE   ARG  25           HE       ARG  25   3.588  -0.589  -6.677
  184   1HH1  ARG  25          2HH2      ARG  25   2.727  -3.528  -5.010
  185   2HH1  ARG  25          1HH2      ARG  25   4.044  -4.443  -5.691
  186   1HH2  ARG  25          2HH1      ARG  25   5.350  -1.755  -7.472
  187   2HH2  ARG  25          1HH1      ARG  25   5.550  -3.406  -7.028
  188    H    ARG  26           H        ARG  26  -0.525  -0.146  -0.672
  189    HA   ARG  26           HA       ARG  26  -0.118  -2.715   0.566
  190   1HB   ARG  26          1HB       ARG  26  -0.319  -0.198   1.567
  191   2HB   ARG  26          2HB       ARG  26  -1.988  -0.692   1.808
  192   1HG   ARG  26          1HG       ARG  26  -1.309  -1.652   3.736
  193   2HG   ARG  26          2HG       ARG  26  -0.575  -2.917   2.770
  194   1HD   ARG  26          1HD       ARG  26   1.291  -0.692   2.840
  195   2HD   ARG  26          2HD       ARG  26   0.669  -0.917   4.462
  196    HE   ARG  26           HE       ARG  26   1.791  -2.923   4.640
  197   1HH1  ARG  26          2HH2      ARG  26   1.882  -1.973   1.294
  198   2HH1  ARG  26          1HH2      ARG  26   3.068  -3.188   0.852
  199   1HH2  ARG  26          2HH1      ARG  26   3.330  -4.471   4.045
  200   2HH2  ARG  26          1HH1      ARG  26   3.843  -4.609   2.405
  201    H    TYR  27           H        TYR  27  -3.132  -1.076  -0.446
  202    HA   TYR  27           HA       TYR  27  -4.982  -3.009   0.404
  203   1HB   TYR  27          1HB       TYR  27  -5.481  -0.684  -0.275
  204   2HB   TYR  27          2HB       TYR  27  -5.039  -1.060  -1.938
  205    HD1  TYR  27           1HD      TYR  27  -6.876  -1.162  -3.346
  206    HD2  TYR  27           2HD      TYR  27  -7.257  -2.581   0.709
  207    HE1  TYR  27           1HE      TYR  27  -9.268  -1.751  -3.759
  208    HE2  TYR  27           2HE      TYR  27  -9.613  -3.194   0.288
  209    HH   TYR  27           HH       TYR  27 -11.031  -3.754  -1.562
  210    H    ILE  28           H        ILE  28  -3.367  -2.647  -2.797
  211    HA   ILE  28           HA       ILE  28  -4.518  -4.997  -3.959
  212    HB   ILE  28           HB       ILE  28  -1.965  -3.490  -4.566
  213   2HG1  ILE  28          2HG1      ILE  28  -3.137  -2.242  -6.141
  214   1HG2  ILE  28          1HG2      ILE  28  -2.091  -4.625  -6.818
  215   2HG2  ILE  28          2HG2      ILE  28  -1.672  -5.708  -5.486
  216   3HG2  ILE  28          3HG2      ILE  28  -3.317  -5.718  -6.142
  217   1HD1  ILE  28          1HD1      ILE  28  -5.498  -4.156  -6.002
  218   2HD1  ILE  28          2HD1      ILE  28  -5.473  -2.595  -6.850
  219   3HD1  ILE  28          3HD1      ILE  28  -4.417  -3.901  -7.398
  220    H    ASN  29           H        ASN  29  -1.338  -4.562  -2.266
  221    HA   ASN  29           HA       ASN  29  -0.595  -7.318  -2.332
  222   1HB   ASN  29          1HB       ASN  29   0.227  -4.892  -0.830
  223   2HB   ASN  29          2HB       ASN  29   0.370  -6.356   0.113
  224   1HD2  ASN  29          1HD2      ASN  29   2.362  -4.465  -1.477
  225   2HD2  ASN  29          2HD2      ASN  29   3.428  -5.785  -2.026
  226    H    MET  30           H        MET  30  -2.772  -5.612  -0.083
  227    HA   MET  30           HA       MET  30  -3.195  -7.906   1.635
  228   1HB   MET  30          1HB       MET  30  -4.349  -5.162   1.288
  229   2HB   MET  30          2HB       MET  30  -5.411  -6.356   2.034
  230   1HG   MET  30          1HG       MET  30  -3.784  -6.852   3.751
  231   2HG   MET  30          2HG       MET  30  -2.544  -5.896   2.934
  232   1HE   MET  30          1HE       MET  30  -6.043  -4.337   5.493
  233   2HE   MET  30          2HE       MET  30  -6.218  -5.608   4.264
  234    H    LEU  31           H        LEU  31  -4.954  -6.681  -1.265
  235    HA   LEU  31           HA       LEU  31  -7.061  -8.597  -1.186
  236   1HB   LEU  31          1HB       LEU  31  -5.771  -6.819  -3.278
  237   2HB   LEU  31          2HB       LEU  31  -7.004  -7.949  -3.732
  238    HG   LEU  31           HG       LEU  31  -7.437  -5.931  -1.501
  239   1HD1  LEU  31          1HD1      LEU  31  -8.524  -4.504  -3.137
  240   2HD1  LEU  31          2HD1      LEU  31  -6.830  -4.740  -3.575
  241   3HD1  LEU  31          3HD1      LEU  31  -8.115  -5.614  -4.455
  242   1HD2  LEU  31          1HD2      LEU  31  -9.825  -6.575  -2.969
  243   2HD2  LEU  31          2HD2      LEU  31  -9.032  -8.102  -2.557
  244   3HD2  LEU  31          3HD2      LEU  31  -9.423  -6.943  -1.281
  245    H    THR  32           H        THR  32  -3.800  -8.751  -2.486
  246    HA   THR  32           HA       THR  32  -4.318 -11.482  -3.545
  247    HB   THR  32           HB       THR  32  -2.954  -9.684  -4.714
  248    HG1  THR  32           1HG      THR  32  -1.727 -11.259  -5.652
  249   1HG2  THR  32          1HG2      THR  32  -0.465 -10.795  -3.517
  250   2HG2  THR  32          2HG2      THR  32  -0.814  -9.179  -4.174
  251   3HG2  THR  32          3HG2      THR  32  -1.306  -9.601  -2.535
  252    H    ARG  33           H        ARG  33  -3.107 -10.076  -0.711
  253    HA   ARG  33           HA       ARG  33  -2.299 -10.727   1.261
  254   1HB   ARG  33          1HB       ARG  33  -3.952 -12.488   1.301
  255   2HB   ARG  33          2HB       ARG  33  -2.959 -13.522   0.277
  256   1HG   ARG  33          1HG       ARG  33  -1.227 -13.532   2.179
  257   2HG   ARG  33          2HG       ARG  33  -2.508 -12.821   3.175
  258   1HD   ARG  33          1HD       ARG  33  -3.611 -15.091   1.752
  259   2HD   ARG  33          2HD       ARG  33  -2.029 -15.564   2.354
  260    HE   ARG  33           HE       ARG  33  -2.823 -15.532   4.518
  261   1HH1  ARG  33          2HH2      ARG  33  -5.184 -13.876   2.540
  262   2HH1  ARG  33          1HH2      ARG  33  -6.352 -13.732   3.829
  263   1HH2  ARG  33          2HH1      ARG  33  -4.324 -15.295   6.183
  264   2HH2  ARG  33          1HH1      ARG  33  -5.849 -14.533   5.845
  265    HA   PRO  34           HA       PRO  34   2.020 -11.645   0.248
  266   1HB   PRO  34          1HB       PRO  34   3.160 -11.613   2.746
  267   2HB   PRO  34          2HB       PRO  34   2.676 -10.164   1.837
  268   1HG   PRO  34          1HG       PRO  34   1.274 -11.479   4.138
  269   2HG   PRO  34          2HG       PRO  34   1.383  -9.746   3.713
  270   1HD   PRO  34          1HD       PRO  34  -0.758 -11.478   3.167
  271   2HD   PRO  34          2HD       PRO  34  -0.515  -9.880   2.421
  272    H    ARG  35           H        ARG  35   0.468 -13.761  -0.144
  273    HA   ARG  35           HA       ARG  35   1.174 -16.104   1.475
  274   1HB   ARG  35          1HB       ARG  35  -0.896 -15.999   0.140
  275   2HB   ARG  35          2HB       ARG  35   0.028 -15.887  -1.356
  276   1HG   ARG  35          1HG       ARG  35   0.664 -18.113  -1.322
  277   2HG   ARG  35          2HG       ARG  35   0.593 -18.245   0.442
  278   1HD   ARG  35          1HD       ARG  35  -1.732 -18.441   0.501
  279   2HD   ARG  35          2HD       ARG  35  -1.938 -17.893  -1.178
  280    HE   ARG  35           HE       ARG  35  -0.376 -20.181  -1.382
  281   1HH1  ARG  35          2HH2      ARG  35  -3.540 -19.567  -0.006
  282   2HH1  ARG  35          1HH2      ARG  35  -4.113 -21.180  -0.346
  283   1HH2  ARG  35          2HH1      ARG  35  -1.179 -22.273  -1.793
  284   2HH2  ARG  35          1HH1      ARG  35  -2.751 -22.733  -1.242
  285    H    TYR  36           H        TYR  36   2.865 -14.279  -0.840
  286    HA   TYR  36           HA       TYR  36   4.884 -16.429  -1.264
  287   1HB   TYR  36          1HB       TYR  36   3.903 -14.273  -3.167
  288   2HB   TYR  36          2HB       TYR  36   5.337 -15.253  -3.438
  289    HD1  TYR  36           1HD      TYR  36   5.189 -17.584  -4.121
  290    HD2  TYR  36           2HD      TYR  36   1.627 -15.317  -3.260
  291    HE1  TYR  36           1HE      TYR  36   3.799 -19.351  -5.205
  292    HE2  TYR  36           2HE      TYR  36   0.241 -17.070  -4.354
  293    HH   TYR  36           HH       TYR  36   0.450 -18.917  -5.976
  294   1HN   NH2  37          1HN       NH2  37   6.845 -15.960  -0.307
  295   2HN   NH2  37          2HN       NH2  37   7.354 -14.309   0.006
  Start of MODEL    4
    1   1H    ALA   1          1H        ALA   1 -12.544  11.007  15.766
    2   2H    ALA   1          2H        ALA   1 -13.004  10.148  14.449
    3   3H    ALA   1          3H        ALA   1 -12.284   9.376  15.725
    4    HA   ALA   1           HA       ALA   1 -10.229  10.551  15.324
    5   1HB   ALA   1          1HB       ALA   1 -11.456   8.909  13.089
    6   2HB   ALA   1          2HB       ALA   1  -9.815   9.557  12.949
    7   3HB   ALA   1          3HB       ALA   1 -10.213   8.457  14.280
    8    HA   PRO   2           HA       PRO   2 -10.555  14.371  13.097
    9   1HB   PRO   2          1HB       PRO   2  -7.937  14.848  12.399
   10   2HB   PRO   2          2HB       PRO   2  -8.590  15.035  14.056
   11   1HG   PRO   2          1HG       PRO   2  -6.908  12.820  12.931
   12   2HG   PRO   2          2HG       PRO   2  -6.959  13.468  14.594
   13   1HD   PRO   2          1HD       PRO   2  -8.224  11.124  13.648
   14   2HD   PRO   2          2HD       PRO   2  -8.579  11.949  15.194
   15    H    LEU   3           H        LEU   3 -11.469  14.559  11.161
   16    HA   LEU   3           HA       LEU   3 -10.029  14.052   8.718
   17   1HB   LEU   3          1HB       LEU   3 -10.950  11.769   9.290
   18   2HB   LEU   3          2HB       LEU   3 -12.567  12.453   9.308
   19    HG   LEU   3           HG       LEU   3 -12.316  13.033   6.873
   20   1HD1  LEU   3          1HD1      LEU   3  -9.911  13.241   6.636
   21   2HD1  LEU   3          2HD1      LEU   3  -9.655  11.572   7.196
   22   3HD1  LEU   3          3HD1      LEU   3 -10.433  11.888   5.630
   23   1HD2  LEU   3          1HD2      LEU   3 -12.403  10.650   6.085
   24   2HD2  LEU   3          2HD2      LEU   3 -11.860  10.135   7.697
   25   3HD2  LEU   3          3HD2      LEU   3 -13.424  10.973   7.500
   26    H    GLU   4           H        GLU   4 -10.513  15.928   7.635
   27    HA   GLU   4           HA       GLU   4 -12.782  17.555   8.301
   28   1HB   GLU   4          1HB       GLU   4 -10.345  17.766   6.711
   29   2HB   GLU   4          2HB       GLU   4 -11.701  18.417   5.812
   30   1HG   GLU   4          1HG       GLU   4 -11.961  20.218   7.191
   31   2HG   GLU   4          2HG       GLU   4 -11.696  19.289   8.654
   32    HA   PRO   5           HA       PRO   5 -15.438  15.157   5.552
   33   1HB   PRO   5          1HB       PRO   5 -17.878  16.258   6.311
   34   2HB   PRO   5          2HB       PRO   5 -17.016  14.976   7.205
   35   1HG   PRO   5          1HG       PRO   5 -17.252  17.891   7.854
   36   2HG   PRO   5          2HG       PRO   5 -17.025  16.492   8.943
   37   1HD   PRO   5          1HD       PRO   5 -15.023  18.292   8.036
   38   2HD   PRO   5          2HD       PRO   5 -14.773  16.758   8.904
   39    H    VAL   6           H        VAL   6 -14.613  18.286   5.347
   40    HA   VAL   6           HA       VAL   6 -15.321  18.636   2.610
   41    HB   VAL   6           HB       VAL   6 -17.471  19.256   3.927
   42   1HG1  VAL   6          1HG1      VAL   6 -15.962  20.791   5.562
   43   2HG1  VAL   6          2HG1      VAL   6 -16.421  22.013   4.360
   44   3HG1  VAL   6          3HG1      VAL   6 -17.662  21.096   5.221
   45   1HG2  VAL   6          1HG2      VAL   6 -18.088  20.949   2.386
   46   2HG2  VAL   6          2HG2      VAL   6 -16.406  21.388   2.053
   47   3HG2  VAL   6          3HG2      VAL   6 -17.040  19.803   1.549
   48    H    TYR   7           H        TYR   7 -14.398  20.789   1.840
   49    HA   TYR   7           HA       TYR   7 -12.608  22.198   1.643
   50   1HB   TYR   7          1HB       TYR   7 -14.216  22.901   3.909
   51   2HB   TYR   7          2HB       TYR   7 -12.588  23.330   4.302
   52    HD1  TYR   7           1HD      TYR   7 -15.251  23.773   1.737
   53    HD2  TYR   7           2HD      TYR   7 -11.535  25.247   3.363
   54    HE1  TYR   7           1HE      TYR   7 -15.477  25.839   0.373
   55    HE2  TYR   7           2HE      TYR   7 -11.787  27.339   2.020
   56    HH   TYR   7           HH       TYR   7 -14.322  27.773  -0.398
   57    HA   PRO   8           HA       PRO   8  -9.446  19.459   3.633
   58   1HB   PRO   8          1HB       PRO   8  -7.945  18.930   1.379
   59   2HB   PRO   8          2HB       PRO   8  -9.377  17.996   1.877
   60   1HG   PRO   8          1HG       PRO   8  -9.138  20.072  -0.274
   61   2HG   PRO   8          2HG       PRO   8 -10.177  18.620  -0.211
   62   1HD   PRO   8          1HD       PRO   8 -10.955  21.268   0.355
   63   2HD   PRO   8          2HD       PRO   8 -11.870  19.800   0.798
   64    H    GLY   9           H        GLY   9  -9.451  22.512   2.352
   65   1HA   GLY   9          1HA       GLY   9  -8.192  24.336   3.075
   66   2HA   GLY   9          2HA       GLY   9  -6.924  23.250   3.653
   67    H    ASP  10           H        ASP  10  -6.172  21.839   1.544
   68    HA   ASP  10           HA       ASP  10  -5.378  23.793  -0.592
   69   1HB   ASP  10          1HB       ASP  10  -3.622  22.679   1.109
   70   2HB   ASP  10          2HB       ASP  10  -3.713  21.353  -0.046
   71    H    ASN  11           H        ASN  11  -4.676  22.520  -2.617
   72    HA   ASN  11           HA       ASN  11  -6.988  21.209  -3.788
   73   1HB   ASN  11          1HB       ASN  11  -4.120  21.697  -4.652
   74   2HB   ASN  11          2HB       ASN  11  -5.198  20.688  -5.621
   75   1HD2  ASN  11          1HD2      ASN  11  -4.012  23.742  -5.557
   76   2HD2  ASN  11          2HD2      ASN  11  -5.399  24.486  -6.357
   77    H    ALA  12           H        ALA  12  -3.794  19.824  -3.732
   78    HA   ALA  12           HA       ALA  12  -4.689  17.282  -2.509
   79   1HB   ALA  12          1HB       ALA  12  -3.334  16.160  -4.487
   80   2HB   ALA  12          2HB       ALA  12  -5.052  16.554  -4.663
   81   3HB   ALA  12          3HB       ALA  12  -3.819  17.618  -5.374
   82    H    THR  13           H        THR  13  -3.496  17.891  -0.755
   83    HA   THR  13           HA       THR  13  -0.869  18.855  -0.704
   84    HB   THR  13           HB       THR  13  -2.169  18.972   1.258
   85    HG1  THR  13           1HG      THR  13  -0.213  18.817   2.042
   86   1HG2  THR  13          1HG2      THR  13  -1.999  15.981   1.589
   87   2HG2  THR  13          2HG2      THR  13  -2.912  17.109   2.588
   88   3HG2  THR  13          3HG2      THR  13  -3.464  16.759   0.943
   89    HA   PRO  14           HA       PRO  14   1.456  15.422  -2.161
   90   1HB   PRO  14          1HB       PRO  14   3.969  16.000  -1.115
   91   2HB   PRO  14          2HB       PRO  14   3.247  16.749  -2.565
   92   1HG   PRO  14          1HG       PRO  14   3.531  17.890   0.181
   93   2HG   PRO  14          2HG       PRO  14   3.499  18.729  -1.398
   94   1HD   PRO  14          1HD       PRO  14   1.398  18.512   0.429
   95   2HD   PRO  14          2HD       PRO  14   1.206  18.996  -1.266
   96    H    GLU  15           H        GLU  15   1.052  16.045   1.222
   97    HA   GLU  15           HA       GLU  15   2.229  13.502   2.087
   98   1HB   GLU  15          1HB       GLU  15   1.652  16.010   3.344
   99   2HB   GLU  15          2HB       GLU  15   0.545  14.857   4.089
  100   1HG   GLU  15          1HG       GLU  15   2.530  13.306   4.439
  101   2HG   GLU  15          2HG       GLU  15   3.576  14.601   3.847
  102    H    GLN  16           H        GLN  16  -0.770  14.463   0.832
  103    HA   GLN  16           HA       GLN  16  -2.144  12.094   2.009
  104   1HB   GLN  16          1HB       GLN  16  -3.305  14.300   2.092
  105   2HB   GLN  16          2HB       GLN  16  -3.298  14.349   0.316
  106   1HG   GLN  16          1HG       GLN  16  -5.458  13.655   1.091
  107   2HG   GLN  16          2HG       GLN  16  -4.700  12.251   0.344
  108   1HE2  GLN  16          1HE2      GLN  16  -3.856  10.538   1.825
  109   2HE2  GLN  16          2HE2      GLN  16  -4.503  10.501   3.470
  110    H    MET  17           H        MET  17  -1.005  13.520  -1.017
  111    HA   MET  17           HA       MET  17  -2.118  11.527  -2.796
  112   1HB   MET  17          1HB       MET  17  -0.470  13.956  -2.943
  113   2HB   MET  17          2HB       MET  17   0.201  12.709  -3.962
  114   1HG   MET  17          1HG       MET  17  -2.774  13.183  -4.097
  115   2HG   MET  17          2HG       MET  17  -1.690  14.384  -4.796
  116   1HE   MET  17          1HE       MET  17  -3.864  12.924  -6.676
  117   2HE   MET  17          2HE       MET  17  -2.724  14.243  -7.030
  118    H    ALA  18           H        ALA  18   1.163  11.925  -1.255
  119    HA   ALA  18           HA       ALA  18   2.192   9.516  -2.405
  120   1HB   ALA  18          1HB       ALA  18   3.987   9.798  -0.839
  121   2HB   ALA  18          2HB       ALA  18   3.487  11.433  -1.300
  122   3HB   ALA  18          3HB       ALA  18   2.981  10.758   0.264
  123    H    ARG  19           H        ARG  19  -0.047  10.076   0.157
  124    HA   ARG  19           HA       ARG  19   0.314   7.419   1.357
  125   1HB   ARG  19          1HB       ARG  19  -0.479   9.647   2.524
  126   2HB   ARG  19          2HB       ARG  19  -2.082   9.186   1.961
  127   1HG   ARG  19          1HG       ARG  19  -2.252   7.441   3.456
  128   2HG   ARG  19          2HG       ARG  19  -0.582   6.934   3.210
  129   1HD   ARG  19          1HD       ARG  19   0.010   9.147   4.530
  130   2HD   ARG  19          2HD       ARG  19  -1.653   8.991   5.126
  131    HE   ARG  19           HE       ARG  19  -0.342   6.473   5.389
  132   1HH1  ARG  19          2HH2      ARG  19  -0.081   9.668   6.780
  133   2HH1  ARG  19          1HH2      ARG  19   0.547   9.090   8.295
  134   1HH2  ARG  19          2HH1      ARG  19   0.708   5.765   7.262
  135   2HH2  ARG  19          1HH1      ARG  19   1.020   6.913   8.532
  136    H    TYR  20           H        TYR  20  -2.203   8.999  -0.658
  137    HA   TYR  20           HA       TYR  20  -4.031   6.883  -0.931
  138   1HB   TYR  20          1HB       TYR  20  -3.205   9.330  -2.442
  139   2HB   TYR  20          2HB       TYR  20  -3.953   8.100  -3.407
  140    HD1  TYR  20           1HD      TYR  20  -4.562   9.635  -0.011
  141    HD2  TYR  20           2HD      TYR  20  -6.238   8.383  -3.777
  142    HE1  TYR  20           1HE      TYR  20  -6.792  10.465   0.712
  143    HE2  TYR  20           2HE      TYR  20  -8.468   9.204  -3.049
  144    HH   TYR  20           HH       TYR  20  -9.260   9.848   0.077
  145    H    TYR  21           H        TYR  21  -1.102   7.584  -2.885
  146    HA   TYR  21           HA       TYR  21  -1.327   5.320  -4.593
  147   1HB   TYR  21          1HB       TYR  21   0.047   7.568  -4.700
  148   2HB   TYR  21          2HB       TYR  21   1.296   6.655  -3.868
  149    HD1  TYR  21           1HD      TYR  21   2.727   5.194  -5.157
  150    HD2  TYR  21           2HD      TYR  21  -0.948   6.686  -6.856
  151    HE1  TYR  21           1HE      TYR  21   3.443   4.387  -7.405
  152    HE2  TYR  21           2HE      TYR  21  -0.241   5.855  -9.102
  153    HH   TYR  21           HH       TYR  21   2.975   4.755  -9.786
  154    H    SER  22           H        SER  22   0.509   5.776  -1.558
  155    HA   SER  22           HA       SER  22   1.774   3.174  -1.543
  156   1HB   SER  22          1HB       SER  22   1.606   5.485   0.240
  157   2HB   SER  22          2HB       SER  22   1.383   4.001   1.148
  158    HG   SER  22           HG       SER  22   3.541   4.561  -0.617
  159    H    ALA  23           H        ALA  23  -1.250   4.428  -0.114
  160    HA   ALA  23           HA       ALA  23  -2.095   2.043   1.158
  161   1HB   ALA  23          1HB       ALA  23  -3.052   4.350   1.527
  162   2HB   ALA  23          2HB       ALA  23  -3.853   4.220  -0.055
  163   3HB   ALA  23          3HB       ALA  23  -4.270   3.093   1.250
  164    H    LEU  24           H        LEU  24  -2.687   3.230  -2.236
  165    HA   LEU  24           HA       LEU  24  -4.228   1.024  -3.129
  166   1HB   LEU  24          1HB       LEU  24  -4.145   2.827  -4.594
  167   2HB   LEU  24          2HB       LEU  24  -2.449   3.113  -4.327
  168    HG   LEU  24           HG       LEU  24  -1.934   1.031  -5.647
  169   1HD1  LEU  24          1HD1      LEU  24  -3.994  -0.185  -5.684
  170   2HD1  LEU  24          2HD1      LEU  24  -4.917   1.228  -6.218
  171   3HD1  LEU  24          3HD1      LEU  24  -3.795   0.428  -7.328
  172   1HD2  LEU  24          1HD2      LEU  24  -1.737   3.343  -6.528
  173   2HD2  LEU  24          2HD2      LEU  24  -2.049   2.112  -7.756
  174   3HD2  LEU  24          3HD2      LEU  24  -3.371   3.177  -7.216
  175    H    ARG  25           H        ARG  25  -0.640   1.402  -3.091
  176    HA   ARG  25           HA       ARG  25  -0.122  -1.189  -4.144
  177   1HB   ARG  25          1HB       ARG  25   1.417   1.009  -3.165
  178   2HB   ARG  25          2HB       ARG  25   1.936  -0.373  -2.209
  179   1HG   ARG  25          1HG       ARG  25   1.804  -0.278  -5.255
  180   2HG   ARG  25          2HG       ARG  25   3.254  -0.034  -4.284
  181   1HD   ARG  25          1HD       ARG  25   2.075  -2.521  -3.425
  182   2HD   ARG  25          2HD       ARG  25   2.044  -2.507  -5.196
  183    HE   ARG  25           HE       ARG  25   4.600  -1.672  -4.079
  184   1HH1  ARG  25          2HH2      ARG  25   2.767  -4.514  -4.939
  185   2HH1  ARG  25          1HH2      ARG  25   4.182  -5.526  -5.105
  186   1HH2  ARG  25          2HH1      ARG  25   6.382  -2.959  -4.268
  187   2HH2  ARG  25          1HH1      ARG  25   6.204  -4.637  -4.696
  188    H    ARG  26           H        ARG  26  -0.291  -0.200  -0.724
  189    HA   ARG  26           HA       ARG  26   0.091  -2.845   0.330
  190   1HB   ARG  26          1HB       ARG  26   0.050  -0.368   1.464
  191   2HB   ARG  26          2HB       ARG  26  -1.587  -0.896   1.881
  192   1HG   ARG  26          1HG       ARG  26  -0.390  -3.110   2.668
  193   2HG   ARG  26          2HG       ARG  26   1.092  -2.146   2.605
  194   1HD   ARG  26          1HD       ARG  26   0.252  -0.606   4.268
  195   2HD   ARG  26          2HD       ARG  26  -1.375  -1.319   4.174
  196    HE   ARG  26           HE       ARG  26   0.374  -3.401   4.874
  197   1HH1  ARG  26          2HH2      ARG  26  -0.858  -0.497   6.370
  198   2HH1  ARG  26          1HH2      ARG  26  -0.787  -1.136   7.979
  199   1HH2  ARG  26          2HH1      ARG  26   0.475  -4.219   6.947
  200   2HH2  ARG  26          1HH1      ARG  26  -0.099  -3.221   8.284
  201    H    TYR  27           H        TYR  27  -2.867  -1.109  -0.587
  202    HA   TYR  27           HA       TYR  27  -4.813  -2.953   0.277
  203   1HB   TYR  27          1HB       TYR  27  -5.267  -0.647  -0.388
  204   2HB   TYR  27          2HB       TYR  27  -4.773  -0.976  -2.035
  205    HD1  TYR  27           1HD      TYR  27  -7.145  -2.355   0.509
  206    HD2  TYR  27           2HD      TYR  27  -6.506  -1.163  -3.589
  207    HE1  TYR  27           1HE      TYR  27  -9.534  -2.888  -0.022
  208    HE2  TYR  27           2HE      TYR  27  -8.896  -1.658  -4.106
  209    HH   TYR  27           HH       TYR  27 -10.772  -3.092  -3.199
  210    H    ILE  28           H        ILE  28  -3.170  -2.708  -2.938
  211    HA   ILE  28           HA       ILE  28  -4.389  -5.039  -4.069
  212    HB   ILE  28           HB       ILE  28  -1.712  -3.700  -4.587
  213   2HG1  ILE  28          2HG1      ILE  28  -2.817  -2.987  -6.713
  214   1HG2  ILE  28          1HG2      ILE  28  -1.574  -4.983  -6.703
  215   2HG2  ILE  28          2HG2      ILE  28  -1.411  -6.010  -5.284
  216   3HG2  ILE  28          3HG2      ILE  28  -2.942  -5.987  -6.175
  217   1HD1  ILE  28          1HD1      ILE  28  -5.125  -3.077  -7.104
  218   2HD1  ILE  28          2HD1      ILE  28  -4.817  -4.721  -6.509
  219   3HD1  ILE  28          3HD1      ILE  28  -5.507  -3.481  -5.425
  220    H    ASN  29           H        ASN  29  -1.386  -4.772  -2.119
  221    HA   ASN  29           HA       ASN  29  -0.775  -7.568  -2.180
  222   1HB   ASN  29          1HB       ASN  29   0.656  -5.600  -1.300
  223   2HB   ASN  29          2HB       ASN  29  -0.250  -5.748   0.198
  224   1HD2  ASN  29          1HD2      ASN  29   2.573  -6.782  -1.343
  225   2HD2  ASN  29          2HD2      ASN  29   2.779  -8.241  -0.366
  226    H    MET  30           H        MET  30  -2.713  -5.684   0.190
  227    HA   MET  30           HA       MET  30  -3.521  -7.842   1.792
  228   1HB   MET  30          1HB       MET  30  -3.763  -5.311   2.196
  229   2HB   MET  30          2HB       MET  30  -5.236  -5.410   1.222
  230   1HG   MET  30          1HG       MET  30  -5.861  -7.383   2.872
  231   2HG   MET  30          2HG       MET  30  -4.583  -6.715   3.881
  232   1HE   MET  30          1HE       MET  30  -8.715  -5.291   2.840
  233   2HE   MET  30          2HE       MET  30  -7.587  -4.272   1.921
  234    H    LEU  31           H        LEU  31  -5.086  -6.610  -1.224
  235    HA   LEU  31           HA       LEU  31  -7.333  -8.365  -1.232
  236   1HB   LEU  31          1HB       LEU  31  -5.734  -6.808  -3.285
  237   2HB   LEU  31          2HB       LEU  31  -7.033  -7.851  -3.790
  238    HG   LEU  31           HG       LEU  31  -7.421  -5.597  -1.782
  239   1HD1  LEU  31          1HD1      LEU  31  -7.960  -5.658  -4.784
  240   2HD1  LEU  31          2HD1      LEU  31  -8.346  -4.342  -3.663
  241   3HD1  LEU  31          3HD1      LEU  31  -6.664  -4.753  -3.960
  242   1HD2  LEU  31          1HD2      LEU  31  -9.250  -7.593  -3.123
  243   2HD2  LEU  31          2HD2      LEU  31  -9.284  -6.943  -1.473
  244   3HD2  LEU  31          3HD2      LEU  31  -9.854  -5.958  -2.824
  245    H    THR  32           H        THR  32  -3.981  -8.981  -1.862
  246    HA   THR  32           HA       THR  32  -4.603 -11.695  -2.960
  247    HB   THR  32           HB       THR  32  -2.012 -10.155  -3.236
  248    HG1  THR  32           1HG      THR  32  -3.716  -9.164  -4.322
  249   1HG2  THR  32          1HG2      THR  32  -2.594 -12.914  -3.740
  250   2HG2  THR  32          2HG2      THR  32  -2.583 -12.132  -5.321
  251   3HG2  THR  32          3HG2      THR  32  -1.177 -11.993  -4.249
  252    H    ARG  33           H        ARG  33  -4.814 -10.889  -0.185
  253    HA   ARG  33           HA       ARG  33  -2.645 -11.756   1.382
  254   1HB   ARG  33          1HB       ARG  33  -5.567 -11.337   1.776
  255   2HB   ARG  33          2HB       ARG  33  -4.937 -12.621   2.786
  256   1HG   ARG  33          1HG       ARG  33  -3.069 -11.043   3.521
  257   2HG   ARG  33          2HG       ARG  33  -3.903  -9.766   2.664
  258   1HD   ARG  33          1HD       ARG  33  -5.208  -9.413   4.447
  259   2HD   ARG  33          2HD       ARG  33  -5.891 -11.025   4.297
  260    HE   ARG  33           HE       ARG  33  -3.780 -10.107   6.128
  261   1HH1  ARG  33          2HH2      ARG  33  -5.224 -13.018   4.797
  262   2HH1  ARG  33          1HH2      ARG  33  -4.664 -14.030   6.099
  263   1HH2  ARG  33          2HH1      ARG  33  -3.131 -11.437   7.805
  264   2HH2  ARG  33          1HH1      ARG  33  -3.530 -13.138   7.769
  265    HA   PRO  34           HA       PRO  34  -2.420 -16.126   0.951
  266   1HB   PRO  34          1HB       PRO  34  -1.711 -16.998   3.473
  267   2HB   PRO  34          2HB       PRO  34  -0.617 -16.161   2.338
  268   1HG   PRO  34          1HG       PRO  34  -2.016 -15.055   4.756
  269   2HG   PRO  34          2HG       PRO  34  -0.423 -14.618   4.061
  270   1HD   PRO  34          1HD       PRO  34  -2.836 -13.237   3.719
  271   2HD   PRO  34          2HD       PRO  34  -1.379 -13.016   2.717
  272    H    ARG  35           H        ARG  35  -4.587 -16.409   0.416
  273    HA   ARG  35           HA       ARG  35  -6.181 -17.827   2.504
  274   1HB   ARG  35          1HB       ARG  35  -6.870 -15.387   1.914
  275   2HB   ARG  35          2HB       ARG  35  -7.505 -16.062   0.417
  276   1HG   ARG  35          1HG       ARG  35  -9.286 -17.085   1.499
  277   2HG   ARG  35          2HG       ARG  35  -8.306 -17.564   2.880
  278   1HD   ARG  35          1HD       ARG  35  -9.885 -16.013   3.705
  279   2HD   ARG  35          2HD       ARG  35  -8.303 -15.215   3.699
  280    HE   ARG  35           HE       ARG  35  -9.711 -14.679   1.253
  281   1HH1  ARG  35          2HH2      ARG  35  -9.732 -13.722   4.589
  282   2HH1  ARG  35          1HH2      ARG  35 -10.594 -12.219   4.319
  283   1HH2  ARG  35          2HH1      ARG  35 -10.771 -12.726   0.873
  284   2HH2  ARG  35          1HH1      ARG  35 -11.141 -11.676   2.201
  285    H    TYR  36           H        TYR  36  -4.718 -19.408   1.183
  286    HA   TYR  36           HA       TYR  36  -4.579 -21.261  -0.119
  287   1HB   TYR  36          1HB       TYR  36  -7.594 -21.181   0.185
  288   2HB   TYR  36          2HB       TYR  36  -6.641 -22.562  -0.332
  289    HD1  TYR  36           1HD      TYR  36  -5.394 -23.919   1.230
  290    HD2  TYR  36           2HD      TYR  36  -7.437 -20.359   2.570
  291    HE1  TYR  36           1HE      TYR  36  -5.119 -24.647   3.590
  292    HE2  TYR  36           2HE      TYR  36  -7.109 -21.075   4.940
  293    HH   TYR  36           HH       TYR  36  -6.644 -23.952   5.948
  294   1HN   NH2  37          1HN       NH2  37  -3.729 -19.816  -1.905
  295   2HN   NH2  37          2HN       NH2  37  -4.710 -19.857  -3.387
  Start of MODEL    5
    1   1H    ALA   1          1H        ALA   1 -16.982  18.997 -12.263
    2   2H    ALA   1          2H        ALA   1 -17.720  20.285 -11.549
    3   3H    ALA   1          3H        ALA   1 -16.288  19.732 -10.952
    4    HA   ALA   1           HA       ALA   1 -18.852  18.330 -10.908
    5   1HB   ALA   1          1HB       ALA   1 -17.601  16.606  -9.550
    6   2HB   ALA   1          2HB       ALA   1 -17.074  16.697 -11.235
    7   3HB   ALA   1          3HB       ALA   1 -16.090  17.435  -9.951
    8    HA   PRO   2           HA       PRO   2 -19.292  20.503  -7.016
    9   1HB   PRO   2          1HB       PRO   2 -21.175  18.955  -5.747
   10   2HB   PRO   2          2HB       PRO   2 -21.518  19.996  -7.153
   11   1HG   PRO   2          1HG       PRO   2 -21.194  17.014  -7.071
   12   2HG   PRO   2          2HG       PRO   2 -22.243  18.020  -8.115
   13   1HD   PRO   2          1HD       PRO   2 -19.719  16.919  -8.790
   14   2HD   PRO   2          2HD       PRO   2 -20.609  18.159  -9.718
   15    H    LEU   3           H        LEU   3 -16.954  19.632  -6.944
   16    HA   LEU   3           HA       LEU   3 -16.453  17.788  -4.677
   17   1HB   LEU   3          1HB       LEU   3 -14.140  17.983  -5.202
   18   2HB   LEU   3          2HB       LEU   3 -15.001  17.700  -6.686
   19    HG   LEU   3           HG       LEU   3 -14.794  20.576  -6.351
   20   1HD1  LEU   3          1HD1      LEU   3 -12.916  20.295  -4.852
   21   2HD1  LEU   3          2HD1      LEU   3 -12.177  19.073  -5.914
   22   3HD1  LEU   3          3HD1      LEU   3 -12.279  20.770  -6.430
   23   1HD2  LEU   3          1HD2      LEU   3 -13.052  19.053  -8.270
   24   2HD2  LEU   3          2HD2      LEU   3 -14.815  19.040  -8.483
   25   3HD2  LEU   3          3HD2      LEU   3 -13.944  20.576  -8.478
   26    H    GLU   4           H        GLU   4 -14.367  19.024  -3.441
   27    HA   GLU   4           HA       GLU   4 -13.843  20.401  -1.711
   28   1HB   GLU   4          1HB       GLU   4 -14.421  22.145  -3.594
   29   2HB   GLU   4          2HB       GLU   4 -15.772  22.569  -2.557
   30   1HG   GLU   4          1HG       GLU   4 -12.911  22.421  -1.517
   31   2HG   GLU   4          2HG       GLU   4 -13.443  23.792  -2.464
   32    HA   PRO   5           HA       PRO   5 -17.634  18.830   0.385
   33   1HB   PRO   5          1HB       PRO   5 -16.355  16.861   1.906
   34   2HB   PRO   5          2HB       PRO   5 -17.108  16.618   0.312
   35   1HG   PRO   5          1HG       PRO   5 -14.220  16.794   1.016
   36   2HG   PRO   5          2HG       PRO   5 -15.018  15.976  -0.359
   37   1HD   PRO   5          1HD       PRO   5 -13.698  18.509  -0.376
   38   2HD   PRO   5          2HD       PRO   5 -14.658  17.777  -1.691
   39    H    VAL   6           H        VAL   6 -17.427  18.258   3.039
   40    HA   VAL   6           HA       VAL   6 -17.006  20.642   4.474
   41    HB   VAL   6           HB       VAL   6 -16.826  19.180   6.482
   42   1HG1  VAL   6          1HG1      VAL   6 -19.040  18.782   4.483
   43   2HG1  VAL   6          2HG1      VAL   6 -19.014  17.776   5.943
   44   3HG1  VAL   6          3HG1      VAL   6 -19.042  19.541   6.080
   45   1HG2  VAL   6          1HG2      VAL   6 -15.460  17.362   5.701
   46   2HG2  VAL   6          2HG2      VAL   6 -17.003  16.691   6.225
   47   3HG2  VAL   6          3HG2      VAL   6 -16.655  16.879   4.493
   48    H    TYR   7           H        TYR   7 -15.369  21.290   5.900
   49    HA   TYR   7           HA       TYR   7 -13.289  21.916   6.491
   50   1HB   TYR   7          1HB       TYR   7 -12.697  19.026   5.797
   51   2HB   TYR   7          2HB       TYR   7 -11.394  20.091   6.122
   52    HD1  TYR   7           1HD      TYR   7 -11.158  21.183   8.362
   53    HD2  TYR   7           2HD      TYR   7 -14.205  18.247   7.533
   54    HE1  TYR   7           1HE      TYR   7 -11.439  20.772  10.807
   55    HE2  TYR   7           2HE      TYR   7 -14.476  17.823   9.958
   56    HH   TYR   7           HH       TYR   7 -13.501  18.174  12.026
   57    HA   PRO   8           HA       PRO   8 -11.417  23.573   2.856
   58   1HB   PRO   8          1HB       PRO   8  -8.744  23.950   3.568
   59   2HB   PRO   8          2HB       PRO   8 -10.094  25.035   3.986
   60   1HG   PRO   8          1HG       PRO   8  -8.643  23.096   5.719
   61   2HG   PRO   8          2HG       PRO   8  -9.554  24.564   6.177
   62   1HD   PRO   8          1HD       PRO   8 -10.392  21.875   6.354
   63   2HD   PRO   8          2HD       PRO   8 -11.428  23.308   6.590
   64    H    GLY   9           H        GLY   9 -10.994  22.504   1.016
   65   1HA   GLY   9          1HA       GLY   9  -9.744  19.883   0.976
   66   2HA   GLY   9          2HA       GLY   9 -10.277  20.815  -0.415
   67    H    ASP  10           H        ASP  10  -8.675  23.110  -0.077
   68    HA   ASP  10           HA       ASP  10  -6.688  24.023  -0.605
   69   1HB   ASP  10          1HB       ASP  10  -6.060  22.575   1.543
   70   2HB   ASP  10          2HB       ASP  10  -5.095  21.675   0.387
   71    H    ASN  11           H        ASN  11  -4.453  23.395  -1.833
   72    HA   ASN  11           HA       ASN  11  -5.375  22.265  -4.410
   73   1HB   ASN  11          1HB       ASN  11  -3.985  24.414  -4.120
   74   2HB   ASN  11          2HB       ASN  11  -2.609  23.354  -3.814
   75   1HD2  ASN  11          1HD2      ASN  11  -1.735  22.218  -5.616
   76   2HD2  ASN  11          2HD2      ASN  11  -2.253  22.630  -7.278
   77    H    ALA  12           H        ALA  12  -5.530  20.300  -2.727
   78    HA   ALA  12           HA       ALA  12  -4.921  18.225  -2.063
   79   1HB   ALA  12          1HB       ALA  12  -4.011  16.779  -3.630
   80   2HB   ALA  12          2HB       ALA  12  -4.485  18.124  -4.677
   81   3HB   ALA  12          3HB       ALA  12  -2.797  17.957  -4.172
   82    H    THR  13           H        THR  13  -2.528  16.826  -1.762
   83    HA   THR  13           HA       THR  13  -0.511  18.605  -0.681
   84    HB   THR  13           HB       THR  13  -1.795  18.763   1.253
   85    HG1  THR  13           1HG      THR  13  -0.739  17.120   2.676
   86   1HG2  THR  13          1HG2      THR  13  -2.133  15.824   1.640
   87   2HG2  THR  13          2HG2      THR  13  -3.039  17.157   2.370
   88   3HG2  THR  13          3HG2      THR  13  -3.355  16.704   0.693
   89    HA   PRO  14           HA       PRO  14   1.867  15.102  -1.953
   90   1HB   PRO  14          1HB       PRO  14   4.254  15.584  -0.609
   91   2HB   PRO  14          2HB       PRO  14   3.741  16.368  -2.128
   92   1HG   PRO  14          1HG       PRO  14   3.766  17.488   0.632
   93   2HG   PRO  14          2HG       PRO  14   3.912  18.330  -0.931
   94   1HD   PRO  14          1HD       PRO  14   1.621  18.152   0.675
   95   2HD   PRO  14          2HD       PRO  14   1.653  18.697  -1.015
   96    H    GLU  15           H        GLU  15   1.081  15.738   1.367
   97    HA   GLU  15           HA       GLU  15   2.101  13.158   2.324
   98   1HB   GLU  15          1HB       GLU  15   2.095  15.321   3.661
   99   2HB   GLU  15          2HB       GLU  15   0.351  15.223   3.747
  100   1HG   GLU  15          1HG       GLU  15   1.676  12.705   4.614
  101   2HG   GLU  15          2HG       GLU  15   2.273  14.103   5.485
  102    H    GLN  16           H        GLN  16  -0.793  14.302   0.918
  103    HA   GLN  16           HA       GLN  16  -2.381  11.939   1.844
  104   1HB   GLN  16          1HB       GLN  16  -3.456  14.169   1.902
  105   2HB   GLN  16          2HB       GLN  16  -3.188  14.338   0.151
  106   1HG   GLN  16          1HG       GLN  16  -5.423  13.756   0.357
  107   2HG   GLN  16          2HG       GLN  16  -4.652  12.234  -0.077
  108   1HE2  GLN  16          1HE2      GLN  16  -7.062  13.392   1.818
  109   2HE2  GLN  16          2HE2      GLN  16  -6.871  12.247   3.155
  110    H    MET  17           H        MET  17  -0.953  13.429  -1.090
  111    HA   MET  17           HA       MET  17  -2.016  11.462  -2.944
  112   1HB   MET  17          1HB       MET  17  -0.300  13.861  -2.994
  113   2HB   MET  17          2HB       MET  17   0.352  12.602  -4.014
  114   1HG   MET  17          1HG       MET  17  -2.601  13.154  -4.222
  115   2HG   MET  17          2HG       MET  17  -1.485  14.361  -4.851
  116   1HE   MET  17          1HE       MET  17  -3.569  13.144  -6.802
  117   2HE   MET  17          2HE       MET  17  -2.289  14.296  -7.248
  118    H    ALA  18           H        ALA  18   1.146  11.785  -1.163
  119    HA   ALA  18           HA       ALA  18   2.193   9.369  -2.311
  120   1HB   ALA  18          1HB       ALA  18   3.577  11.157  -1.276
  121   2HB   ALA  18          2HB       ALA  18   2.864  10.786   0.305
  122   3HB   ALA  18          3HB       ALA  18   3.872   9.579  -0.523
  123    H    ARG  19           H        ARG  19  -0.146   9.972   0.188
  124    HA   ARG  19           HA       ARG  19   0.109   7.301   1.390
  125   1HB   ARG  19          1HB       ARG  19  -1.181   9.813   2.099
  126   2HB   ARG  19          2HB       ARG  19  -2.364   8.538   2.156
  127   1HG   ARG  19          1HG       ARG  19   0.385   8.308   3.455
  128   2HG   ARG  19          2HG       ARG  19  -1.010   8.951   4.305
  129   1HD   ARG  19          1HD       ARG  19  -1.159   6.219   2.965
  130   2HD   ARG  19          2HD       ARG  19  -0.379   6.421   4.543
  131    HE   ARG  19           HE       ARG  19  -3.014   7.642   4.421
  132   1HH1  ARG  19          2HH2      ARG  19  -1.405   4.584   5.008
  133   2HH1  ARG  19          1HH2      ARG  19  -2.561   4.055   6.193
  134   1HH2  ARG  19          2HH1      ARG  19  -4.605   6.861   5.802
  135   2HH2  ARG  19          1HH1      ARG  19  -4.385   5.332   6.594
  136    H    TYR  20           H        TYR  20  -2.281   8.961  -0.742
  137    HA   TYR  20           HA       TYR  20  -4.117   6.888  -1.066
  138   1HB   TYR  20          1HB       TYR  20  -3.146   9.262  -2.613
  139   2HB   TYR  20          2HB       TYR  20  -3.941   8.054  -3.558
  140    HD1  TYR  20           1HD      TYR  20  -6.213   7.069  -2.316
  141    HD2  TYR  20           2HD      TYR  20  -4.542  11.022  -1.979
  142    HE1  TYR  20           1HE      TYR  20  -8.442   7.940  -1.650
  143    HE2  TYR  20           2HE      TYR  20  -6.795  11.907  -1.312
  144    HH   TYR  20           HH       TYR  20  -9.613   9.765  -0.953
  145    H    TYR  21           H        TYR  21  -1.098   7.460  -2.894
  146    HA   TYR  21           HA       TYR  21  -1.318   5.105  -4.552
  147   1HB   TYR  21          1HB       TYR  21   0.829   7.134  -3.906
  148   2HB   TYR  21          2HB       TYR  21   1.222   5.679  -4.803
  149    HD1  TYR  21           1HD      TYR  21  -1.789   8.029  -5.051
  150    HD2  TYR  21           2HD      TYR  21   1.629   6.233  -6.984
  151    HE1  TYR  21           1HE      TYR  21  -2.442   9.083  -7.188
  152    HE2  TYR  21           2HE      TYR  21   0.993   7.333  -9.104
  153    HH   TYR  21           HH       TYR  21  -0.386   8.903 -10.078
  154    H    SER  22           H        SER  22   0.505   5.766  -1.484
  155    HA   SER  22           HA       SER  22   1.750   3.169  -1.388
  156   1HB   SER  22          1HB       SER  22   1.374   5.445   0.486
  157   2HB   SER  22          2HB       SER  22   1.446   3.872   1.267
  158    HG   SER  22           HG       SER  22   3.526   4.638   1.018
  159    H    ALA  23           H        ALA  23  -1.345   4.387  -0.082
  160    HA   ALA  23           HA       ALA  23  -2.141   1.963   1.193
  161   1HB   ALA  23          1HB       ALA  23  -3.123   4.277   1.568
  162   2HB   ALA  23          2HB       ALA  23  -3.951   4.112   0.007
  163   3HB   ALA  23          3HB       ALA  23  -4.308   2.981   1.318
  164    H    LEU  24           H        LEU  24  -2.461   3.121  -2.237
  165    HA   LEU  24           HA       LEU  24  -4.088   0.966  -3.136
  166   1HB   LEU  24          1HB       LEU  24  -3.935   2.843  -4.544
  167   2HB   LEU  24          2HB       LEU  24  -2.208   2.988  -4.349
  168    HG   LEU  24           HG       LEU  24  -1.956   0.820  -5.670
  169   1HD1  LEU  24          1HD1      LEU  24  -4.869   1.498  -6.264
  170   2HD1  LEU  24          2HD1      LEU  24  -3.866   0.443  -7.283
  171   3HD1  LEU  24          3HD1      LEU  24  -4.221  -0.017  -5.600
  172   1HD2  LEU  24          1HD2      LEU  24  -3.031   3.288  -7.042
  173   2HD2  LEU  24          2HD2      LEU  24  -1.340   2.960  -6.585
  174   3HD2  LEU  24          3HD2      LEU  24  -2.118   1.967  -7.823
  175    H    ARG  25           H        ARG  25  -0.486   1.364  -3.174
  176    HA   ARG  25           HA       ARG  25   0.004  -1.232  -4.216
  177   1HB   ARG  25          1HB       ARG  25   1.709   0.738  -3.737
  178   2HB   ARG  25          2HB       ARG  25   1.840   0.018  -2.133
  179   1HG   ARG  25          1HG       ARG  25   3.600  -0.995  -3.329
  180   2HG   ARG  25          2HG       ARG  25   2.344  -2.222  -3.355
  181   1HD   ARG  25          1HD       ARG  25   3.056  -2.207  -5.592
  182   2HD   ARG  25          2HD       ARG  25   1.639  -1.170  -5.652
  183    HE   ARG  25           HE       ARG  25   2.986   0.649  -6.167
  184   1HH1  ARG  25          2HH2      ARG  25   5.074  -1.944  -5.125
  185   2HH1  ARG  25          1HH2      ARG  25   6.550  -1.082  -5.447
  186   1HH2  ARG  25          2HH1      ARG  25   4.881   1.673  -6.799
  187   2HH2  ARG  25          1HH1      ARG  25   6.412   0.952  -6.396
  188    H    ARG  26           H        ARG  26  -0.455  -0.246  -0.847
  189    HA   ARG  26           HA       ARG  26  -0.020  -2.909   0.206
  190   1HB   ARG  26          1HB       ARG  26  -0.119  -0.433   1.350
  191   2HB   ARG  26          2HB       ARG  26  -1.727  -0.969   1.742
  192   1HG   ARG  26          1HG       ARG  26  -0.990  -2.397   3.328
  193   2HG   ARG  26          2HG       ARG  26   0.211  -3.128   2.280
  194   1HD   ARG  26          1HD       ARG  26   0.880  -0.358   3.214
  195   2HD   ARG  26          2HD       ARG  26   0.790  -1.595   4.456
  196    HE   ARG  26           HE       ARG  26   2.687  -2.596   3.675
  197   1HH1  ARG  26          2HH2      ARG  26   1.714  -0.373   1.121
  198   2HH1  ARG  26          1HH2      ARG  26   3.207  -0.599   0.253
  199   1HH2  ARG  26          2HH1      ARG  26   4.534  -2.863   2.523
  200   2HH2  ARG  26          1HH1      ARG  26   4.777  -1.982   1.047
  201    H    TYR  27           H        TYR  27  -3.048  -1.055  -0.358
  202    HA   TYR  27           HA       TYR  27  -4.924  -3.008   0.340
  203   1HB   TYR  27          1HB       TYR  27  -5.452  -0.658  -0.115
  204   2HB   TYR  27          2HB       TYR  27  -4.971  -0.845  -1.789
  205    HD1  TYR  27           1HD      TYR  27  -6.428  -1.855  -3.436
  206    HD2  TYR  27           2HD      TYR  27  -7.581  -1.573   0.704
  207    HE1  TYR  27           1HE      TYR  27  -8.781  -2.353  -4.059
  208    HE2  TYR  27           2HE      TYR  27  -9.946  -2.052   0.067
  209    HH   TYR  27           HH       TYR  27 -10.928  -2.524  -3.316
  210    H    ILE  28           H        ILE  28  -3.155  -2.600  -2.769
  211    HA   ILE  28           HA       ILE  28  -4.480  -4.877  -3.982
  212    HB   ILE  28           HB       ILE  28  -1.935  -3.349  -4.597
  213   2HG1  ILE  28          2HG1      ILE  28  -4.115  -2.238  -4.968
  214   1HG2  ILE  28          1HG2      ILE  28  -3.109  -5.685  -6.174
  215   2HG2  ILE  28          2HG2      ILE  28  -1.771  -4.635  -6.711
  216   3HG2  ILE  28          3HG2      ILE  28  -1.543  -5.685  -5.329
  217   1HD1  ILE  28          1HD1      ILE  28  -4.074  -1.759  -7.326
  218   2HD1  ILE  28          2HD1      ILE  28  -2.392  -1.850  -6.733
  219   3HD1  ILE  28          3HD1      ILE  28  -3.116  -3.184  -7.677
  220    H    ASN  29           H        ASN  29  -1.388  -4.572  -2.181
  221    HA   ASN  29           HA       ASN  29  -0.642  -7.305  -2.370
  222   1HB   ASN  29          1HB       ASN  29   0.337  -4.963  -1.045
  223   2HB   ASN  29          2HB       ASN  29   0.106  -6.158   0.215
  224   1HD2  ASN  29          1HD2      ASN  29   1.280  -8.268  -0.022
  225   2HD2  ASN  29          2HD2      ASN  29   2.683  -8.263  -1.097
  226    H    MET  30           H        MET  30  -2.711  -5.667   0.062
  227    HA   MET  30           HA       MET  30  -3.182  -8.111   1.535
  228   1HB   MET  30          1HB       MET  30  -4.707  -6.765   2.856
  229   2HB   MET  30          2HB       MET  30  -3.100  -6.061   2.705
  230   1HG   MET  30          1HG       MET  30  -3.897  -4.221   1.766
  231   2HG   MET  30          2HG       MET  30  -4.978  -5.124   0.711
  232   1HE   MET  30          1HE       MET  30  -8.194  -5.508   2.295
  233   2HE   MET  30          2HE       MET  30  -6.836  -6.532   1.802
  234    H    LEU  31           H        LEU  31  -4.926  -6.498  -1.112
  235    HA   LEU  31           HA       LEU  31  -7.314  -8.095  -0.893
  236   1HB   LEU  31          1HB       LEU  31  -6.046  -6.321  -2.981
  237   2HB   LEU  31          2HB       LEU  31  -7.377  -7.303  -3.417
  238    HG   LEU  31           HG       LEU  31  -7.593  -4.758  -2.510
  239   1HD1  LEU  31          1HD1      LEU  31  -9.342  -5.942  -3.665
  240   2HD1  LEU  31          2HD1      LEU  31  -9.647  -6.971  -2.255
  241   3HD1  LEU  31          3HD1      LEU  31 -10.011  -5.231  -2.194
  242   1HD2  LEU  31          1HD2      LEU  31  -8.486  -6.387  -0.104
  243   2HD2  LEU  31          2HD2      LEU  31  -7.019  -5.384  -0.149
  244   3HD2  LEU  31          3HD2      LEU  31  -8.588  -4.632  -0.330
  245    H    THR  32           H        THR  32  -4.398  -8.371  -2.856
  246    HA   THR  32           HA       THR  32  -5.303 -11.038  -3.808
  247    HB   THR  32           HB       THR  32  -4.135  -9.059  -5.169
  248    HG1  THR  32           1HG      THR  32  -5.033 -10.871  -6.030
  249   1HG2  THR  32          1HG2      THR  32  -1.776 -10.916  -4.838
  250   2HG2  THR  32          2HG2      THR  32  -1.864  -9.329  -5.624
  251   3HG2  THR  32          3HG2      THR  32  -1.917  -9.436  -3.860
  252    H    ARG  33           H        ARG  33  -3.742 -10.020  -1.122
  253    HA   ARG  33           HA       ARG  33  -1.640 -11.774  -0.594
  254   1HB   ARG  33          1HB       ARG  33  -3.355 -10.060   0.911
  255   2HB   ARG  33          2HB       ARG  33  -3.364 -11.580   1.752
  256   1HG   ARG  33          1HG       ARG  33  -0.990 -11.593   2.018
  257   2HG   ARG  33          2HG       ARG  33  -0.785 -10.158   1.000
  258   1HD   ARG  33          1HD       ARG  33  -1.408  -8.712   2.626
  259   2HD   ARG  33          2HD       ARG  33  -2.705  -9.758   3.240
  260    HE   ARG  33           HE       ARG  33  -0.492 -11.093   4.049
  261   1HH1  ARG  33          2HH2      ARG  33  -1.429  -7.755   4.540
  262   2HH1  ARG  33          1HH2      ARG  33  -0.565  -7.611   6.048
  263   1HH2  ARG  33          2HH1      ARG  33   0.622 -10.874   5.959
  264   2HH2  ARG  33          1HH1      ARG  33   0.584  -9.380   6.832
  265    HA   PRO  34           HA       PRO  34  -4.507 -15.293   0.711
  266   1HB   PRO  34          1HB       PRO  34  -7.225 -15.202   0.236
  267   2HB   PRO  34          2HB       PRO  34  -6.436 -14.672   1.749
  268   1HG   PRO  34          1HG       PRO  34  -7.584 -12.999  -0.444
  269   2HG   PRO  34          2HG       PRO  34  -7.367 -12.616   1.286
  270   1HD   PRO  34          1HD       PRO  34  -5.727 -11.830  -0.890
  271   2HD   PRO  34          2HD       PRO  34  -5.390 -11.592   0.840
  272    H    ARG  35           H        ARG  35  -3.573 -16.467  -0.855
  273    HA   ARG  35           HA       ARG  35  -5.121 -17.365  -3.088
  274   1HB   ARG  35          1HB       ARG  35  -3.736 -15.024  -3.633
  275   2HB   ARG  35          2HB       ARG  35  -2.604 -16.228  -4.221
  276   1HG   ARG  35          1HG       ARG  35  -4.281 -17.195  -5.686
  277   2HG   ARG  35          2HG       ARG  35  -5.568 -16.269  -4.905
  278   1HD   ARG  35          1HD       ARG  35  -3.656 -14.340  -5.770
  279   2HD   ARG  35          2HD       ARG  35  -3.836 -15.474  -7.103
  280    HE   ARG  35           HE       ARG  35  -5.782 -13.575  -6.082
  281   1HH1  ARG  35          2HH2      ARG  35  -5.572 -16.618  -7.762
  282   2HH1  ARG  35          1HH2      ARG  35  -7.096 -16.461  -8.571
  283   1HH2  ARG  35          2HH1      ARG  35  -7.810 -13.382  -7.062
  284   2HH2  ARG  35          1HH1      ARG  35  -8.418 -14.662  -8.053
  285    H    TYR  36           H        TYR  36  -4.799 -19.290  -2.033
  286    HA   TYR  36           HA       TYR  36  -2.030 -20.398  -1.973
  287   1HB   TYR  36          1HB       TYR  36  -3.841 -20.271   0.050
  288   2HB   TYR  36          2HB       TYR  36  -4.290 -21.822  -0.630
  289    HD1  TYR  36           1HD      TYR  36  -3.027 -23.744   0.027
  290    HD2  TYR  36           2HD      TYR  36  -1.344 -19.812   0.522
  291    HE1  TYR  36           1HE      TYR  36  -1.136 -24.719   1.314
  292    HE2  TYR  36           2HE      TYR  36   0.565 -20.792   1.817
  293    HH   TYR  36           HH       TYR  36   0.733 -24.286   2.479
  294   1HN   NH2  37          1HN       NH2  37  -1.542 -22.489  -2.931
  295   2HN   NH2  37          2HN       NH2  37  -2.710 -23.131  -4.096
  Start of MODEL    6
    1   1H    ALA   1          1H        ALA   1 -23.773  15.984 -21.092
    2   2H    ALA   1          2H        ALA   1 -22.649  16.223 -19.896
    3   3H    ALA   1          3H        ALA   1 -22.275  15.293 -21.189
    4    HA   ALA   1           HA       ALA   1 -24.546  14.539 -19.548
    5   1HB   ALA   1          1HB       ALA   1 -23.891  13.388 -21.755
    6   2HB   ALA   1          2HB       ALA   1 -22.441  12.816 -20.924
    7   3HB   ALA   1          3HB       ALA   1 -24.046  12.323 -20.358
    8    HA   PRO   2           HA       PRO   2 -21.912  14.088 -15.984
    9   1HB   PRO   2          1HB       PRO   2 -23.152  12.146 -14.516
   10   2HB   PRO   2          2HB       PRO   2 -23.852  13.761 -14.795
   11   1HG   PRO   2          1HG       PRO   2 -24.548  11.158 -16.140
   12   2HG   PRO   2          2HG       PRO   2 -25.622  12.514 -15.665
   13   1HD   PRO   2          1HD       PRO   2 -24.561  12.034 -18.226
   14   2HD   PRO   2          2HD       PRO   2 -25.279  13.583 -17.678
   15    H    LEU   3           H        LEU   3 -20.467  13.306 -17.833
   16    HA   LEU   3           HA       LEU   3 -19.634  10.512 -17.943
   17   1HB   LEU   3          1HB       LEU   3 -18.299  13.107 -18.837
   18   2HB   LEU   3          2HB       LEU   3 -17.717  11.494 -19.249
   19    HG   LEU   3           HG       LEU   3 -20.577  12.019 -19.963
   20   1HD1  LEU   3          1HD1      LEU   3 -19.831  14.162 -20.627
   21   2HD1  LEU   3          2HD1      LEU   3 -18.292  13.538 -21.249
   22   3HD1  LEU   3          3HD1      LEU   3 -19.803  13.178 -22.106
   23   1HD2  LEU   3          1HD2      LEU   3 -18.353  10.912 -21.690
   24   2HD2  LEU   3          2HD2      LEU   3 -19.268   9.924 -20.528
   25   3HD2  LEU   3          3HD2      LEU   3 -20.110  10.714 -21.864
   26    H    GLU   4           H        GLU   4 -17.178  10.071 -17.480
   27    HA   GLU   4           HA       GLU   4 -16.697  10.120 -14.769
   28   1HB   GLU   4          1HB       GLU   4 -14.704  10.023 -17.075
   29   2HB   GLU   4          2HB       GLU   4 -14.272   9.737 -15.394
   30   1HG   GLU   4          1HG       GLU   4 -14.735   7.574 -15.719
   31   2HG   GLU   4          2HG       GLU   4 -16.420   8.028 -15.675
   32    HA   PRO   5           HA       PRO   5 -15.607  14.228 -13.675
   33   1HB   PRO   5          1HB       PRO   5 -14.015  13.822 -11.428
   34   2HB   PRO   5          2HB       PRO   5 -15.801  13.775 -11.461
   35   1HG   PRO   5          1HG       PRO   5 -13.859  11.504 -11.361
   36   2HG   PRO   5          2HG       PRO   5 -15.526  11.595 -10.720
   37   1HD   PRO   5          1HD       PRO   5 -14.716  10.334 -13.106
   38   2HD   PRO   5          2HD       PRO   5 -16.396  10.777 -12.679
   39    H    VAL   6           H        VAL   6 -14.244  15.492 -14.706
   40    HA   VAL   6           HA       VAL   6 -11.830  14.779 -15.971
   41    HB   VAL   6           HB       VAL   6 -11.353  17.157 -16.163
   42   1HG1  VAL   6          1HG1      VAL   6 -13.278  17.865 -17.389
   43   2HG1  VAL   6          2HG1      VAL   6 -13.147  16.105 -17.579
   44   3HG1  VAL   6          3HG1      VAL   6 -14.356  16.795 -16.471
   45   1HG2  VAL   6          1HG2      VAL   6 -12.904  18.864 -15.130
   46   2HG2  VAL   6          2HG2      VAL   6 -13.555  17.574 -14.096
   47   3HG2  VAL   6          3HG2      VAL   6 -11.851  18.045 -13.975
   48    H    TYR   7           H        TYR   7  -9.660  15.216 -15.483
   49    HA   TYR   7           HA       TYR   7  -8.428  14.154 -13.486
   50   1HB   TYR   7          1HB       TYR   7  -7.667  16.674 -14.925
   51   2HB   TYR   7          2HB       TYR   7  -6.612  16.008 -13.695
   52    HD1  TYR   7           1HD      TYR   7  -7.320  15.897 -17.173
   53    HD2  TYR   7           2HD      TYR   7  -6.065  13.456 -13.845
   54    HE1  TYR   7           1HE      TYR   7  -6.197  14.321 -18.741
   55    HE2  TYR   7           2HE      TYR   7  -4.965  11.865 -15.424
   56    HH   TYR   7           HH       TYR   7  -4.345  12.623 -18.680
   57    HA   PRO   8           HA       PRO   8 -10.013  16.676 -10.046
   58   1HB   PRO   8          1HB       PRO   8 -10.288  14.687  -8.160
   59   2HB   PRO   8          2HB       PRO   8 -11.477  15.036  -9.439
   60   1HG   PRO   8          1HG       PRO   8  -9.464  12.812  -9.306
   61   2HG   PRO   8          2HG       PRO   8 -11.103  12.828 -10.031
   62   1HD   PRO   8          1HD       PRO   8  -8.668  13.119 -11.418
   63   2HD   PRO   8          2HD       PRO   8 -10.283  13.533 -12.052
   64    H    GLY   9           H        GLY   9  -7.130  15.088 -10.486
   65   1HA   GLY   9          1HA       GLY   9  -5.754  15.623  -7.974
   66   2HA   GLY   9          2HA       GLY   9  -5.025  15.134  -9.511
   67    H    ASP  10           H        ASP  10  -4.342  16.701 -10.963
   68    HA   ASP  10           HA       ASP  10  -3.139  18.555 -11.425
   69   1HB   ASP  10          1HB       ASP  10  -5.732  18.675 -12.162
   70   2HB   ASP  10          2HB       ASP  10  -5.669  20.162 -11.237
   71    H    ASN  11           H        ASN  11  -1.782  18.752  -9.597
   72    HA   ASN  11           HA       ASN  11  -0.860  19.666  -7.725
   73   1HB   ASN  11          1HB       ASN  11  -1.917  21.926  -9.216
   74   2HB   ASN  11          2HB       ASN  11  -2.013  22.255  -7.504
   75   1HD2  ASN  11          1HD2      ASN  11   0.101  22.110 -10.212
   76   2HD2  ASN  11          2HD2      ASN  11   1.568  22.409  -9.276
   77    H    ALA  12           H        ALA  12  -1.929  18.047  -6.546
   78    HA   ALA  12           HA       ALA  12  -4.057  19.032  -4.713
   79   1HB   ALA  12          1HB       ALA  12  -4.693  16.579  -4.516
   80   2HB   ALA  12          2HB       ALA  12  -5.027  17.335  -6.073
   81   3HB   ALA  12          3HB       ALA  12  -3.619  16.264  -5.894
   82    H    THR  13           H        THR  13  -4.051  17.488  -2.736
   83    HA   THR  13           HA       THR  13  -2.059  18.373  -1.036
   84    HB   THR  13           HB       THR  13  -3.014  16.696   0.514
   85    HG1  THR  13           1HG      THR  13  -4.976  15.702  -0.280
   86   1HG2  THR  13          1HG2      THR  13  -5.217  18.207  -0.948
   87   2HG2  THR  13          2HG2      THR  13  -5.133  17.783   0.773
   88   3HG2  THR  13          3HG2      THR  13  -4.034  19.012   0.110
   89    HA   PRO  14           HA       PRO  14   0.973  15.432  -2.637
   90   1HB   PRO  14          1HB       PRO  14   3.234  16.438  -1.366
   91   2HB   PRO  14          2HB       PRO  14   2.533  17.026  -2.898
   92   1HG   PRO  14          1HG       PRO  14   2.393  18.262  -0.193
   93   2HG   PRO  14          2HG       PRO  14   2.261  19.029  -1.795
   94   1HD   PRO  14          1HD       PRO  14   0.141  18.379  -0.020
   95   2HD   PRO  14          2HD       PRO  14  -0.055  18.876  -1.708
   96    H    GLU  15           H        GLU  15   1.005  16.285   0.782
   97    HA   GLU  15           HA       GLU  15   2.290  13.920   1.755
   98   1HB   GLU  15          1HB       GLU  15   1.784  16.421   2.726
   99   2HB   GLU  15          2HB       GLU  15   0.460  15.581   3.513
  100   1HG   GLU  15          1HG       GLU  15   1.914  14.334   4.878
  101   2HG   GLU  15          2HG       GLU  15   3.236  14.396   3.711
  102    H    GLN  16           H        GLN  16  -0.886  14.494   0.752
  103    HA   GLN  16           HA       GLN  16  -1.946  12.001   1.992
  104   1HB   GLN  16          1HB       GLN  16  -3.367  13.871   2.375
  105   2HB   GLN  16          2HB       GLN  16  -3.200  14.423   0.720
  106   1HG   GLN  16          1HG       GLN  16  -5.406  13.519   1.052
  107   2HG   GLN  16          2HG       GLN  16  -4.533  12.527  -0.097
  108   1HE2  GLN  16          1HE2      GLN  16  -6.673  11.262   0.832
  109   2HE2  GLN  16          2HE2      GLN  16  -6.220  10.146   2.118
  110    H    MET  17           H        MET  17  -0.959  13.420  -1.139
  111    HA   MET  17           HA       MET  17  -2.065  11.383  -2.836
  112   1HB   MET  17          1HB       MET  17  -0.181  13.692  -3.019
  113   2HB   MET  17          2HB       MET  17   0.150  12.406  -4.133
  114   1HG   MET  17          1HG       MET  17  -2.720  13.221  -3.909
  115   2HG   MET  17          2HG       MET  17  -1.624  14.404  -4.618
  116   1HE   MET  17          1HE       MET  17  -4.120  11.798  -5.963
  117   2HE   MET  17          2HE       MET  17  -3.970  13.570  -6.056
  118    H    ALA  18           H        ALA  18   1.190  11.874  -1.329
  119    HA   ALA  18           HA       ALA  18   2.267   9.407  -2.306
  120   1HB   ALA  18          1HB       ALA  18   4.061  10.432  -1.405
  121   2HB   ALA  18          2HB       ALA  18   3.057  11.536  -0.450
  122   3HB   ALA  18          3HB       ALA  18   3.484   9.947   0.198
  123    H    ARG  19           H        ARG  19   0.002  10.056   0.221
  124    HA   ARG  19           HA       ARG  19   0.262   7.417   1.453
  125   1HB   ARG  19          1HB       ARG  19  -0.939   9.942   2.190
  126   2HB   ARG  19          2HB       ARG  19  -2.204   8.726   2.219
  127   1HG   ARG  19          1HG       ARG  19   0.534   8.404   3.525
  128   2HG   ARG  19          2HG       ARG  19  -0.867   9.050   4.369
  129   1HD   ARG  19          1HD       ARG  19  -1.247   6.386   3.003
  130   2HD   ARG  19          2HD       ARG  19  -0.154   6.395   4.373
  131    HE   ARG  19           HE       ARG  19  -3.025   6.605   4.450
  132   1HH1  ARG  19          2HH2      ARG  19  -0.184   7.669   6.165
  133   2HH1  ARG  19          1HH2      ARG  19  -1.014   7.918   7.676
  134   1HH2  ARG  19          2HH1      ARG  19  -4.091   6.891   6.439
  135   2HH2  ARG  19          1HH1      ARG  19  -3.185   7.436   7.820
  136    H    TYR  20           H        TYR  20  -2.222   9.014  -0.626
  137    HA   TYR  20           HA       TYR  20  -3.985   6.881  -0.904
  138   1HB   TYR  20          1HB       TYR  20  -3.136   9.266  -2.528
  139   2HB   TYR  20          2HB       TYR  20  -4.012   8.030  -3.372
  140    HD1  TYR  20           1HD      TYR  20  -6.118   7.091  -1.621
  141    HD2  TYR  20           2HD      TYR  20  -4.559  11.076  -2.174
  142    HE1  TYR  20           1HE      TYR  20  -8.269   8.040  -0.836
  143    HE2  TYR  20           2HE      TYR  20  -6.754  12.028  -1.473
  144    HH   TYR  20           HH       TYR  20  -9.327  10.001  -0.127
  145    H    TYR  21           H        TYR  21  -1.083   7.581  -2.910
  146    HA   TYR  21           HA       TYR  21  -1.298   5.263  -4.584
  147   1HB   TYR  21          1HB       TYR  21   0.864   7.232  -3.842
  148   2HB   TYR  21          2HB       TYR  21   1.306   5.771  -4.697
  149    HD1  TYR  21           1HD      TYR  21  -1.053   8.715  -4.969
  150    HD2  TYR  21           2HD      TYR  21   1.116   5.590  -7.008
  151    HE1  TYR  21           1HE      TYR  21  -1.594   9.762  -7.156
  152    HE2  TYR  21           2HE      TYR  21   0.601   6.661  -9.189
  153    HH   TYR  21           HH       TYR  21  -0.062   8.703 -10.126
  154    H    SER  22           H        SER  22   0.465   5.798  -1.510
  155    HA   SER  22           HA       SER  22   1.715   3.203  -1.493
  156   1HB   SER  22          1HB       SER  22   2.396   5.212  -0.090
  157   2HB   SER  22          2HB       SER  22   1.000   4.864   0.953
  158    HG   SER  22           HG       SER  22   1.990   2.626   0.973
  159    H    ALA  23           H        ALA  23  -1.384   4.435  -0.224
  160    HA   ALA  23           HA       ALA  23  -2.219   2.024   1.062
  161   1HB   ALA  23          1HB       ALA  23  -3.225   4.525   1.084
  162   2HB   ALA  23          2HB       ALA  23  -4.268   3.839  -0.178
  163   3HB   ALA  23          3HB       ALA  23  -4.205   3.094   1.433
  164    H    LEU  24           H        LEU  24  -2.671   3.223  -2.354
  165    HA   LEU  24           HA       LEU  24  -4.225   1.033  -3.273
  166   1HB   LEU  24          1HB       LEU  24  -4.115   2.877  -4.704
  167   2HB   LEU  24          2HB       LEU  24  -2.405   3.123  -4.456
  168    HG   LEU  24           HG       LEU  24  -1.969   1.030  -5.806
  169   1HD1  LEU  24          1HD1      LEU  24  -3.722   0.358  -7.403
  170   2HD1  LEU  24          2HD1      LEU  24  -4.280   0.081  -5.745
  171   3HD1  LEU  24          3HD1      LEU  24  -4.866   1.483  -6.662
  172   1HD2  LEU  24          1HD2      LEU  24  -1.511   3.192  -6.724
  173   2HD2  LEU  24          2HD2      LEU  24  -2.289   2.204  -7.968
  174   3HD2  LEU  24          3HD2      LEU  24  -3.225   3.453  -7.112
  175    H    ARG  25           H        ARG  25  -0.638   1.398  -3.113
  176    HA   ARG  25           HA       ARG  25  -0.099  -1.199  -4.166
  177   1HB   ARG  25          1HB       ARG  25   1.397   1.016  -2.984
  178   2HB   ARG  25          2HB       ARG  25   1.964  -0.490  -2.281
  179   1HG   ARG  25          1HG       ARG  25   1.670   0.037  -5.269
  180   2HG   ARG  25          2HG       ARG  25   3.181   0.206  -4.378
  181   1HD   ARG  25          1HD       ARG  25   1.851  -2.431  -3.988
  182   2HD   ARG  25          2HD       ARG  25   2.278  -2.087  -5.668
  183    HE   ARG  25           HE       ARG  25   4.501  -1.460  -3.997
  184   1HH1  ARG  25          2HH2      ARG  25   2.756  -4.257  -5.139
  185   2HH1  ARG  25          1HH2      ARG  25   4.119  -5.328  -5.083
  186   1HH2  ARG  25          2HH1      ARG  25   6.292  -2.821  -3.983
  187   2HH2  ARG  25          1HH1      ARG  25   6.099  -4.513  -4.375
  188    H    ARG  26           H        ARG  26  -0.354  -0.171  -0.758
  189    HA   ARG  26           HA       ARG  26   0.036  -2.811   0.301
  190   1HB   ARG  26          1HB       ARG  26   0.078  -0.416   1.439
  191   2HB   ARG  26          2HB       ARG  26  -1.630  -0.721   1.726
  192   1HG   ARG  26          1HG       ARG  26  -0.104  -3.100   2.471
  193   2HG   ARG  26          2HG       ARG  26   0.723  -1.698   3.105
  194   1HD   ARG  26          1HD       ARG  26  -1.997  -1.252   3.781
  195   2HD   ARG  26          2HD       ARG  26  -1.779  -2.981   3.962
  196    HE   ARG  26           HE       ARG  26  -0.327  -2.631   5.748
  197   1HH1  ARG  26          2HH2      ARG  26  -0.889   0.445   4.180
  198   2HH1  ARG  26          1HH2      ARG  26  -0.067   1.373   5.407
  199   1HH2  ARG  26          2HH1      ARG  26   0.739  -1.422   7.303
  200   2HH2  ARG  26          1HH1      ARG  26   0.827   0.314   7.169
  201    H    TYR  27           H        TYR  27  -2.929  -1.103  -0.655
  202    HA   TYR  27           HA       TYR  27  -4.854  -2.951   0.290
  203   1HB   TYR  27          1HB       TYR  27  -5.344  -0.654  -0.396
  204   2HB   TYR  27          2HB       TYR  27  -4.838  -1.005  -2.045
  205    HD1  TYR  27           1HD      TYR  27  -7.161  -2.588   0.465
  206    HD2  TYR  27           2HD      TYR  27  -6.620  -1.061  -3.536
  207    HE1  TYR  27           1HE      TYR  27  -9.545  -3.114  -0.066
  208    HE2  TYR  27           2HE      TYR  27  -8.986  -1.573  -4.057
  209    HH   TYR  27           HH       TYR  27 -11.035  -2.188  -3.125
  210    H    ILE  28           H        ILE  28  -3.273  -2.674  -2.955
  211    HA   ILE  28           HA       ILE  28  -4.445  -5.017  -4.078
  212    HB   ILE  28           HB       ILE  28  -1.803  -3.620  -4.598
  213   2HG1  ILE  28          2HG1      ILE  28  -4.055  -2.517  -5.167
  214   1HG2  ILE  28          1HG2      ILE  28  -2.795  -6.246  -5.671
  215   2HG2  ILE  28          2HG2      ILE  28  -2.178  -5.132  -6.872
  216   3HG2  ILE  28          3HG2      ILE  28  -1.144  -5.609  -5.520
  217   1HD1  ILE  28          1HD1      ILE  28  -2.040  -1.748  -6.298
  218   2HD1  ILE  28          2HD1      ILE  28  -2.130  -3.075  -7.471
  219   3HD1  ILE  28          3HD1      ILE  28  -3.391  -1.847  -7.457
  220    H    ASN  29           H        ASN  29  -1.378  -4.692  -2.192
  221    HA   ASN  29           HA       ASN  29  -0.742  -7.462  -2.227
  222   1HB   ASN  29          1HB       ASN  29   0.738  -5.546  -1.452
  223   2HB   ASN  29          2HB       ASN  29  -0.175  -5.535   0.064
  224   1HD2  ASN  29          1HD2      ASN  29   1.787  -6.126   1.297
  225   2HD2  ASN  29          2HD2      ASN  29   2.396  -7.766   1.107
  226    H    MET  30           H        MET  30  -2.703  -5.635   0.184
  227    HA   MET  30           HA       MET  30  -3.365  -7.840   1.831
  228   1HB   MET  30          1HB       MET  30  -3.761  -5.308   2.227
  229   2HB   MET  30          2HB       MET  30  -5.233  -5.501   1.266
  230   1HG   MET  30          1HG       MET  30  -5.578  -7.580   2.981
  231   2HG   MET  30          2HG       MET  30  -4.498  -6.606   3.968
  232   1HE   MET  30          1HE       MET  30  -7.792  -6.175   1.681
  233   2HE   MET  30          2HE       MET  30  -7.929  -7.451   2.910
  234    H    LEU  31           H        LEU  31  -5.155  -6.567  -1.052
  235    HA   LEU  31           HA       LEU  31  -7.234  -8.525  -1.052
  236   1HB   LEU  31          1HB       LEU  31  -5.964  -6.610  -3.049
  237   2HB   LEU  31          2HB       LEU  31  -7.178  -7.748  -3.569
  238    HG   LEU  31           HG       LEU  31  -7.646  -5.699  -1.354
  239   1HD1  LEU  31          1HD1      LEU  31  -9.080  -4.684  -3.249
  240   2HD1  LEU  31          2HD1      LEU  31  -7.326  -4.460  -3.310
  241   3HD1  LEU  31          3HD1      LEU  31  -8.111  -5.665  -4.355
  242   1HD2  LEU  31          1HD2      LEU  31  -9.242  -7.357  -0.967
  243   2HD2  LEU  31          2HD2      LEU  31 -10.103  -6.305  -2.095
  244   3HD2  LEU  31          3HD2      LEU  31  -9.361  -7.809  -2.683
  245    H    THR  32           H        THR  32  -3.924  -8.685  -2.053
  246    HA   THR  32           HA       THR  32  -4.356 -11.271  -3.464
  247    HB   THR  32           HB       THR  32  -1.784  -9.687  -3.515
  248    HG1  THR  32           1HG      THR  32  -3.355  -8.282  -4.191
  249   1HG2  THR  32          1HG2      THR  32  -3.121 -11.495  -5.591
  250   2HG2  THR  32          2HG2      THR  32  -1.512 -10.750  -5.702
  251   3HG2  THR  32          3HG2      THR  32  -1.811 -12.023  -4.519
  252    H    ARG  33           H        ARG  33  -4.236 -10.680  -0.433
  253    HA   ARG  33           HA       ARG  33  -2.047 -11.975   0.766
  254   1HB   ARG  33          1HB       ARG  33  -4.905 -11.538   1.495
  255   2HB   ARG  33          2HB       ARG  33  -4.217 -12.997   2.171
  256   1HG   ARG  33          1HG       ARG  33  -2.244 -11.458   2.964
  257   2HG   ARG  33          2HG       ARG  33  -3.407 -10.143   2.675
  258   1HD   ARG  33          1HD       ARG  33  -4.940 -12.042   4.034
  259   2HD   ARG  33          2HD       ARG  33  -3.341 -12.274   4.757
  260    HE   ARG  33           HE       ARG  33  -3.851  -9.512   4.773
  261   1HH1  ARG  33          2HH2      ARG  33  -5.369 -12.320   6.177
  262   2HH1  ARG  33          1HH2      ARG  33  -5.994 -11.454   7.553
  263   1HH2  ARG  33          2HH1      ARG  33  -4.699  -8.394   6.550
  264   2HH2  ARG  33          1HH1      ARG  33  -5.632  -9.253   7.725
  265    HA   PRO  34           HA       PRO  34  -3.766 -16.312   0.080
  266   1HB   PRO  34          1HB       PRO  34  -5.945 -16.839  -1.503
  267   2HB   PRO  34          2HB       PRO  34  -6.034 -16.462   0.240
  268   1HG   PRO  34          1HG       PRO  34  -6.650 -14.678  -2.102
  269   2HG   PRO  34          2HG       PRO  34  -7.388 -14.707  -0.473
  270   1HD   PRO  34          1HD       PRO  34  -5.408 -12.934  -1.390
  271   2HD   PRO  34          2HD       PRO  34  -5.868 -13.199   0.311
  272    H    ARG  35           H        ARG  35  -1.899 -16.424  -0.981
  273    HA   ARG  35           HA       ARG  35  -1.955 -17.413  -3.690
  274   1HB   ARG  35          1HB       ARG  35  -1.710 -14.674  -3.722
  275   2HB   ARG  35          2HB       ARG  35  -0.024 -15.111  -3.522
  276   1HG   ARG  35          1HG       ARG  35  -0.341 -14.975  -5.859
  277   2HG   ARG  35          2HG       ARG  35  -0.342 -16.709  -5.527
  278   1HD   ARG  35          1HD       ARG  35  -3.063 -15.801  -5.276
  279   2HD   ARG  35          2HD       ARG  35  -2.397 -15.002  -6.702
  280    HE   ARG  35           HE       ARG  35  -1.842 -17.870  -6.602
  281   1HH1  ARG  35          2HH2      ARG  35  -4.275 -15.561  -7.562
  282   2HH1  ARG  35          1HH2      ARG  35  -5.027 -16.636  -8.709
  283   1HH2  ARG  35          2HH1      ARG  35  -2.762 -19.225  -8.075
  284   2HH2  ARG  35          1HH1      ARG  35  -4.214 -18.772  -8.930
  285    H    TYR  36           H        TYR  36   0.019 -16.214  -1.050
  286    HA   TYR  36           HA       TYR  36   2.402 -17.688  -1.650
  287   1HB   TYR  36          1HB       TYR  36   1.745 -15.572  -0.033
  288   2HB   TYR  36          2HB       TYR  36   1.848 -16.838   1.168
  289    HD1  TYR  36           1HD      TYR  36   3.631 -14.481  -0.834
  290    HD2  TYR  36           2HD      TYR  36   4.081 -18.267   1.181
  291    HE1  TYR  36           1HE      TYR  36   6.113 -14.206  -0.861
  292    HE2  TYR  36           2HE      TYR  36   6.559 -18.020   1.080
  293    HH   TYR  36           HH       TYR  36   8.304 -16.786  -0.105
  294   1HN   NH2  37          1HN       NH2  37   3.075 -19.793  -0.991
  295   2HN   NH2  37          2HN       NH2  37   2.040 -20.772   0.058
  Start of MODEL    7
    1   1H    ALA   1          1H        ALA   1 -15.569   1.300 -13.239
    2   2H    ALA   1          2H        ALA   1 -15.428   0.871 -14.815
    3   3H    ALA   1          3H        ALA   1 -15.980  -0.227 -13.716
    4    HA   ALA   1           HA       ALA   1 -13.715   0.308 -12.586
    5   1HB   ALA   1          1HB       ALA   1 -14.694  -1.908 -14.102
    6   2HB   ALA   1          2HB       ALA   1 -13.003  -1.628 -14.577
    7   3HB   ALA   1          3HB       ALA   1 -13.400  -1.859 -12.880
    8    HA   PRO   2           HA       PRO   2 -11.187   1.711 -16.326
    9   1HB   PRO   2          1HB       PRO   2 -12.336   1.998 -18.821
   10   2HB   PRO   2          2HB       PRO   2 -11.554   0.497 -18.252
   11   1HG   PRO   2          1HG       PRO   2 -14.464   1.106 -18.545
   12   2HG   PRO   2          2HG       PRO   2 -13.613  -0.465 -18.637
   13   1HD   PRO   2          1HD       PRO   2 -15.034   0.644 -16.445
   14   2HD   PRO   2          2HD       PRO   2 -14.070  -0.857 -16.441
   15    H    LEU   3           H        LEU   3 -11.173   3.769 -17.704
   16    HA   LEU   3           HA       LEU   3 -11.387   5.977 -17.864
   17   1HB   LEU   3          1HB       LEU   3 -13.392   5.845 -18.884
   18   2HB   LEU   3          2HB       LEU   3 -14.267   5.209 -17.525
   19    HG   LEU   3           HG       LEU   3 -13.277   8.018 -17.201
   20   1HD1  LEU   3          1HD1      LEU   3 -15.092   7.177 -19.391
   21   2HD1  LEU   3          2HD1      LEU   3 -15.696   8.490 -18.364
   22   3HD1  LEU   3          3HD1      LEU   3 -14.126   8.651 -19.162
   23   1HD2  LEU   3          1HD2      LEU   3 -15.467   8.226 -16.061
   24   2HD2  LEU   3          2HD2      LEU   3 -15.861   6.545 -16.502
   25   3HD2  LEU   3          3HD2      LEU   3 -14.520   6.893 -15.395
   26    H    GLU   4           H        GLU   4 -10.849   7.747 -16.669
   27    HA   GLU   4           HA       GLU   4 -10.368   7.249 -13.885
   28   1HB   GLU   4          1HB       GLU   4 -10.034   9.717 -15.635
   29   2HB   GLU   4          2HB       GLU   4  -9.691   9.724 -13.913
   30   1HG   GLU   4          1HG       GLU   4  -7.597   9.216 -14.696
   31   2HG   GLU   4          2HG       GLU   4  -8.220   7.606 -14.372
   32    HA   PRO   5           HA       PRO   5 -14.103   8.667 -12.084
   33   1HB   PRO   5          1HB       PRO   5 -13.284   9.441  -9.538
   34   2HB   PRO   5          2HB       PRO   5 -13.401   7.768 -10.124
   35   1HG   PRO   5          1HG       PRO   5 -10.958   9.477  -9.799
   36   2HG   PRO   5          2HG       PRO   5 -11.152   7.706  -9.587
   37   1HD   PRO   5          1HD       PRO   5 -10.078   8.994 -11.837
   38   2HD   PRO   5          2HD       PRO   5 -10.673   7.310 -11.783
   39    H    VAL   6           H        VAL   6 -13.575  10.433 -13.859
   40    HA   VAL   6           HA       VAL   6 -13.903  12.545 -14.669
   41    HB   VAL   6           HB       VAL   6 -14.864  13.174 -11.855
   42   1HG1  VAL   6          1HG1      VAL   6 -16.098  15.087 -13.200
   43   2HG1  VAL   6          2HG1      VAL   6 -14.547  15.284 -12.409
   44   3HG1  VAL   6          3HG1      VAL   6 -14.616  15.019 -14.170
   45   1HG2  VAL   6          1HG2      VAL   6 -16.913  13.168 -13.931
   46   2HG2  VAL   6          2HG2      VAL   6 -16.080  11.612 -13.864
   47   3HG2  VAL   6          3HG2      VAL   6 -16.804  12.277 -12.398
   48    H    TYR   7           H        TYR   7 -12.686  14.567 -14.872
   49    HA   TYR   7           HA       TYR   7 -10.725  15.732 -14.824
   50   1HB   TYR   7          1HB       TYR   7 -11.547  15.461 -11.975
   51   2HB   TYR   7          2HB       TYR   7  -9.911  16.003 -12.250
   52    HD1  TYR   7           1HD      TYR   7 -13.331  17.054 -12.132
   53    HD2  TYR   7           2HD      TYR   7  -9.477  17.947 -13.811
   54    HE1  TYR   7           1HE      TYR   7 -14.051  19.426 -12.503
   55    HE2  TYR   7           2HE      TYR   7 -10.158  20.300 -14.162
   56    HH   TYR   7           HH       TYR   7 -11.745  21.873 -13.551
   57    HA   PRO   8           HA       PRO   8  -7.908  12.097 -14.632
   58   1HB   PRO   8          1HB       PRO   8  -6.716  12.385 -17.097
   59   2HB   PRO   8          2HB       PRO   8  -8.262  11.565 -16.806
   60   1HG   PRO   8          1HG       PRO   8  -7.789  14.306 -17.927
   61   2HG   PRO   8          2HG       PRO   8  -9.078  13.127 -18.301
   62   1HD   PRO   8          1HD       PRO   8  -9.267  15.356 -16.568
   63   2HD   PRO   8          2HD       PRO   8 -10.428  14.001 -16.655
   64    H    GLY   9           H        GLY   9  -7.275  13.759 -12.936
   65   1HA   GLY   9          1HA       GLY   9  -4.653  14.025 -12.388
   66   2HA   GLY   9          2HA       GLY   9  -4.873  15.377 -13.513
   67    H    ASP  10           H        ASP  10  -5.273  14.286 -10.275
   68    HA   ASP  10           HA       ASP  10  -6.937  16.596  -9.480
   69   1HB   ASP  10          1HB       ASP  10  -5.660  14.582  -7.618
   70   2HB   ASP  10          2HB       ASP  10  -7.027  15.641  -7.313
   71    H    ASN  11           H        ASN  11  -6.166  17.935  -7.631
   72    HA   ASN  11           HA       ASN  11  -3.217  18.256  -7.419
   73   1HB   ASN  11          1HB       ASN  11  -3.465  20.661  -7.546
   74   2HB   ASN  11          2HB       ASN  11  -4.068  19.908  -9.018
   75   1HD2  ASN  11          1HD2      ASN  11  -4.736  22.388  -6.942
   76   2HD2  ASN  11          2HD2      ASN  11  -6.500  22.375  -7.119
   77    H    ALA  12           H        ALA  12  -3.357  17.051  -5.475
   78    HA   ALA  12           HA       ALA  12  -4.499  18.582  -3.190
   79   1HB   ALA  12          1HB       ALA  12  -5.452  16.162  -3.901
   80   2HB   ALA  12          2HB       ALA  12  -4.088  15.640  -2.886
   81   3HB   ALA  12          3HB       ALA  12  -5.347  16.713  -2.223
   82    H    THR  13           H        THR  13  -3.383  17.946  -1.106
   83    HA   THR  13           HA       THR  13  -0.722  18.795  -1.127
   84    HB   THR  13           HB       THR  13  -1.980  19.014   0.843
   85    HG1  THR  13           1HG      THR  13   0.056  18.765   1.455
   86   1HG2  THR  13          1HG2      THR  13  -3.275  16.696   0.494
   87   2HG2  THR  13          2HG2      THR  13  -1.958  16.100   1.514
   88   3HG2  THR  13          3HG2      THR  13  -3.031  17.372   2.107
   89    HA   PRO  14           HA       PRO  14   1.509  15.216  -2.452
   90   1HB   PRO  14          1HB       PRO  14   4.025  15.802  -1.439
   91   2HB   PRO  14          2HB       PRO  14   3.331  16.469  -2.936
   92   1HG   PRO  14          1HG       PRO  14   3.675  17.782  -0.280
   93   2HG   PRO  14          2HG       PRO  14   3.613  18.515  -1.910
   94   1HD   PRO  14          1HD       PRO  14   1.546  18.421  -0.008
   95   2HD   PRO  14          2HD       PRO  14   1.351  18.863  -1.718
   96    H    GLU  15           H        GLU  15   1.114  16.061   0.886
   97    HA   GLU  15           HA       GLU  15   2.260  13.587   1.928
   98   1HB   GLU  15          1HB       GLU  15   1.809  16.147   2.949
   99   2HB   GLU  15          2HB       GLU  15   0.482  15.266   3.666
  100   1HG   GLU  15          1HG       GLU  15   1.859  14.367   5.215
  101   2HG   GLU  15          2HG       GLU  15   2.912  13.687   3.976
  102    H    GLN  16           H        GLN  16  -0.723  14.477   0.593
  103    HA   GLN  16           HA       GLN  16  -2.129  12.166   1.879
  104   1HB   GLN  16          1HB       GLN  16  -3.250  14.358   1.940
  105   2HB   GLN  16          2HB       GLN  16  -3.271  14.400   0.161
  106   1HG   GLN  16          1HG       GLN  16  -4.793  12.542   0.077
  107   2HG   GLN  16          2HG       GLN  16  -4.528  12.170   1.792
  108   1HE2  GLN  16          1HE2      GLN  16  -6.470  12.599   2.856
  109   2HE2  GLN  16          2HE2      GLN  16  -7.336  14.130   2.594
  110    H    MET  17           H        MET  17  -0.952  13.459  -1.217
  111    HA   MET  17           HA       MET  17  -2.086  11.385  -2.874
  112   1HB   MET  17          1HB       MET  17  -0.386  13.785  -3.150
  113   2HB   MET  17          2HB       MET  17   0.164  12.478  -4.167
  114   1HG   MET  17          1HG       MET  17  -2.795  12.966  -4.150
  115   2HG   MET  17          2HG       MET  17  -1.802  14.227  -4.858
  116   1HE   MET  17          1HE       MET  17  -0.819  13.114  -8.206
  117   2HE   MET  17          2HE       MET  17  -1.993  14.216  -7.459
  118    H    ALA  18           H        ALA  18   1.174  11.828  -1.334
  119    HA   ALA  18           HA       ALA  18   2.212   9.356  -2.360
  120   1HB   ALA  18          1HB       ALA  18   3.722  11.024  -1.524
  121   2HB   ALA  18          2HB       ALA  18   2.883  11.107   0.042
  122   3HB   ALA  18          3HB       ALA  18   3.813   9.658  -0.394
  123    H    ARG  19           H        ARG  19  -0.013  10.077   0.192
  124    HA   ARG  19           HA       ARG  19   0.262   7.464   1.491
  125   1HB   ARG  19          1HB       ARG  19  -0.962   9.989   2.163
  126   2HB   ARG  19          2HB       ARG  19  -2.208   8.755   2.221
  127   1HG   ARG  19          1HG       ARG  19   0.518   8.481   3.547
  128   2HG   ARG  19          2HG       ARG  19  -0.881   9.131   4.384
  129   1HD   ARG  19          1HD       ARG  19  -0.996   6.384   3.086
  130   2HD   ARG  19          2HD       ARG  19  -0.284   6.628   4.687
  131    HE   ARG  19           HE       ARG  19  -2.929   7.809   4.407
  132   1HH1  ARG  19          2HH2      ARG  19  -1.273   4.866   5.234
  133   2HH1  ARG  19          1HH2      ARG  19  -2.553   4.260   6.245
  134   1HH2  ARG  19          2HH1      ARG  19  -4.537   7.073   5.811
  135   2HH2  ARG  19          1HH1      ARG  19  -4.393   5.497   6.515
  136    H    TYR  20           H        TYR  20  -2.190   9.000  -0.633
  137    HA   TYR  20           HA       TYR  20  -3.996   6.859  -0.848
  138   1HB   TYR  20          1HB       TYR  20  -3.202   9.277  -2.440
  139   2HB   TYR  20          2HB       TYR  20  -4.053   8.035  -3.302
  140    HD1  TYR  20           1HD      TYR  20  -6.284   8.619  -3.628
  141    HD2  TYR  20           2HD      TYR  20  -4.433   9.477   0.174
  142    HE1  TYR  20           1HE      TYR  20  -8.445   9.506  -2.773
  143    HE2  TYR  20           2HE      TYR  20  -6.594  10.369   1.017
  144    HH   TYR  20           HH       TYR  20  -9.544   9.796  -0.380
  145    H    TYR  21           H        TYR  21  -1.148   7.590  -2.898
  146    HA   TYR  21           HA       TYR  21  -1.330   5.290  -4.570
  147   1HB   TYR  21          1HB       TYR  21   0.018   7.375  -4.919
  148   2HB   TYR  21          2HB       TYR  21   1.141   6.840  -3.681
  149    HD1  TYR  21           1HD      TYR  21   2.198   4.365  -4.096
  150    HD2  TYR  21           2HD      TYR  21   0.477   6.901  -7.141
  151    HE1  TYR  21           1HE      TYR  21   3.360   3.062  -5.836
  152    HE2  TYR  21           2HE      TYR  21   1.720   5.613  -8.885
  153    HH   TYR  21           HH       TYR  21   2.941   2.645  -8.501
  154    H    SER  22           H        SER  22   0.529   5.795  -1.538
  155    HA   SER  22           HA       SER  22   1.758   3.192  -1.486
  156   1HB   SER  22          1HB       SER  22   2.593   5.076  -0.151
  157   2HB   SER  22          2HB       SER  22   1.077   5.126   0.768
  158    HG   SER  22           HG       SER  22   2.514   3.933   1.955
  159    H    ALA  23           H        ALA  23  -1.310   4.444  -0.145
  160    HA   ALA  23           HA       ALA  23  -2.134   2.034   1.109
  161   1HB   ALA  23          1HB       ALA  23  -3.147   4.495   1.205
  162   2HB   ALA  23          2HB       ALA  23  -4.157   3.889  -0.127
  163   3HB   ALA  23          3HB       ALA  23  -4.155   3.064   1.445
  164    H    LEU  24           H        LEU  24  -2.609   3.198  -2.314
  165    HA   LEU  24           HA       LEU  24  -4.189   0.997  -3.171
  166   1HB   LEU  24          1HB       LEU  24  -4.136   2.837  -4.609
  167   2HB   LEU  24          2HB       LEU  24  -2.423   3.086  -4.421
  168    HG   LEU  24           HG       LEU  24  -2.047   0.965  -5.769
  169   1HD1  LEU  24          1HD1      LEU  24  -4.241  -0.046  -5.670
  170   2HD1  LEU  24          2HD1      LEU  24  -5.010   1.411  -6.337
  171   3HD1  LEU  24          3HD1      LEU  24  -3.950   0.427  -7.352
  172   1HD2  LEU  24          1HD2      LEU  24  -1.435   2.554  -7.174
  173   2HD2  LEU  24          2HD2      LEU  24  -3.040   2.445  -7.914
  174   3HD2  LEU  24          3HD2      LEU  24  -2.720   3.655  -6.664
  175    H    ARG  25           H        ARG  25  -0.609   1.384  -3.098
  176    HA   ARG  25           HA       ARG  25  -0.043  -1.197  -4.198
  177   1HB   ARG  25          1HB       ARG  25   1.627   0.725  -3.778
  178   2HB   ARG  25          2HB       ARG  25   1.632   0.238  -2.084
  179   1HG   ARG  25          1HG       ARG  25   3.478  -0.940  -2.910
  180   2HG   ARG  25          2HG       ARG  25   2.214  -2.165  -3.023
  181   1HD   ARG  25          1HD       ARG  25   1.835  -1.312  -5.439
  182   2HD   ARG  25          2HD       ARG  25   3.360  -0.423  -5.233
  183    HE   ARG  25           HE       ARG  25   3.829  -3.113  -4.502
  184   1HH1  ARG  25          2HH2      ARG  25   2.978  -1.387  -7.421
  185   2HH1  ARG  25          1HH2      ARG  25   3.677  -2.579  -8.482
  186   1HH2  ARG  25          2HH1      ARG  25   4.754  -4.629  -5.907
  187   2HH2  ARG  25          1HH1      ARG  25   4.674  -4.363  -7.624
  188    H    ARG  26           H        ARG  26  -0.321  -0.218  -0.767
  189    HA   ARG  26           HA       ARG  26   0.061  -2.876   0.255
  190   1HB   ARG  26          1HB       ARG  26   0.355  -0.710   1.487
  191   2HB   ARG  26          2HB       ARG  26  -1.405  -0.566   1.590
  192   1HG   ARG  26          1HG       ARG  26  -1.620  -2.496   2.939
  193   2HG   ARG  26          2HG       ARG  26  -0.005  -3.101   2.531
  194   1HD   ARG  26          1HD       ARG  26   1.000  -1.962   4.151
  195   2HD   ARG  26          2HD       ARG  26   0.156  -0.450   3.768
  196    HE   ARG  26           HE       ARG  26  -1.803  -1.913   4.990
  197   1HH1  ARG  26          2HH2      ARG  26   1.450  -1.099   5.996
  198   2HH1  ARG  26          1HH2      ARG  26   1.060  -1.056   7.687
  199   1HH2  ARG  26          2HH1      ARG  26  -2.336  -1.704   7.163
  200   2HH2  ARG  26          1HH1      ARG  26  -1.107  -1.361   8.329
  201    H    TYR  27           H        TYR  27  -2.883  -1.080  -0.521
  202    HA   TYR  27           HA       TYR  27  -4.837  -2.909   0.361
  203   1HB   TYR  27          1HB       TYR  27  -5.312  -0.597  -0.327
  204   2HB   TYR  27          2HB       TYR  27  -4.803  -0.958  -1.976
  205    HD1  TYR  27           1HD      TYR  27  -7.133  -2.517   0.541
  206    HD2  TYR  27           2HD      TYR  27  -6.594  -1.015  -3.471
  207    HE1  TYR  27           1HE      TYR  27  -9.487  -3.053   0.030
  208    HE2  TYR  27           2HE      TYR  27  -8.973  -1.535  -3.977
  209    HH   TYR  27           HH       TYR  27 -11.171  -2.515  -1.409
  210    H    ILE  28           H        ILE  28  -3.276  -2.620  -2.882
  211    HA   ILE  28           HA       ILE  28  -4.472  -4.943  -4.015
  212    HB   ILE  28           HB       ILE  28  -1.824  -3.574  -4.548
  213   2HG1  ILE  28          2HG1      ILE  28  -3.961  -2.388  -5.132
  214   1HG2  ILE  28          1HG2      ILE  28  -1.928  -5.043  -6.730
  215   2HG2  ILE  28          2HG2      ILE  28  -1.320  -5.763  -5.249
  216   3HG2  ILE  28          3HG2      ILE  28  -2.989  -6.095  -5.779
  217   1HD1  ILE  28          1HD1      ILE  28  -1.734  -2.363  -6.582
  218   2HD1  ILE  28          2HD1      ILE  28  -2.764  -3.214  -7.764
  219   3HD1  ILE  28          3HD1      ILE  28  -3.219  -1.617  -7.194
  220    H    ASN  29           H        ASN  29  -1.306  -4.705  -2.227
  221    HA   ASN  29           HA       ASN  29  -0.787  -7.488  -2.239
  222   1HB   ASN  29          1HB       ASN  29   0.843  -5.836  -1.471
  223   2HB   ASN  29          2HB       ASN  29  -0.166  -5.458  -0.068
  224   1HD2  ASN  29          1HD2      ASN  29   1.582  -6.030   1.378
  225   2HD2  ASN  29          2HD2      ASN  29   1.956  -7.736   1.614
  226    H    MET  30           H        MET  30  -2.715  -5.643   0.170
  227    HA   MET  30           HA       MET  30  -3.528  -7.877   1.738
  228   1HB   MET  30          1HB       MET  30  -4.270  -5.007   1.459
  229   2HB   MET  30          2HB       MET  30  -5.569  -6.029   2.046
  230   1HG   MET  30          1HG       MET  30  -4.559  -6.491   4.018
  231   2HG   MET  30          2HG       MET  30  -2.951  -6.582   3.319
  232   1HE   MET  30          1HE       MET  30  -5.815  -4.481   4.344
  233   2HE   MET  30          2HE       MET  30  -5.056  -3.339   5.474
  234    H    LEU  31           H        LEU  31  -4.857  -6.768  -1.378
  235    HA   LEU  31           HA       LEU  31  -7.179  -8.520  -1.219
  236   1HB   LEU  31          1HB       LEU  31  -5.790  -6.842  -3.342
  237   2HB   LEU  31          2HB       LEU  31  -7.085  -7.923  -3.762
  238    HG   LEU  31           HG       LEU  31  -7.432  -5.817  -1.594
  239   1HD1  LEU  31          1HD1      LEU  31  -6.733  -4.642  -3.610
  240   2HD1  LEU  31          2HD1      LEU  31  -7.897  -5.559  -4.598
  241   3HD1  LEU  31          3HD1      LEU  31  -8.472  -4.417  -3.371
  242   1HD2  LEU  31          1HD2      LEU  31  -9.452  -7.161  -3.440
  243   2HD2  LEU  31          2HD2      LEU  31  -9.114  -7.701  -1.786
  244   3HD2  LEU  31          3HD2      LEU  31  -9.794  -6.082  -2.062
  245    H    THR  32           H        THR  32  -3.841  -8.828  -2.056
  246    HA   THR  32           HA       THR  32  -4.246 -11.422  -3.363
  247    HB   THR  32           HB       THR  32  -1.998 -11.443  -3.937
  248    HG1  THR  32           1HG      THR  32  -1.662  -9.625  -1.782
  249   1HG2  THR  32          1HG2      THR  32  -3.411  -9.095  -4.599
  250   2HG2  THR  32          2HG2      THR  32  -1.826  -8.538  -4.065
  251   3HG2  THR  32          3HG2      THR  32  -1.959  -9.722  -5.369
  252    H    ARG  33           H        ARG  33  -3.531 -10.266  -0.241
  253    HA   ARG  33           HA       ARG  33  -2.360 -12.501   0.987
  254   1HB   ARG  33          1HB       ARG  33  -3.364 -10.042   1.818
  255   2HB   ARG  33          2HB       ARG  33  -4.457 -11.136   2.633
  256   1HG   ARG  33          1HG       ARG  33  -1.560 -11.860   2.818
  257   2HG   ARG  33          2HG       ARG  33  -1.989 -10.323   3.527
  258   1HD   ARG  33          1HD       ARG  33  -3.881 -12.510   4.251
  259   2HD   ARG  33          2HD       ARG  33  -2.228 -12.828   4.747
  260    HE   ARG  33           HE       ARG  33  -4.021 -10.759   5.789
  261   1HH1  ARG  33          2HH2      ARG  33  -0.704 -11.702   5.485
  262   2HH1  ARG  33          1HH2      ARG  33  -0.098 -10.604   6.711
  263   1HH2  ARG  33          2HH1      ARG  33  -3.284  -9.429   7.501
  264   2HH2  ARG  33          1HH1      ARG  33  -1.566  -9.358   7.805
  265    HA   PRO  34           HA       PRO  34  -6.492 -14.686   1.634
  266   1HB   PRO  34          1HB       PRO  34  -8.776 -13.866   0.275
  267   2HB   PRO  34          2HB       PRO  34  -8.319 -13.317   1.910
  268   1HG   PRO  34          1HG       PRO  34  -8.094 -11.862  -0.697
  269   2HG   PRO  34          2HG       PRO  34  -8.330 -11.212   0.957
  270   1HD   PRO  34          1HD       PRO  34  -5.925 -11.360  -0.495
  271   2HD   PRO  34          2HD       PRO  34  -6.085 -10.993   1.238
  272    H    ARG  35           H        ARG  35  -4.973 -13.984  -1.124
  273    HA   ARG  35           HA       ARG  35  -4.697 -16.275  -2.422
  274   1HB   ARG  35          1HB       ARG  35  -7.471 -15.344  -3.008
  275   2HB   ARG  35          2HB       ARG  35  -6.563 -15.839  -4.416
  276   1HG   ARG  35          1HG       ARG  35  -6.229 -18.013  -3.726
  277   2HG   ARG  35          2HG       ARG  35  -6.571 -17.677  -2.019
  278   1HD   ARG  35          1HD       ARG  35  -8.903 -17.245  -2.473
  279   2HD   ARG  35          2HD       ARG  35  -8.617 -17.317  -4.226
  280    HE   ARG  35           HE       ARG  35  -7.890 -19.729  -2.721
  281   1HH1  ARG  35          2HH2      ARG  35 -10.478 -18.169  -4.474
  282   2HH1  ARG  35          1HH2      ARG  35 -11.171 -19.671  -5.046
  283   1HH2  ARG  35          2HH1      ARG  35  -8.863 -21.659  -3.369
  284   2HH2  ARG  35          1HH1      ARG  35 -10.322 -21.602  -4.326
  285    H    TYR  36           H        TYR  36  -6.139 -13.473  -3.982
  286    HA   TYR  36           HA       TYR  36  -3.697 -12.482  -5.139
  287   1HB   TYR  36          1HB       TYR  36  -4.606 -14.779  -6.422
  288   2HB   TYR  36          2HB       TYR  36  -5.353 -13.514  -7.370
  289    HD1  TYR  36           1HD      TYR  36  -4.117 -13.240  -9.352
  290    HD2  TYR  36           2HD      TYR  36  -1.977 -13.862  -5.656
  291    HE1  TYR  36           1HE      TYR  36  -1.957 -12.950 -10.551
  292    HE2  TYR  36           2HE      TYR  36   0.168 -13.527  -6.840
  293    HH   TYR  36           HH       TYR  36   0.303 -12.629 -10.284
  294   1HN   NH2  37          1HN       NH2  37  -7.329 -12.654  -5.720
  295   2HN   NH2  37          2HN       NH2  37  -7.369 -10.898  -5.850
  Start of MODEL    8
    1   1H    ALA   1          1H        ALA   1   2.910   8.228  22.392
    2   2H    ALA   1          2H        ALA   1   2.258   7.497  21.061
    3   3H    ALA   1          3H        ALA   1   2.283   9.132  21.159
    4    HA   ALA   1           HA       ALA   1   0.842   7.439  23.061
    5   1HB   ALA   1          1HB       ALA   1   0.078   9.360  24.040
    6   2HB   ALA   1          2HB       ALA   1   1.550  10.060  23.364
    7   3HB   ALA   1          3HB       ALA   1   0.003  10.258  22.508
    8    HA   PRO   2           HA       PRO   2  -2.258   6.773  19.953
    9   1HB   PRO   2          1HB       PRO   2  -4.647   6.955  21.316
   10   2HB   PRO   2          2HB       PRO   2  -3.543   5.564  21.391
   11   1HG   PRO   2          1HG       PRO   2  -4.011   7.689  23.431
   12   2HG   PRO   2          2HG       PRO   2  -3.456   6.006  23.649
   13   1HD   PRO   2          1HD       PRO   2  -1.880   8.372  23.613
   14   2HD   PRO   2          2HD       PRO   2  -1.262   6.693  23.608
   15    H    LEU   3           H        LEU   3  -2.299   8.315  18.437
   16    HA   LEU   3           HA       LEU   3  -3.093  11.064  18.824
   17   1HB   LEU   3          1HB       LEU   3  -2.739   9.303  16.353
   18   2HB   LEU   3          2HB       LEU   3  -3.257  10.968  16.261
   19    HG   LEU   3           HG       LEU   3  -1.015  11.204  17.902
   20   1HD1  LEU   3          1HD1      LEU   3   0.776  10.030  16.490
   21   2HD1  LEU   3          2HD1      LEU   3  -0.147   9.008  17.597
   22   3HD1  LEU   3          3HD1      LEU   3  -0.519   9.006  15.855
   23   1HD2  LEU   3          1HD2      LEU   3  -0.931  11.434  14.881
   24   2HD2  LEU   3          2HD2      LEU   3  -1.732  12.619  15.942
   25   3HD2  LEU   3          3HD2      LEU   3   0.002  12.340  16.096
   26    H    GLU   4           H        GLU   4  -4.885  11.978  17.380
   27    HA   GLU   4           HA       GLU   4  -7.356  11.061  18.414
   28   1HB   GLU   4          1HB       GLU   4  -6.364  13.283  16.780
   29   2HB   GLU   4          2HB       GLU   4  -7.892  12.710  16.142
   30   1HG   GLU   4          1HG       GLU   4  -9.098  13.417  17.946
   31   2HG   GLU   4          2HG       GLU   4  -7.862  12.971  19.109
   32    HA   PRO   5           HA       PRO   5  -8.706   8.010  15.564
   33   1HB   PRO   5          1HB       PRO   5 -11.464   8.389  15.541
   34   2HB   PRO   5          2HB       PRO   5 -10.547   7.622  16.853
   35   1HG   PRO   5          1HG       PRO   5 -11.735  10.358  16.745
   36   2HG   PRO   5          2HG       PRO   5 -11.403   9.309  18.158
   37   1HD   PRO   5          1HD       PRO   5  -9.846  11.482  17.211
   38   2HD   PRO   5          2HD       PRO   5  -9.384  10.310  18.478
   39    H    VAL   6           H        VAL   6 -10.504   7.859  13.650
   40    HA   VAL   6           HA       VAL   6  -9.529   9.014  11.353
   41    HB   VAL   6           HB       VAL   6 -11.747   8.580  10.319
   42   1HG1  VAL   6          1HG1      VAL   6 -10.222   6.765  10.338
   43   2HG1  VAL   6          2HG1      VAL   6 -10.495   6.427  12.058
   44   3HG1  VAL   6          3HG1      VAL   6 -11.770   6.093  10.882
   45   1HG2  VAL   6          1HG2      VAL   6 -13.544   7.502  11.592
   46   2HG2  VAL   6          2HG2      VAL   6 -12.649   7.729  13.110
   47   3HG2  VAL   6          3HG2      VAL   6 -13.269   9.121  12.205
   48    H    TYR   7           H        TYR   7  -9.408  10.966  10.496
   49    HA   TYR   7           HA       TYR   7 -11.441  13.020  11.034
   50   1HB   TYR   7          1HB       TYR   7  -9.424  12.816  12.843
   51   2HB   TYR   7          2HB       TYR   7  -8.657  13.891  11.711
   52    HD1  TYR   7           1HD      TYR   7 -11.940  13.351  13.482
   53    HD2  TYR   7           2HD      TYR   7  -9.025  16.207  12.094
   54    HE1  TYR   7           1HE      TYR   7 -13.239  15.176  14.551
   55    HE2  TYR   7           2HE      TYR   7 -10.327  18.046  13.187
   56    HH   TYR   7           HH       TYR   7 -13.476  17.482  14.718
   57    HA   PRO   8           HA       PRO   8  -9.646  13.347   6.819
   58   1HB   PRO   8          1HB       PRO   8 -12.007  13.935   5.501
   59   2HB   PRO   8          2HB       PRO   8 -11.387  12.287   5.798
   60   1HG   PRO   8          1HG       PRO   8 -13.608  13.731   7.182
   61   2HG   PRO   8          2HG       PRO   8 -13.372  11.975   6.938
   62   1HD   PRO   8          1HD       PRO   8 -12.820  13.481   9.290
   63   2HD   PRO   8          2HD       PRO   8 -12.333  11.792   8.977
   64    H    GLY   9           H        GLY   9  -9.086  15.220   5.769
   65   1HA   GLY   9          1HA       GLY   9 -10.310  17.817   6.382
   66   2HA   GLY   9          2HA       GLY   9  -8.697  17.548   7.050
   67    H    ASP  10           H        ASP  10 -10.604  17.861   4.169
   68    HA   ASP  10           HA       ASP  10 -10.221  18.443   2.037
   69   1HB   ASP  10          1HB       ASP  10  -8.595  20.085   3.141
   70   2HB   ASP  10          2HB       ASP  10  -7.305  18.974   2.664
   71    H    ASN  11           H        ASN  11  -8.931  17.815   0.019
   72    HA   ASN  11           HA       ASN  11  -7.615  15.177   0.200
   73   1HB   ASN  11          1HB       ASN  11  -9.887  14.495  -0.183
   74   2HB   ASN  11          2HB       ASN  11 -10.095  15.707  -1.465
   75   1HD2  ASN  11          1HD2      ASN  11 -10.267  14.537  -3.363
   76   2HD2  ASN  11          2HD2      ASN  11  -9.051  13.344  -3.837
   77    H    ALA  12           H        ALA  12  -5.798  16.532  -0.145
   78    HA   ALA  12           HA       ALA  12  -4.909  16.580  -2.827
   79   1HB   ALA  12          1HB       ALA  12  -6.252  18.684  -2.940
   80   2HB   ALA  12          2HB       ALA  12  -5.414  19.300  -1.505
   81   3HB   ALA  12          3HB       ALA  12  -4.529  19.049  -3.032
   82    H    THR  13           H        THR  13  -2.726  18.047  -2.654
   83    HA   THR  13           HA       THR  13  -0.744  18.574  -1.730
   84    HB   THR  13           HB       THR  13  -2.259  18.670   0.524
   85    HG1  THR  13           1HG      THR  13  -0.819  20.144   0.177
   86   1HG2  THR  13          1HG2      THR  13  -1.176  17.607   2.374
   87   2HG2  THR  13          2HG2      THR  13  -1.556  16.322   1.223
   88   3HG2  THR  13          3HG2      THR  13   0.096  16.948   1.347
   89    HA   PRO  14           HA       PRO  14   1.519  14.944  -2.484
   90   1HB   PRO  14          1HB       PRO  14   3.986  15.386  -1.315
   91   2HB   PRO  14          2HB       PRO  14   3.421  16.103  -2.850
   92   1HG   PRO  14          1HG       PRO  14   3.680  17.373  -0.168
   93   2HG   PRO  14          2HG       PRO  14   3.719  18.131  -1.790
   94   1HD   PRO  14          1HD       PRO  14   1.583  18.030   0.056
   95   2HD   PRO  14          2HD       PRO  14   1.438  18.619  -1.615
   96    H    GLU  15           H        GLU  15   1.683  15.905   0.939
   97    HA   GLU  15           HA       GLU  15   2.447  13.363   1.967
   98   1HB   GLU  15          1HB       GLU  15   1.803  15.983   3.022
   99   2HB   GLU  15          2HB       GLU  15   0.734  14.862   3.835
  100   1HG   GLU  15          1HG       GLU  15   2.770  15.149   5.126
  101   2HG   GLU  15          2HG       GLU  15   2.651  13.487   4.546
  102    H    GLN  16           H        GLN  16  -0.587  14.485   0.856
  103    HA   GLN  16           HA       GLN  16  -2.006  12.120   1.953
  104   1HB   GLN  16          1HB       GLN  16  -2.922  14.615   1.844
  105   2HB   GLN  16          2HB       GLN  16  -3.256  14.190   0.162
  106   1HG   GLN  16          1HG       GLN  16  -5.247  13.777   1.325
  107   2HG   GLN  16          2HG       GLN  16  -4.544  12.171   1.098
  108   1HE2  GLN  16          1HE2      GLN  16  -6.330  13.777   3.339
  109   2HE2  GLN  16          2HE2      GLN  16  -5.532  13.076   4.761
  110    H    MET  17           H        MET  17  -0.784  13.481  -1.125
  111    HA   MET  17           HA       MET  17  -2.059  11.544  -2.847
  112   1HB   MET  17          1HB       MET  17  -0.149  13.781  -3.063
  113   2HB   MET  17          2HB       MET  17   0.218  12.484  -4.150
  114   1HG   MET  17          1HG       MET  17  -2.595  13.566  -3.950
  115   2HG   MET  17          2HG       MET  17  -1.372  14.392  -4.902
  116   1HE   MET  17          1HE       MET  17  -3.330  14.211  -6.542
  117   2HE   MET  17          2HE       MET  17  -1.897  14.038  -7.586
  118    H    ALA  18           H        ALA  18   1.214  11.780  -1.373
  119    HA   ALA  18           HA       ALA  18   2.212   9.340  -2.486
  120   1HB   ALA  18          1HB       ALA  18   3.911   9.614  -0.626
  121   2HB   ALA  18          2HB       ALA  18   3.694  11.067  -1.625
  122   3HB   ALA  18          3HB       ALA  18   2.949  10.980  -0.015
  123    H    ARG  19           H        ARG  19   0.090  10.047   0.155
  124    HA   ARG  19           HA       ARG  19   0.306   7.398   1.392
  125   1HB   ARG  19          1HB       ARG  19  -0.831   9.962   2.126
  126   2HB   ARG  19          2HB       ARG  19  -2.094   8.767   2.213
  127   1HG   ARG  19          1HG       ARG  19   0.629   8.538   3.578
  128   2HG   ARG  19          2HG       ARG  19  -0.885   9.040   4.349
  129   1HD   ARG  19          1HD       ARG  19  -1.826   6.761   3.493
  130   2HD   ARG  19          2HD       ARG  19  -0.133   6.302   3.271
  131    HE   ARG  19           HE       ARG  19  -0.429   7.363   5.892
  132   1HH1  ARG  19          2HH2      ARG  19  -1.513   4.556   4.123
  133   2HH1  ARG  19          1HH2      ARG  19  -1.763   3.592   5.557
  134   1HH2  ARG  19          2HH1      ARG  19  -0.818   6.155   7.721
  135   2HH2  ARG  19          1HH1      ARG  19  -1.253   4.478   7.583
  136    H    TYR  20           H        TYR  20  -2.154   9.079  -0.628
  137    HA   TYR  20           HA       TYR  20  -4.049   7.046  -0.892
  138   1HB   TYR  20          1HB       TYR  20  -3.119   9.439  -2.425
  139   2HB   TYR  20          2HB       TYR  20  -3.940   8.239  -3.363
  140    HD1  TYR  20           1HD      TYR  20  -6.149   8.800  -3.779
  141    HD2  TYR  20           2HD      TYR  20  -4.471   9.724   0.088
  142    HE1  TYR  20           1HE      TYR  20  -8.348   9.725  -3.036
  143    HE2  TYR  20           2HE      TYR  20  -6.657  10.656   0.809
  144    HH   TYR  20           HH       TYR  20  -8.703  11.457  -0.055
  145    H    TYR  21           H        TYR  21  -1.169   7.608  -2.956
  146    HA   TYR  21           HA       TYR  21  -1.453   5.211  -4.512
  147   1HB   TYR  21          1HB       TYR  21   0.736   7.219  -3.973
  148   2HB   TYR  21          2HB       TYR  21   1.155   5.707  -4.756
  149    HD1  TYR  21           1HD      TYR  21   0.184   5.028  -6.910
  150    HD2  TYR  21           2HD      TYR  21  -0.539   8.941  -5.243
  151    HE1  TYR  21           1HE      TYR  21  -0.435   5.887  -9.169
  152    HE2  TYR  21           2HE      TYR  21  -1.139   9.794  -7.493
  153    HH   TYR  21           HH       TYR  21  -0.859   9.299  -9.826
  154    H    SER  22           H        SER  22   0.470   5.827  -1.528
  155    HA   SER  22           HA       SER  22   1.701   3.233  -1.382
  156   1HB   SER  22          1HB       SER  22   1.322   5.540   0.431
  157   2HB   SER  22          2HB       SER  22   1.229   4.010   1.278
  158    HG   SER  22           HG       SER  22   3.360   5.033  -0.243
  159    H    ALA  23           H        ALA  23  -1.412   4.452  -0.114
  160    HA   ALA  23           HA       ALA  23  -2.234   2.022   1.123
  161   1HB   ALA  23          1HB       ALA  23  -4.501   3.030   0.967
  162   2HB   ALA  23          2HB       ALA  23  -3.296   4.154   1.638
  163   3HB   ALA  23          3HB       ALA  23  -3.848   4.329  -0.046
  164    H    LEU  24           H        LEU  24  -2.634   3.203  -2.306
  165    HA   LEU  24           HA       LEU  24  -4.185   0.978  -3.184
  166   1HB   LEU  24          1HB       LEU  24  -4.106   2.731  -4.706
  167   2HB   LEU  24          2HB       LEU  24  -2.411   3.055  -4.430
  168    HG   LEU  24           HG       LEU  24  -1.894   0.889  -5.656
  169   1HD1  LEU  24          1HD1      LEU  24  -4.576   1.207  -6.989
  170   2HD1  LEU  24          2HD1      LEU  24  -3.464  -0.179  -6.987
  171   3HD1  LEU  24          3HD1      LEU  24  -4.436   0.175  -5.550
  172   1HD2  LEU  24          1HD2      LEU  24  -2.252   1.988  -7.910
  173   2HD2  LEU  24          2HD2      LEU  24  -3.031   3.317  -7.021
  174   3HD2  LEU  24          3HD2      LEU  24  -1.350   2.899  -6.698
  175    H    ARG  25           H        ARG  25  -0.603   1.375  -3.043
  176    HA   ARG  25           HA       ARG  25  -0.051  -1.223  -4.075
  177   1HB   ARG  25          1HB       ARG  25   1.629   0.674  -3.728
  178   2HB   ARG  25          2HB       ARG  25   1.635   0.262  -2.012
  179   1HG   ARG  25          1HG       ARG  25   3.524  -0.850  -2.951
  180   2HG   ARG  25          2HG       ARG  25   2.321  -2.116  -2.691
  181   1HD   ARG  25          1HD       ARG  25   1.630  -1.809  -5.144
  182   2HD   ARG  25          2HD       ARG  25   3.016  -0.714  -5.304
  183    HE   ARG  25           HE       ARG  25   3.740  -3.300  -4.200
  184   1HH1  ARG  25          2HH2      ARG  25   3.101  -1.684  -7.277
  185   2HH1  ARG  25          1HH2      ARG  25   4.048  -2.838  -8.168
  186   1HH2  ARG  25          2HH1      ARG  25   4.880  -4.777  -5.444
  187   2HH2  ARG  25          1HH1      ARG  25   4.865  -4.639  -7.182
  188    H    ARG  26           H        ARG  26  -0.345  -0.210  -0.676
  189    HA   ARG  26           HA       ARG  26   0.026  -2.845   0.415
  190   1HB   ARG  26          1HB       ARG  26   0.042  -0.431   1.534
  191   2HB   ARG  26          2HB       ARG  26  -1.670  -0.769   1.829
  192   1HG   ARG  26          1HG       ARG  26  -1.024  -2.883   3.006
  193   2HG   ARG  26          2HG       ARG  26   0.684  -2.545   2.644
  194   1HD   ARG  26          1HD       ARG  26   0.486  -0.392   3.890
  195   2HD   ARG  26          2HD       ARG  26  -1.158  -0.843   4.366
  196    HE   ARG  26           HE       ARG  26   0.252  -2.998   5.219
  197   1HH1  ARG  26          2HH2      ARG  26   0.824   0.399   5.782
  198   2HH1  ARG  26          1HH2      ARG  26   1.640   0.145   7.299
  199   1HH2  ARG  26          2HH1      ARG  26   1.323  -3.314   7.191
  200   2HH2  ARG  26          1HH1      ARG  26   1.937  -1.932   8.045
  201    H    TYR  27           H        TYR  27  -2.929  -1.099  -0.532
  202    HA   TYR  27           HA       TYR  27  -4.847  -2.975   0.328
  203   1HB   TYR  27          1HB       TYR  27  -5.333  -0.664  -0.352
  204   2HB   TYR  27          2HB       TYR  27  -4.822  -1.017  -2.002
  205    HD1  TYR  27           1HD      TYR  27  -6.542  -1.311  -3.549
  206    HD2  TYR  27           2HD      TYR  27  -7.202  -2.369   0.583
  207    HE1  TYR  27           1HE      TYR  27  -8.915  -1.814  -4.061
  208    HE2  TYR  27           2HE      TYR  27  -9.594  -2.891   0.059
  209    HH   TYR  27           HH       TYR  27 -10.831  -2.904  -3.219
  210    H    ILE  28           H        ILE  28  -3.194  -2.692  -2.870
  211    HA   ILE  28           HA       ILE  28  -4.407  -4.994  -4.048
  212    HB   ILE  28           HB       ILE  28  -1.761  -3.599  -4.515
  213   2HG1  ILE  28          2HG1      ILE  28  -2.789  -2.444  -6.277
  214   1HG2  ILE  28          1HG2      ILE  28  -2.985  -5.786  -6.247
  215   2HG2  ILE  28          2HG2      ILE  28  -1.604  -4.759  -6.689
  216   3HG2  ILE  28          3HG2      ILE  28  -1.469  -5.887  -5.343
  217   1HD1  ILE  28          1HD1      ILE  28  -5.226  -2.787  -6.898
  218   2HD1  ILE  28          2HD1      ILE  28  -4.120  -4.030  -7.495
  219   3HD1  ILE  28          3HD1      ILE  28  -5.157  -4.360  -6.084
  220    H    ASN  29           H        ASN  29  -1.360  -4.710  -2.194
  221    HA   ASN  29           HA       ASN  29  -0.619  -7.453  -2.246
  222   1HB   ASN  29          1HB       ASN  29   0.795  -5.525  -1.426
  223   2HB   ASN  29          2HB       ASN  29  -0.209  -5.450   0.020
  224   1HD2  ASN  29          1HD2      ASN  29   2.411  -7.216  -1.561
  225   2HD2  ASN  29          2HD2      ASN  29   2.644  -8.283  -0.175
  226    H    MET  30           H        MET  30  -2.708  -5.691   0.074
  227    HA   MET  30           HA       MET  30  -3.395  -7.953   1.649
  228   1HB   MET  30          1HB       MET  30  -4.272  -5.142   1.371
  229   2HB   MET  30          2HB       MET  30  -5.567  -6.214   1.837
  230   1HG   MET  30          1HG       MET  30  -2.874  -6.136   3.220
  231   2HG   MET  30          2HG       MET  30  -4.268  -5.213   3.756
  232   1HE   MET  30          1HE       MET  30  -6.735  -7.031   3.471
  233   2HE   MET  30          2HE       MET  30  -6.769  -7.964   4.974
  234    H    LEU  31           H        LEU  31  -5.134  -6.495  -1.147
  235    HA   LEU  31           HA       LEU  31  -7.304  -8.275  -1.164
  236   1HB   LEU  31          1HB       LEU  31  -6.154  -6.259  -2.949
  237   2HB   LEU  31          2HB       LEU  31  -6.528  -7.654  -3.901
  238    HG   LEU  31           HG       LEU  31  -8.767  -7.239  -2.133
  239   1HD1  LEU  31          1HD1      LEU  31  -8.250  -4.729  -3.719
  240   2HD1  LEU  31          2HD1      LEU  31  -9.445  -5.066  -2.437
  241   3HD1  LEU  31          3HD1      LEU  31  -7.728  -4.890  -2.030
  242   1HD2  LEU  31          1HD2      LEU  31 -10.050  -7.185  -4.097
  243   2HD2  LEU  31          2HD2      LEU  31  -8.711  -6.548  -5.082
  244   3HD2  LEU  31          3HD2      LEU  31  -8.674  -8.227  -4.501
  245    H    THR  32           H        THR  32  -4.194  -8.556  -2.742
  246    HA   THR  32           HA       THR  32  -4.806 -11.346  -3.569
  247    HB   THR  32           HB       THR  32  -2.267  -9.893  -4.265
  248    HG1  THR  32           1HG      THR  32  -3.957  -8.546  -4.838
  249   1HG2  THR  32          1HG2      THR  32  -2.416 -12.284  -4.934
  250   2HG2  THR  32          2HG2      THR  32  -3.989 -11.980  -5.690
  251   3HG2  THR  32          3HG2      THR  32  -2.526 -11.240  -6.361
  252    H    ARG  33           H        ARG  33  -4.435 -10.625  -0.713
  253    HA   ARG  33           HA       ARG  33  -2.037 -11.642   0.361
  254   1HB   ARG  33          1HB       ARG  33  -4.870 -11.454   1.331
  255   2HB   ARG  33          2HB       ARG  33  -3.887 -12.669   2.100
  256   1HG   ARG  33          1HG       ARG  33  -2.272 -10.342   2.154
  257   2HG   ARG  33          2HG       ARG  33  -3.911  -9.800   2.470
  258   1HD   ARG  33          1HD       ARG  33  -3.272 -10.259   4.586
  259   2HD   ARG  33          2HD       ARG  33  -4.053 -11.778   4.147
  260    HE   ARG  33           HE       ARG  33  -1.340 -12.040   3.451
  261   1HH1  ARG  33          2HH2      ARG  33  -3.151 -11.601   6.390
  262   2HH1  ARG  33          1HH2      ARG  33  -1.964 -12.366   7.414
  263   1HH2  ARG  33          2HH1      ARG  33   0.255 -12.884   4.784
  264   2HH2  ARG  33          1HH1      ARG  33  -0.009 -13.004   6.502
  265    HA   PRO  34           HA       PRO  34  -3.542 -16.095   0.169
  266   1HB   PRO  34          1HB       PRO  34  -5.813 -16.872  -1.175
  267   2HB   PRO  34          2HB       PRO  34  -5.759 -16.348   0.529
  268   1HG   PRO  34          1HG       PRO  34  -6.699 -14.813  -1.877
  269   2HG   PRO  34          2HG       PRO  34  -7.265 -14.742  -0.182
  270   1HD   PRO  34          1HD       PRO  34  -5.492 -12.950  -1.429
  271   2HD   PRO  34          2HD       PRO  34  -5.781 -13.104   0.323
  272    H    ARG  35           H        ARG  35  -1.665 -15.777  -1.100
  273    HA   ARG  35           HA       ARG  35  -1.756 -17.221  -3.615
  274   1HB   ARG  35          1HB       ARG  35  -2.359 -14.911  -4.330
  275   2HB   ARG  35          2HB       ARG  35  -0.817 -14.314  -3.714
  276   1HG   ARG  35          1HG       ARG  35   0.433 -15.517  -5.353
  277   2HG   ARG  35          2HG       ARG  35  -0.872 -16.665  -5.638
  278   1HD   ARG  35          1HD       ARG  35  -1.328 -15.488  -7.479
  279   2HD   ARG  35          2HD       ARG  35  -2.132 -14.353  -6.405
  280    HE   ARG  35           HE       ARG  35  -0.360 -12.847  -6.643
  281   1HH1  ARG  35          2HH2      ARG  35   0.511 -15.863  -8.223
  282   2HH1  ARG  35          1HH2      ARG  35   1.902 -15.202  -9.013
  283   1HH2  ARG  35          2HH1      ARG  35   1.416 -12.005  -7.695
  284   2HH2  ARG  35          1HH1      ARG  35   2.357 -13.013  -8.770
  285    H    TYR  36           H        TYR  36  -0.504 -18.589  -2.381
  286    HA   TYR  36           HA       TYR  36   1.421 -19.612  -1.709
  287   1HB   TYR  36          1HB       TYR  36   1.792 -19.278  -4.121
  288   2HB   TYR  36          2HB       TYR  36   2.634 -17.772  -3.793
  289    HD1  TYR  36           1HD      TYR  36   2.760 -21.341  -2.519
  290    HD2  TYR  36           2HD      TYR  36   4.940 -17.926  -3.992
  291    HE1  TYR  36           1HE      TYR  36   4.886 -22.628  -2.366
  292    HE2  TYR  36           2HE      TYR  36   7.060 -19.232  -3.885
  293    HH   TYR  36           HH       TYR  36   7.986 -21.350  -3.517
  294   1HN   NH2  37          1HN       NH2  37   1.211 -18.667   0.503
  295   2HN   NH2  37          2HN       NH2  37   2.487 -17.540   0.966
  Start of MODEL    9
    1   1H    ALA   1          1H        ALA   1 -18.734  31.836 -24.571
    2   2H    ALA   1          2H        ALA   1 -17.311  31.326 -23.921
    3   3H    ALA   1          3H        ALA   1 -18.708  31.157 -23.073
    4    HA   ALA   1           HA       ALA   1 -17.114  33.522 -23.545
    5   1HB   ALA   1          1HB       ALA   1 -19.336  34.739 -22.604
    6   2HB   ALA   1          2HB       ALA   1 -18.879  34.668 -24.307
    7   3HB   ALA   1          3HB       ALA   1 -20.083  33.526 -23.670
    8    HA   PRO   2           HA       PRO   2 -17.973  33.252 -18.932
    9   1HB   PRO   2          1HB       PRO   2 -19.722  31.413 -17.851
   10   2HB   PRO   2          2HB       PRO   2 -20.182  33.072 -18.331
   11   1HG   PRO   2          1HG       PRO   2 -20.722  30.484 -19.740
   12   2HG   PRO   2          2HG       PRO   2 -21.686  31.990 -19.729
   13   1HD   PRO   2          1HD       PRO   2 -19.912  31.112 -21.743
   14   2HD   PRO   2          2HD       PRO   2 -20.620  32.748 -21.596
   15    H    LEU   3           H        LEU   3 -16.787  32.027 -17.416
   16    HA   LEU   3           HA       LEU   3 -15.134  30.652 -16.830
   17   1HB   LEU   3          1HB       LEU   3 -17.489  29.274 -16.710
   18   2HB   LEU   3          2HB       LEU   3 -16.603  28.205 -17.763
   19    HG   LEU   3           HG       LEU   3 -16.298  27.382 -15.597
   20   1HD1  LEU   3          1HD1      LEU   3 -14.055  27.950 -16.968
   21   2HD1  LEU   3          2HD1      LEU   3 -13.731  28.903 -15.519
   22   3HD1  LEU   3          3HD1      LEU   3 -14.053  27.167 -15.401
   23   1HD2  LEU   3          1HD2      LEU   3 -15.822  30.237 -14.709
   24   2HD2  LEU   3          2HD2      LEU   3 -17.107  29.124 -14.220
   25   3HD2  LEU   3          3HD2      LEU   3 -15.446  28.831 -13.695
   26    H    GLU   4           H        GLU   4 -14.010  31.731 -18.669
   27    HA   GLU   4           HA       GLU   4 -13.331  30.312 -21.052
   28   1HB   GLU   4          1HB       GLU   4 -12.603  32.805 -19.860
   29   2HB   GLU   4          2HB       GLU   4 -11.110  31.905 -20.129
   30   1HG   GLU   4          1HG       GLU   4 -11.968  31.498 -22.519
   31   2HG   GLU   4          2HG       GLU   4 -13.176  32.727 -22.158
   32    HA   PRO   5           HA       PRO   5  -9.532  28.467 -18.938
   33   1HB   PRO   5          1HB       PRO   5  -9.072  28.697 -16.232
   34   2HB   PRO   5          2HB       PRO   5  -8.502  29.860 -17.460
   35   1HG   PRO   5          1HG       PRO   5 -10.781  30.131 -15.536
   36   2HG   PRO   5          2HG       PRO   5  -9.738  31.394 -16.255
   37   1HD   PRO   5          1HD       PRO   5 -12.349  30.649 -17.081
   38   2HD   PRO   5          2HD       PRO   5 -11.211  31.707 -17.960
   39    H    VAL   6           H        VAL   6 -10.274  26.476 -19.284
   40    HA   VAL   6           HA       VAL   6 -12.373  25.122 -17.938
   41    HB   VAL   6           HB       VAL   6  -9.960  23.882 -19.314
   42   1HG1  VAL   6          1HG1      VAL   6 -11.150  21.911 -19.612
   43   2HG1  VAL   6          2HG1      VAL   6 -11.707  22.347 -18.008
   44   3HG1  VAL   6          3HG1      VAL   6 -12.734  22.676 -19.396
   45   1HG2  VAL   6          1HG2      VAL   6 -12.620  24.597 -20.632
   46   2HG2  VAL   6          2HG2      VAL   6 -11.167  25.584 -20.794
   47   3HG2  VAL   6          3HG2      VAL   6 -11.163  23.933 -21.401
   48    H    TYR   7           H        TYR   7 -12.417  23.712 -16.223
   49    HA   TYR   7           HA       TYR   7 -10.034  23.568 -14.442
   50   1HB   TYR   7          1HB       TYR   7 -12.875  24.154 -13.975
   51   2HB   TYR   7          2HB       TYR   7 -12.274  22.902 -12.916
   52    HD1  TYR   7           1HD      TYR   7  -9.747  23.423 -11.985
   53    HD2  TYR   7           2HD      TYR   7 -12.812  26.286 -13.004
   54    HE1  TYR   7           1HE      TYR   7  -8.705  25.072 -10.460
   55    HE2  TYR   7           2HE      TYR   7 -11.785  27.926 -11.424
   56    HH   TYR   7           HH       TYR   7  -8.628  27.404 -10.018
   57    HA   PRO   8           HA       PRO   8 -10.620  19.170 -15.686
   58   1HB   PRO   8          1HB       PRO   8  -7.948  18.485 -15.808
   59   2HB   PRO   8          2HB       PRO   8  -8.880  19.194 -17.159
   60   1HG   PRO   8          1HG       PRO   8  -6.891  20.516 -15.344
   61   2HG   PRO   8          2HG       PRO   8  -7.265  20.853 -17.059
   62   1HD   PRO   8          1HD       PRO   8  -8.205  22.305 -14.831
   63   2HD   PRO   8          2HD       PRO   8  -8.862  22.370 -16.494
   64    H    GLY   9           H        GLY   9  -9.434  20.794 -12.987
   65   1HA   GLY   9          1HA       GLY   9  -9.896  20.006 -10.757
   66   2HA   GLY   9          2HA       GLY   9  -9.569  18.356 -11.267
   67    H    ASP  10           H        ASP  10  -8.206  21.245  -9.957
   68    HA   ASP  10           HA       ASP  10  -5.542  19.958  -9.823
   69   1HB   ASP  10          1HB       ASP  10  -5.940  21.909 -11.636
   70   2HB   ASP  10          2HB       ASP  10  -5.620  22.934 -10.251
   71    H    ASN  11           H        ASN  11  -6.140  19.299  -7.738
   72    HA   ASN  11           HA       ASN  11  -5.585  21.253  -5.655
   73   1HB   ASN  11          1HB       ASN  11  -8.034  21.592  -6.042
   74   2HB   ASN  11          2HB       ASN  11  -8.311  19.890  -5.652
   75   1HD2  ASN  11          1HD2      ASN  11  -9.066  19.703  -3.533
   76   2HD2  ASN  11          2HD2      ASN  11  -8.462  20.760  -2.239
   77    H    ALA  12           H        ALA  12  -3.897  20.027  -4.961
   78    HA   ALA  12           HA       ALA  12  -4.477  17.294  -3.925
   79   1HB   ALA  12          1HB       ALA  12  -2.476  18.099  -5.870
   80   2HB   ALA  12          2HB       ALA  12  -1.677  17.493  -4.411
   81   3HB   ALA  12          3HB       ALA  12  -2.884  16.494  -5.252
   82    H    THR  13           H        THR  13  -2.490  16.753  -2.315
   83    HA   THR  13           HA       THR  13  -2.027  18.989  -0.492
   84    HB   THR  13           HB       THR  13  -4.009  18.523   0.495
   85    HG1  THR  13           1HG      THR  13  -3.576  17.072   2.287
   86   1HG2  THR  13          1HG2      THR  13  -4.628  15.925   0.947
   87   2HG2  THR  13          2HG2      THR  13  -5.215  16.878  -0.422
   88   3HG2  THR  13          3HG2      THR  13  -3.844  15.799  -0.644
   89    HA   PRO  14           HA       PRO  14   1.724  16.696   0.040
   90   1HB   PRO  14          1HB       PRO  14   2.682  17.773   2.405
   91   2HB   PRO  14          2HB       PRO  14   2.733  18.617   0.832
   92   1HG   PRO  14          1HG       PRO  14   0.849  19.030   3.133
   93   2HG   PRO  14          2HG       PRO  14   1.479  20.221   1.955
   94   1HD   PRO  14          1HD       PRO  14  -1.036  19.000   1.897
   95   2HD   PRO  14          2HD       PRO  14  -0.263  19.824   0.517
   96    H    GLU  15           H        GLU  15   2.678  15.038   1.334
   97    HA   GLU  15           HA       GLU  15   2.544  13.014   2.304
   98   1HB   GLU  15          1HB       GLU  15   3.060  14.248   4.238
   99   2HB   GLU  15          2HB       GLU  15   1.398  14.765   4.476
  100   1HG   GLU  15          1HG       GLU  15   0.719  12.668   5.323
  101   2HG   GLU  15          2HG       GLU  15   2.064  11.816   4.535
  102    H    GLN  16           H        GLN  16  -0.160  14.254   1.031
  103    HA   GLN  16           HA       GLN  16  -1.847  11.885   1.643
  104   1HB   GLN  16          1HB       GLN  16  -2.730  14.256   1.761
  105   2HB   GLN  16          2HB       GLN  16  -2.406  14.364   0.030
  106   1HG   GLN  16          1HG       GLN  16  -4.663  13.793   0.033
  107   2HG   GLN  16          2HG       GLN  16  -3.905  12.244  -0.192
  108   1HE2  GLN  16          1HE2      GLN  16  -6.346  11.946   0.533
  109   2HE2  GLN  16          2HE2      GLN  16  -6.511  11.679   2.267
  110    H    MET  17           H        MET  17  -0.048  13.435  -1.107
  111    HA   MET  17           HA       MET  17  -1.184  11.723  -3.129
  112   1HB   MET  17          1HB       MET  17   1.032  13.736  -2.842
  113   2HB   MET  17          2HB       MET  17   1.268  12.520  -4.083
  114   1HG   MET  17          1HG       MET  17  -1.271  14.164  -3.840
  115   2HG   MET  17          2HG       MET  17   0.104  14.618  -4.851
  116   1HE   MET  17          1HE       MET  17  -1.506  14.735  -7.038
  117   2HE   MET  17          2HE       MET  17  -2.646  13.434  -7.447
  118    H    ALA  18           H        ALA  18   1.819  11.540  -1.174
  119    HA   ALA  18           HA       ALA  18   2.617   9.008  -2.315
  120   1HB   ALA  18          1HB       ALA  18   3.623   9.504   0.399
  121   2HB   ALA  18          2HB       ALA  18   4.498   9.431  -1.144
  122   3HB   ALA  18          3HB       ALA  18   3.779  10.958  -0.605
  123    H    ARG  19           H        ARG  19   0.291   9.915   0.064
  124    HA   ARG  19           HA       ARG  19   0.133   7.242   1.299
  125   1HB   ARG  19          1HB       ARG  19  -0.488   9.663   2.298
  126   2HB   ARG  19          2HB       ARG  19  -2.071   9.246   1.689
  127   1HG   ARG  19          1HG       ARG  19  -2.061   8.481   3.905
  128   2HG   ARG  19          2HG       ARG  19  -1.749   7.000   2.989
  129   1HD   ARG  19          1HD       ARG  19   0.558   6.981   3.588
  130   2HD   ARG  19          2HD       ARG  19   0.547   8.705   3.985
  131    HE   ARG  19           HE       ARG  19  -1.232   7.313   5.731
  132   1HH1  ARG  19          2HH2      ARG  19   2.156   7.975   5.278
  133   2HH1  ARG  19          1HH2      ARG  19   2.519   7.945   6.980
  134   1HH2  ARG  19          2HH1      ARG  19  -0.737   7.173   7.908
  135   2HH2  ARG  19          1HH1      ARG  19   0.900   7.441   8.428
  136    H    TYR  20           H        TYR  20  -1.918   9.193  -0.939
  137    HA   TYR  20           HA       TYR  20  -4.008   7.430  -1.345
  138   1HB   TYR  20          1HB       TYR  20  -2.611   9.629  -2.832
  139   2HB   TYR  20          2HB       TYR  20  -3.490   8.548  -3.851
  140    HD1  TYR  20           1HD      TYR  20  -3.813  11.604  -2.430
  141    HD2  TYR  20           2HD      TYR  20  -5.961   7.875  -2.665
  142    HE1  TYR  20           1HE      TYR  20  -5.950  12.814  -1.990
  143    HE2  TYR  20           2HE      TYR  20  -8.095   9.088  -2.213
  144    HH   TYR  20           HH       TYR  20  -8.310  12.319  -1.139
  145    H    TYR  21           H        TYR  21  -0.881   7.518  -3.082
  146    HA   TYR  21           HA       TYR  21  -1.369   5.120  -4.616
  147   1HB   TYR  21          1HB       TYR  21   0.180   6.921  -5.262
  148   2HB   TYR  21          2HB       TYR  21   1.186   6.596  -3.859
  149    HD1  TYR  21           1HD      TYR  21   0.249   5.511  -7.224
  150    HD2  TYR  21           2HD      TYR  21   2.509   4.487  -3.704
  151    HE1  TYR  21           1HE      TYR  21   1.470   3.783  -8.515
  152    HE2  TYR  21           2HE      TYR  21   3.709   2.711  -4.996
  153    HH   TYR  21           HH       TYR  21   3.160   2.206  -8.467
  154    H    SER  22           H        SER  22   0.402   5.721  -1.517
  155    HA   SER  22           HA       SER  22   1.345   3.038  -1.235
  156   1HB   SER  22          1HB       SER  22   2.331   4.881  -0.004
  157   2HB   SER  22          2HB       SER  22   0.804   5.191   0.846
  158    HG   SER  22           HG       SER  22   2.074   2.667   0.992
  159    H    ALA  23           H        ALA  23  -1.681   4.570  -0.046
  160    HA   ALA  23           HA       ALA  23  -2.686   2.287   1.339
  161   1HB   ALA  23          1HB       ALA  23  -4.638   3.563   1.599
  162   2HB   ALA  23          2HB       ALA  23  -3.397   4.809   1.440
  163   3HB   ALA  23          3HB       ALA  23  -4.426   4.413   0.054
  164    H    LEU  24           H        LEU  24  -2.782   3.289  -2.090
  165    HA   LEU  24           HA       LEU  24  -4.608   1.296  -2.986
  166   1HB   LEU  24          1HB       LEU  24  -4.300   3.119  -4.439
  167   2HB   LEU  24          2HB       LEU  24  -2.580   3.160  -4.197
  168    HG   LEU  24           HG       LEU  24  -2.437   0.943  -5.475
  169   1HD1  LEU  24          1HD1      LEU  24  -4.706   0.228  -5.491
  170   2HD1  LEU  24          2HD1      LEU  24  -5.287   1.799  -6.107
  171   3HD1  LEU  24          3HD1      LEU  24  -4.352   0.712  -7.157
  172   1HD2  LEU  24          1HD2      LEU  24  -1.715   3.112  -6.380
  173   2HD2  LEU  24          2HD2      LEU  24  -2.352   2.016  -7.605
  174   3HD2  LEU  24          3HD2      LEU  24  -3.356   3.371  -7.023
  175    H    ARG  25           H        ARG  25  -0.973   1.388  -3.069
  176    HA   ARG  25           HA       ARG  25  -0.872  -1.353  -3.869
  177   1HB   ARG  25          1HB       ARG  25   1.037   0.752  -3.269
  178   2HB   ARG  25          2HB       ARG  25   1.542  -0.719  -2.462
  179   1HG   ARG  25          1HG       ARG  25   0.856  -0.425  -5.415
  180   2HG   ARG  25          2HG       ARG  25   2.477  -0.520  -4.741
  181   1HD   ARG  25          1HD       ARG  25   0.898  -2.838  -3.882
  182   2HD   ARG  25          2HD       ARG  25   0.788  -2.666  -5.621
  183    HE   ARG  25           HE       ARG  25   2.999  -3.641  -4.126
  184   1HH1  ARG  25          2HH2      ARG  25   2.470  -1.614  -6.927
  185   2HH1  ARG  25          1HH2      ARG  25   3.959  -2.086  -7.708
  186   1HH2  ARG  25          2HH1      ARG  25   4.956  -4.158  -5.114
  187   2HH2  ARG  25          1HH1      ARG  25   5.370  -3.389  -6.622
  188    H    ARG  26           H        ARG  26  -1.194   0.056  -0.687
  189    HA   ARG  26           HA       ARG  26  -0.630  -2.256   0.866
  190   1HB   ARG  26          1HB       ARG  26  -1.069   0.152   1.645
  191   2HB   ARG  26          2HB       ARG  26  -2.785  -0.183   1.475
  192   1HG   ARG  26          1HG       ARG  26  -1.565  -2.338   3.003
  193   2HG   ARG  26          2HG       ARG  26  -0.970  -0.796   3.606
  194   1HD   ARG  26          1HD       ARG  26  -3.492  -0.065   3.645
  195   2HD   ARG  26          2HD       ARG  26  -3.836  -1.780   3.433
  196    HE   ARG  26           HE       ARG  26  -3.309  -2.125   5.658
  197   1HH1  ARG  26          2HH2      ARG  26  -1.859   0.922   4.749
  198   2HH1  ARG  26          1HH2      ARG  26  -1.195   1.217   6.334
  199   1HH2  ARG  26          2HH1      ARG  26  -2.436  -1.698   7.719
  200   2HH2  ARG  26          1HH1      ARG  26  -1.646  -0.174   7.995
  201    H    TYR  27           H        TYR  27  -3.876  -1.145  -0.381
  202    HA   TYR  27           HA       TYR  27  -5.069  -3.636   0.532
  203   1HB   TYR  27          1HB       TYR  27  -7.080  -2.806  -0.205
  204   2HB   TYR  27          2HB       TYR  27  -6.217  -1.320   0.106
  205    HD1  TYR  27           1HD      TYR  27  -7.168  -3.717  -2.585
  206    HD2  TYR  27           2HD      TYR  27  -6.120   0.333  -1.638
  207    HE1  TYR  27           1HE      TYR  27  -7.565  -3.068  -4.965
  208    HE2  TYR  27           2HE      TYR  27  -6.589   1.009  -3.994
  209    HH   TYR  27           HH       TYR  27  -7.136   0.252  -6.146
  210    H    ILE  28           H        ILE  28  -3.647  -2.585  -2.593
  211    HA   ILE  28           HA       ILE  28  -4.525  -4.926  -4.035
  212    HB   ILE  28           HB       ILE  28  -2.273  -2.918  -4.435
  213   2HG1  ILE  28          2HG1      ILE  28  -4.461  -2.047  -4.816
  214   1HG2  ILE  28          1HG2      ILE  28  -1.804  -3.873  -6.644
  215   2HG2  ILE  28          2HG2      ILE  28  -1.423  -5.029  -5.390
  216   3HG2  ILE  28          3HG2      ILE  28  -2.931  -5.211  -6.322
  217   1HD1  ILE  28          1HD1      ILE  28  -4.654  -1.550  -7.160
  218   2HD1  ILE  28          2HD1      ILE  28  -2.918  -1.538  -6.740
  219   3HD1  ILE  28          3HD1      ILE  28  -3.650  -2.917  -7.615
  220    H    ASN  29           H        ASN  29  -1.487  -4.339  -2.187
  221    HA   ASN  29           HA       ASN  29  -0.385  -6.924  -2.719
  222   1HB   ASN  29          1HB       ASN  29   0.862  -4.906  -1.841
  223   2HB   ASN  29          2HB       ASN  29   0.070  -5.147  -0.280
  224   1HD2  ASN  29          1HD2      ASN  29   1.829  -5.884   1.030
  225   2HD2  ASN  29          2HD2      ASN  29   2.766  -7.297   0.496
  226    H    MET  30           H        MET  30  -2.389  -5.700   0.040
  227    HA   MET  30           HA       MET  30  -2.436  -8.195   1.402
  228   1HB   MET  30          1HB       MET  30  -3.791  -7.165   2.907
  229   2HB   MET  30          2HB       MET  30  -3.086  -5.767   2.160
  230   1HG   MET  30          1HG       MET  30  -5.292  -5.180   2.290
  231   2HG   MET  30          2HG       MET  30  -5.293  -5.877   0.684
  232   1HE   MET  30          1HE       MET  30  -8.372  -6.167   1.296
  233   2HE   MET  30          2HE       MET  30  -8.585  -6.511   3.032
  234    H    LEU  31           H        LEU  31  -4.619  -6.959  -1.184
  235    HA   LEU  31           HA       LEU  31  -6.390  -9.210  -1.083
  236   1HB   LEU  31          1HB       LEU  31  -5.705  -7.012  -3.068
  237   2HB   LEU  31          2HB       LEU  31  -6.750  -8.296  -3.547
  238    HG   LEU  31           HG       LEU  31  -7.279  -6.358  -1.258
  239   1HD1  LEU  31          1HD1      LEU  31  -7.557  -5.578  -3.657
  240   2HD1  LEU  31          2HD1      LEU  31  -8.794  -6.828  -3.859
  241   3HD1  LEU  31          3HD1      LEU  31  -9.039  -5.522  -2.676
  242   1HD2  LEU  31          1HD2      LEU  31  -8.833  -8.803  -2.148
  243   2HD2  LEU  31          2HD2      LEU  31  -8.296  -8.370  -0.509
  244   3HD2  LEU  31          3HD2      LEU  31  -9.591  -7.454  -1.276
  245    H    THR  32           H        THR  32  -3.297  -8.723  -2.599
  246    HA   THR  32           HA       THR  32  -3.518 -11.357  -3.978
  247    HB   THR  32           HB       THR  32  -1.401  -9.269  -4.525
  248    HG1  THR  32           1HG      THR  32  -3.412  -8.379  -4.873
  249   1HG2  THR  32          1HG2      THR  32  -0.846 -11.412  -5.559
  250   2HG2  THR  32          2HG2      THR  32  -2.525 -11.639  -6.093
  251   3HG2  THR  32          3HG2      THR  32  -1.515 -10.372  -6.818
  252    H    ARG  33           H        ARG  33  -2.939 -10.784  -1.043
  253    HA   ARG  33           HA       ARG  33  -0.319 -11.745  -0.431
  254   1HB   ARG  33          1HB       ARG  33  -2.773 -11.214   1.049
  255   2HB   ARG  33          2HB       ARG  33  -2.145 -12.771   1.527
  256   1HG   ARG  33          1HG       ARG  33   0.100 -11.706   1.897
  257   2HG   ARG  33          2HG       ARG  33  -0.676 -10.120   1.644
  258   1HD   ARG  33          1HD       ARG  33  -2.190 -10.501   3.505
  259   2HD   ARG  33          2HD       ARG  33  -1.663 -12.193   3.658
  260    HE   ARG  33           HE       ARG  33   0.664 -10.791   3.985
  261   1HH1  ARG  33          2HH2      ARG  33  -2.385 -10.845   5.717
  262   2HH1  ARG  33          1HH2      ARG  33  -1.675 -10.371   7.225
  263   1HH2  ARG  33          2HH1      ARG  33   1.534 -10.175   5.906
  264   2HH2  ARG  33          1HH1      ARG  33   0.538 -10.021   7.335
  265    HA   PRO  34           HA       PRO  34  -1.885 -16.190  -0.353
  266   1HB   PRO  34          1HB       PRO  34  -4.392 -16.923  -1.220
  267   2HB   PRO  34          2HB       PRO  34  -4.013 -16.404   0.436
  268   1HG   PRO  34          1HG       PRO  34  -5.364 -14.851  -1.745
  269   2HG   PRO  34          2HG       PRO  34  -5.601 -14.768   0.025
  270   1HD   PRO  34          1HD       PRO  34  -4.066 -13.019  -1.565
  271   2HD   PRO  34          2HD       PRO  34  -4.019 -13.136   0.213
  272    H    ARG  35           H        ARG  35  -0.290 -15.934  -1.991
  273    HA   ARG  35           HA       ARG  35  -0.799 -17.423  -4.384
  274   1HB   ARG  35          1HB       ARG  35  -1.235 -14.534  -4.566
  275   2HB   ARG  35          2HB       ARG  35   0.100 -14.956  -5.597
  276   1HG   ARG  35          1HG       ARG  35  -2.191 -16.857  -5.823
  277   2HG   ARG  35          2HG       ARG  35  -2.602 -15.204  -6.226
  278   1HD   ARG  35          1HD       ARG  35  -0.070 -16.402  -7.372
  279   2HD   ARG  35          2HD       ARG  35  -1.638 -16.868  -8.049
  280    HE   ARG  35           HE       ARG  35  -1.648 -14.069  -7.847
  281   1HH1  ARG  35          2HH2      ARG  35   0.085 -16.463  -9.697
  282   2HH1  ARG  35          1HH2      ARG  35   0.320 -15.425 -11.077
  283   1HH2  ARG  35          2HH1      ARG  35  -1.417 -12.761  -9.656
  284   2HH2  ARG  35          1HH1      ARG  35  -0.542 -13.340 -11.040
  285    H    TYR  36           H        TYR  36   0.862 -18.607  -3.441
  286    HA   TYR  36           HA       TYR  36   3.587 -17.603  -4.064
  287   1HB   TYR  36          1HB       TYR  36   2.511 -17.776  -1.433
  288   2HB   TYR  36          2HB       TYR  36   3.550 -19.170  -1.600
  289    HD1  TYR  36           1HD      TYR  36   5.763 -18.837  -0.865
  290    HD2  TYR  36           2HD      TYR  36   3.586 -15.508  -2.523
  291    HE1  TYR  36           1HE      TYR  36   7.689 -17.308  -0.369
  292    HE2  TYR  36           2HE      TYR  36   5.490 -14.013  -2.059
  293    HH   TYR  36           HH       TYR  36   7.533 -13.824  -1.016
  294   1HN   NH2  37          1HN       NH2  37   4.547 -19.095  -5.467
  295   2HN   NH2  37          2HN       NH2  37   4.187 -20.818  -5.326
  Start of MODEL   10
    1   1H    ALA   1          1H        ALA   1 -14.631  32.722  15.372
    2   2H    ALA   1          2H        ALA   1 -13.445  33.722  14.826
    3   3H    ALA   1          3H        ALA   1 -14.225  34.072  16.233
    4    HA   ALA   1           HA       ALA   1 -16.155  34.710  15.207
    5   1HB   ALA   1          1HB       ALA   1 -15.107  35.955  12.964
    6   2HB   ALA   1          2HB       ALA   1 -15.142  36.620  14.600
    7   3HB   ALA   1          3HB       ALA   1 -13.683  35.796  14.008
    8    HA   PRO   2           HA       PRO   2 -16.662  32.631  11.022
    9   1HB   PRO   2          1HB       PRO   2 -14.659  31.022   9.973
   10   2HB   PRO   2          2HB       PRO   2 -14.902  32.746   9.571
   11   1HG   PRO   2          1HG       PRO   2 -12.814  31.508  11.302
   12   2HG   PRO   2          2HG       PRO   2 -12.779  33.052  10.394
   13   1HD   PRO   2          1HD       PRO   2 -13.274  32.657  13.164
   14   2HD   PRO   2          2HD       PRO   2 -13.419  34.193  12.255
   15    H    LEU   3           H        LEU   3 -17.378  30.461  10.530
   16    HA   LEU   3           HA       LEU   3 -17.083  28.545  12.781
   17   1HB   LEU   3          1HB       LEU   3 -19.453  29.464  11.167
   18   2HB   LEU   3          2HB       LEU   3 -19.369  27.750  11.489
   19    HG   LEU   3           HG       LEU   3 -20.736  28.936  13.131
   20   1HD1  LEU   3          1HD1      LEU   3 -20.069  26.991  14.118
   21   2HD1  LEU   3          2HD1      LEU   3 -18.345  27.319  13.958
   22   3HD1  LEU   3          3HD1      LEU   3 -19.272  28.118  15.229
   23   1HD2  LEU   3          1HD2      LEU   3 -19.863  30.469  14.740
   24   2HD2  LEU   3          2HD2      LEU   3 -18.206  30.268  14.143
   25   3HD2  LEU   3          3HD2      LEU   3 -19.425  31.073  13.130
   26    H    GLU   4           H        GLU   4 -16.663  26.491  12.316
   27    HA   GLU   4           HA       GLU   4 -15.710  24.750  11.323
   28   1HB   GLU   4          1HB       GLU   4 -16.964  23.771   9.767
   29   2HB   GLU   4          2HB       GLU   4 -18.006  25.156   9.960
   30   1HG   GLU   4          1HG       GLU   4 -16.560  26.201   7.992
   31   2HG   GLU   4          2HG       GLU   4 -16.055  24.541   7.748
   32    HA   PRO   5           HA       PRO   5 -12.070  26.030   9.083
   33   1HB   PRO   5          1HB       PRO   5 -11.340  23.802   7.599
   34   2HB   PRO   5          2HB       PRO   5 -11.049  24.018   9.349
   35   1HG   PRO   5          1HG       PRO   5 -13.087  22.316   7.985
   36   2HG   PRO   5          2HG       PRO   5 -12.333  22.124   9.598
   37   1HD   PRO   5          1HD       PRO   5 -14.902  23.163   9.009
   38   2HD   PRO   5          2HD       PRO   5 -14.072  23.219  10.592
   39    H    VAL   6           H        VAL   6 -11.392  26.885   7.110
   40    HA   VAL   6           HA       VAL   6 -13.419  27.109   4.982
   41    HB   VAL   6           HB       VAL   6 -10.728  28.483   5.267
   42   1HG1  VAL   6          1HG1      VAL   6 -12.880  28.638   3.198
   43   2HG1  VAL   6          2HG1      VAL   6 -12.340  30.204   3.805
   44   3HG1  VAL   6          3HG1      VAL   6 -11.165  29.085   3.112
   45   1HG2  VAL   6          1HG2      VAL   6 -12.024  30.429   6.075
   46   2HG2  VAL   6          2HG2      VAL   6 -13.522  29.465   6.013
   47   3HG2  VAL   6          3HG2      VAL   6 -12.226  29.059   7.162
   48    H    TYR   7           H        TYR   7 -11.903  24.592   5.496
   49    HA   TYR   7           HA       TYR   7 -10.653  24.176   2.827
   50   1HB   TYR   7          1HB       TYR   7  -9.835  23.115   5.552
   51   2HB   TYR   7          2HB       TYR   7  -9.272  22.400   4.055
   52    HD1  TYR   7           1HD      TYR   7  -8.633  24.964   6.473
   53    HD2  TYR   7           2HD      TYR   7  -8.124  23.949   2.310
   54    HE1  TYR   7           1HE      TYR   7  -6.812  26.650   6.276
   55    HE2  TYR   7           2HE      TYR   7  -6.312  25.630   2.112
   56    HH   TYR   7           HH       TYR   7  -5.281  27.389   3.162
   57    HA   PRO   8           HA       PRO   8 -13.557  20.805   2.482
   58   1HB   PRO   8          1HB       PRO   8 -12.231  19.145   0.707
   59   2HB   PRO   8          2HB       PRO   8 -13.086  20.643   0.257
   60   1HG   PRO   8          1HG       PRO   8 -10.145  20.161   0.492
   61   2HG   PRO   8          2HG       PRO   8 -11.034  21.324  -0.541
   62   1HD   PRO   8          1HD       PRO   8  -9.717  21.866   1.911
   63   2HD   PRO   8          2HD       PRO   8 -10.816  22.965   1.031
   64    H    GLY   9           H        GLY   9 -10.608  20.545   4.055
   65   1HA   GLY   9          1HA       GLY   9 -10.034  19.190   5.874
   66   2HA   GLY   9          2HA       GLY   9 -11.363  18.086   5.479
   67    H    ASP  10           H        ASP  10 -11.044  17.098   3.184
   68    HA   ASP  10           HA       ASP  10  -8.285  16.425   2.433
   69   1HB   ASP  10          1HB       ASP  10  -8.606  14.022   2.710
   70   2HB   ASP  10          2HB       ASP  10  -8.673  14.858   4.253
   71    H    ASN  11           H        ASN  11  -8.245  16.438   0.269
   72    HA   ASN  11           HA       ASN  11  -9.966  14.906  -1.352
   73   1HB   ASN  11          1HB       ASN  11 -11.494  17.004  -0.761
   74   2HB   ASN  11          2HB       ASN  11 -10.481  17.863  -1.876
   75   1HD2  ASN  11          1HD2      ASN  11 -12.527  18.146  -3.060
   76   2HD2  ASN  11          2HD2      ASN  11 -13.091  16.801  -4.060
   77    H    ALA  12           H        ALA  12  -7.623  14.420  -1.719
   78    HA   ALA  12           HA       ALA  12  -5.817  14.323  -3.082
   79   1HB   ALA  12          1HB       ALA  12  -6.010  14.892  -5.279
   80   2HB   ALA  12          2HB       ALA  12  -7.713  15.120  -4.831
   81   3HB   ALA  12          3HB       ALA  12  -6.632  16.511  -4.932
   82    H    THR  13           H        THR  13  -3.956  14.980  -2.067
   83    HA   THR  13           HA       THR  13  -3.342  17.862  -1.983
   84    HB   THR  13           HB       THR  13  -3.291  18.161   0.267
   85    HG1  THR  13           1HG      THR  13  -3.152  16.276   1.712
   86   1HG2  THR  13          1HG2      THR  13  -5.099  17.116   1.539
   87   2HG2  THR  13          2HG2      THR  13  -5.650  17.608  -0.071
   88   3HG2  THR  13          3HG2      THR  13  -5.323  15.892   0.278
   89    HA   PRO  14           HA       PRO  14   0.735  16.344  -2.676
   90   1HB   PRO  14          1HB       PRO  14   2.371  18.123  -1.318
   91   2HB   PRO  14          2HB       PRO  14   1.555  18.453  -2.872
   92   1HG   PRO  14          1HG       PRO  14   0.856  19.443  -0.147
   93   2HG   PRO  14          2HG       PRO  14   0.531  20.180  -1.746
   94   1HD   PRO  14          1HD       PRO  14  -1.262  18.709  -0.116
   95   2HD   PRO  14          2HD       PRO  14  -1.549  19.223  -1.798
   96    H    GLU  15           H        GLU  15  -0.509  16.361   0.532
   97    HA   GLU  15           HA       GLU  15   1.635  14.475   1.411
   98   1HB   GLU  15          1HB       GLU  15   0.704  16.815   2.685
   99   2HB   GLU  15          2HB       GLU  15  -0.164  15.524   3.505
  100   1HG   GLU  15          1HG       GLU  15   2.333  14.424   3.501
  101   2HG   GLU  15          2HG       GLU  15   2.784  16.124   3.396
  102    H    GLN  16           H        GLN  16  -1.645  14.668   0.531
  103    HA   GLN  16           HA       GLN  16  -2.355  12.119   1.852
  104   1HB   GLN  16          1HB       GLN  16  -3.878  14.090   1.894
  105   2HB   GLN  16          2HB       GLN  16  -4.002  14.007   0.130
  106   1HG   GLN  16          1HG       GLN  16  -5.947  13.027   1.320
  107   2HG   GLN  16          2HG       GLN  16  -5.147  11.884   0.246
  108   1HE2  GLN  16          1HE2      GLN  16  -4.843   9.856   1.164
  109   2HE2  GLN  16          2HE2      GLN  16  -4.758   9.630   2.928
  110    H    MET  17           H        MET  17  -1.349  13.295  -1.321
  111    HA   MET  17           HA       MET  17  -2.320  11.090  -2.895
  112   1HB   MET  17          1HB       MET  17  -0.489  13.462  -3.220
  113   2HB   MET  17          2HB       MET  17  -0.194  12.108  -4.255
  114   1HG   MET  17          1HG       MET  17  -3.067  12.692  -4.129
  115   2HG   MET  17          2HG       MET  17  -2.139  14.093  -4.625
  116   1HE   MET  17          1HE       MET  17   0.308  12.618  -6.798
  117   2HE   MET  17          2HE       MET  17  -0.740  13.565  -7.881
  118    H    ALA  18           H        ALA  18   0.799  11.847  -1.244
  119    HA   ALA  18           HA       ALA  18   2.106   9.479  -2.164
  120   1HB   ALA  18          1HB       ALA  18   2.642  10.946   0.453
  121   2HB   ALA  18          2HB       ALA  18   3.774  10.003  -0.534
  122   3HB   ALA  18          3HB       ALA  18   3.187  11.547  -1.130
  123    H    ARG  19           H        ARG  19  -0.147  10.121   0.413
  124    HA   ARG  19           HA       ARG  19   0.161   7.474   1.627
  125   1HB   ARG  19          1HB       ARG  19  -1.069   9.944   2.403
  126   2HB   ARG  19          2HB       ARG  19  -2.351   8.740   2.362
  127   1HG   ARG  19          1HG       ARG  19   0.331   8.335   3.749
  128   2HG   ARG  19          2HG       ARG  19  -1.081   8.987   4.568
  129   1HD   ARG  19          1HD       ARG  19  -1.539   6.403   3.112
  130   2HD   ARG  19          2HD       ARG  19  -0.417   6.306   4.450
  131    HE   ARG  19           HE       ARG  19  -3.306   6.838   4.573
  132   1HH1  ARG  19          2HH2      ARG  19  -0.334   6.967   6.363
  133   2HH1  ARG  19          1HH2      ARG  19  -1.115   7.016   7.929
  134   1HH2  ARG  19          2HH1      ARG  19  -4.313   6.960   6.592
  135   2HH2  ARG  19          1HH1      ARG  19  -3.359   7.038   8.039
  136    H    TYR  20           H        TYR  20  -2.029   8.926  -0.717
  137    HA   TYR  20           HA       TYR  20  -3.906   6.803  -0.965
  138   1HB   TYR  20          1HB       TYR  20  -4.276   9.041  -1.840
  139   2HB   TYR  20          2HB       TYR  20  -2.914   8.910  -2.919
  140    HD1  TYR  20           1HD      TYR  20  -6.365   7.709  -2.308
  141    HD2  TYR  20           2HD      TYR  20  -3.009   7.737  -5.020
  142    HE1  TYR  20           1HE      TYR  20  -7.800   6.742  -4.092
  143    HE2  TYR  20           2HE      TYR  20  -4.447   6.759  -6.803
  144    HH   TYR  20           HH       TYR  20  -7.789   5.755  -6.211
  145    H    TYR  21           H        TYR  21  -1.106   7.560  -3.054
  146    HA   TYR  21           HA       TYR  21  -1.283   5.231  -4.690
  147   1HB   TYR  21          1HB       TYR  21  -0.001   7.205  -5.313
  148   2HB   TYR  21          2HB       TYR  21   1.073   6.998  -3.937
  149    HD1  TYR  21           1HD      TYR  21  -0.133   5.102  -6.973
  150    HD2  TYR  21           2HD      TYR  21   3.123   5.918  -4.261
  151    HE1  TYR  21           1HE      TYR  21   1.353   3.656  -8.334
  152    HE2  TYR  21           2HE      TYR  21   4.615   4.464  -5.621
  153    HH   TYR  21           HH       TYR  21   3.395   2.545  -8.338
  154    H    SER  22           H        SER  22   0.688   5.761  -1.730
  155    HA   SER  22           HA       SER  22   1.866   3.140  -1.692
  156   1HB   SER  22          1HB       SER  22   1.299   5.087   0.583
  157   2HB   SER  22          2HB       SER  22   2.344   3.657   0.690
  158    HG   SER  22           HG       SER  22   3.655   4.623  -0.975
  159    H    ALA  23           H        ALA  23  -1.191   4.441  -0.299
  160    HA   ALA  23           HA       ALA  23  -1.948   2.036   1.042
  161   1HB   ALA  23          1HB       ALA  23  -4.218   2.973   1.009
  162   2HB   ALA  23          2HB       ALA  23  -3.031   4.174   1.551
  163   3HB   ALA  23          3HB       ALA  23  -3.699   4.257  -0.098
  164    H    LEU  24           H        LEU  24  -2.509   3.179  -2.372
  165    HA   LEU  24           HA       LEU  24  -4.123   0.989  -3.178
  166   1HB   LEU  24          1HB       LEU  24  -4.048   2.781  -4.669
  167   2HB   LEU  24          2HB       LEU  24  -2.329   3.019  -4.484
  168    HG   LEU  24           HG       LEU  24  -1.987   0.844  -5.772
  169   1HD1  LEU  24          1HD1      LEU  24  -3.845   0.291  -7.347
  170   2HD1  LEU  24          2HD1      LEU  24  -4.285  -0.031  -5.657
  171   3HD1  LEU  24          3HD1      LEU  24  -4.902   1.420  -6.486
  172   1HD2  LEU  24          1HD2      LEU  24  -1.331   2.768  -6.849
  173   2HD2  LEU  24          2HD2      LEU  24  -2.455   2.032  -7.995
  174   3HD2  LEU  24          3HD2      LEU  24  -2.992   3.398  -6.994
  175    H    ARG  25           H        ARG  25  -0.561   1.299  -3.086
  176    HA   ARG  25           HA       ARG  25  -0.044  -1.315  -4.132
  177   1HB   ARG  25          1HB       ARG  25   1.621   0.665  -3.688
  178   2HB   ARG  25          2HB       ARG  25   1.723   0.037  -2.049
  179   1HG   ARG  25          1HG       ARG  25   3.507  -0.999  -3.173
  180   2HG   ARG  25          2HG       ARG  25   2.284  -2.262  -3.120
  181   1HD   ARG  25          1HD       ARG  25   2.106  -2.339  -5.393
  182   2HD   ARG  25          2HD       ARG  25   1.953  -0.596  -5.517
  183    HE   ARG  25           HE       ARG  25   4.214  -0.347  -5.871
  184   1HH1  ARG  25          2HH2      ARG  25   3.645  -3.674  -4.984
  185   2HH1  ARG  25          1HH2      ARG  25   5.269  -4.188  -5.338
  186   1HH2  ARG  25          2HH1      ARG  25   6.334  -1.005  -6.240
  187   2HH2  ARG  25          1HH1      ARG  25   6.736  -2.690  -6.155
  188    H    ARG  26           H        ARG  26  -0.211  -0.260  -0.735
  189    HA   ARG  26           HA       ARG  26   0.175  -2.864   0.440
  190   1HB   ARG  26          1HB       ARG  26   0.194  -0.428   1.491
  191   2HB   ARG  26          2HB       ARG  26  -1.523  -0.692   1.707
  192   1HG   ARG  26          1HG       ARG  26  -1.062  -1.723   3.634
  193   2HG   ARG  26          2HG       ARG  26  -0.404  -3.081   2.717
  194   1HD   ARG  26          1HD       ARG  26   1.819  -2.390   2.996
  195   2HD   ARG  26          2HD       ARG  26   1.359  -0.692   3.228
  196    HE   ARG  26           HE       ARG  26   0.408  -2.441   5.343
  197   1HH1  ARG  26          2HH2      ARG  26   3.060  -0.425   4.327
  198   2HH1  ARG  26          1HH2      ARG  26   3.565  -0.013   5.939
  199   1HH2  ARG  26          2HH1      ARG  26   1.103  -1.971   7.448
  200   2HH2  ARG  26          1HH1      ARG  26   2.428  -0.884   7.681
  201    H    TYR  27           H        TYR  27  -2.753  -1.107  -0.558
  202    HA   TYR  27           HA       TYR  27  -4.671  -2.941   0.377
  203   1HB   TYR  27          1HB       TYR  27  -5.134  -0.599  -0.325
  204   2HB   TYR  27          2HB       TYR  27  -4.768  -1.033  -1.994
  205    HD1  TYR  27           1HD      TYR  27  -6.850  -0.449  -2.986
  206    HD2  TYR  27           2HD      TYR  27  -6.788  -3.079   0.443
  207    HE1  TYR  27           1HE      TYR  27  -9.277  -0.942  -3.293
  208    HE2  TYR  27           2HE      TYR  27  -9.166  -3.566   0.126
  209    HH   TYR  27           HH       TYR  27 -10.975  -3.302  -1.229
  210    H    ILE  28           H        ILE  28  -3.327  -2.572  -3.002
  211    HA   ILE  28           HA       ILE  28  -4.511  -4.895  -4.067
  212    HB   ILE  28           HB       ILE  28  -1.889  -3.556  -4.744
  213   2HG1  ILE  28          2HG1      ILE  28  -4.184  -2.392  -5.151
  214   1HG2  ILE  28          1HG2      ILE  28  -3.192  -6.043  -5.891
  215   2HG2  ILE  28          2HG2      ILE  28  -2.350  -4.983  -6.995
  216   3HG2  ILE  28          3HG2      ILE  28  -1.467  -5.680  -5.636
  217   1HD1  ILE  28          1HD1      ILE  28  -2.350  -1.492  -6.342
  218   2HD1  ILE  28          2HD1      ILE  28  -2.152  -2.907  -7.368
  219   3HD1  ILE  28          3HD1      ILE  28  -3.560  -1.880  -7.599
  220    H    ASN  29           H        ASN  29  -1.486  -4.647  -2.181
  221    HA   ASN  29           HA       ASN  29  -0.822  -7.432  -2.270
  222   1HB   ASN  29          1HB       ASN  29   0.060  -5.076  -0.820
  223   2HB   ASN  29          2HB       ASN  29  -0.209  -6.362   0.343
  224   1HD2  ASN  29          1HD2      ASN  29   1.867  -5.190  -2.128
  225   2HD2  ASN  29          2HD2      ASN  29   2.978  -6.568  -2.050
  226    H    MET  30           H        MET  30  -2.629  -5.695   0.332
  227    HA   MET  30           HA       MET  30  -3.479  -8.102   1.570
  228   1HB   MET  30          1HB       MET  30  -4.291  -5.209   1.853
  229   2HB   MET  30          2HB       MET  30  -5.157  -6.490   2.705
  230   1HG   MET  30          1HG       MET  30  -2.487  -7.136   3.186
  231   2HG   MET  30          2HG       MET  30  -2.490  -5.383   3.259
  232   1HE   MET  30          1HE       MET  30  -5.450  -4.686   5.358
  233   2HE   MET  30          2HE       MET  30  -3.931  -4.292   6.196
  234    H    LEU  31           H        LEU  31  -4.769  -6.640  -1.253
  235    HA   LEU  31           HA       LEU  31  -7.387  -7.825  -1.084
  236   1HB   LEU  31          1HB       LEU  31  -5.646  -6.515  -3.184
  237   2HB   LEU  31          2HB       LEU  31  -7.109  -7.312  -3.681
  238    HG   LEU  31           HG       LEU  31  -7.150  -5.203  -1.492
  239   1HD1  LEU  31          1HD1      LEU  31  -6.336  -3.853  -3.206
  240   2HD1  LEU  31          2HD1      LEU  31  -7.039  -4.848  -4.495
  241   3HD1  LEU  31          3HD1      LEU  31  -8.054  -3.762  -3.534
  242   1HD2  LEU  31          1HD2      LEU  31  -9.126  -6.728  -1.783
  243   2HD2  LEU  31          2HD2      LEU  31  -9.488  -5.031  -2.069
  244   3HD2  LEU  31          3HD2      LEU  31  -9.282  -6.131  -3.446
  245    H    THR  32           H        THR  32  -4.228  -9.001  -2.011
  246    HA   THR  32           HA       THR  32  -5.380 -11.675  -2.639
  247    HB   THR  32           HB       THR  32  -4.133 -11.893  -4.715
  248    HG1  THR  32           1HG      THR  32  -2.574 -10.320  -4.243
  249   1HG2  THR  32          1HG2      THR  32  -5.833  -9.377  -4.935
  250   2HG2  THR  32          2HG2      THR  32  -5.532 -10.619  -6.169
  251   3HG2  THR  32          3HG2      THR  32  -6.515 -11.013  -4.742
  252    H    ARG  33           H        ARG  33  -4.416 -11.795  -0.476
  253    HA   ARG  33           HA       ARG  33  -2.087 -13.417  -0.447
  254   1HB   ARG  33          1HB       ARG  33  -1.556 -10.563  -0.228
  255   2HB   ARG  33          2HB       ARG  33  -1.177 -11.300   1.297
  256   1HG   ARG  33          1HG       ARG  33  -0.080 -12.755  -1.059
  257   2HG   ARG  33          2HG       ARG  33   0.476 -11.084  -0.878
  258   1HD   ARG  33          1HD       ARG  33   1.069 -11.541   1.506
  259   2HD   ARG  33          2HD       ARG  33   0.637 -13.241   1.282
  260    HE   ARG  33           HE       ARG  33   3.033 -11.840   0.341
  261   1HH1  ARG  33          2HH2      ARG  33   1.052 -14.606  -0.296
  262   2HH1  ARG  33          1HH2      ARG  33   2.293 -15.485  -1.146
  263   1HH2  ARG  33          2HH1      ARG  33   4.615 -12.850  -0.828
  264   2HH2  ARG  33          1HH1      ARG  33   4.302 -14.414  -1.519
  265    HA   PRO  34           HA       PRO  34  -3.485 -12.987   4.063
  266   1HB   PRO  34          1HB       PRO  34  -5.231 -11.033   4.892
  267   2HB   PRO  34          2HB       PRO  34  -3.455 -10.818   4.842
  268   1HG   PRO  34          1HG       PRO  34  -5.537  -9.768   2.999
  269   2HG   PRO  34          2HG       PRO  34  -3.937  -9.093   3.423
  270   1HD   PRO  34          1HD       PRO  34  -4.625 -10.564   1.080
  271   2HD   PRO  34          2HD       PRO  34  -2.982 -10.120   1.611
  272    H    ARG  35           H        ARG  35  -4.721 -14.608   4.256
  273    HA   ARG  35           HA       ARG  35  -7.404 -14.992   4.562
  274   1HB   ARG  35          1HB       ARG  35  -6.770 -14.873   1.651
  275   2HB   ARG  35          2HB       ARG  35  -7.743 -16.251   2.136
  276   1HG   ARG  35          1HG       ARG  35  -9.533 -14.983   2.915
  277   2HG   ARG  35          2HG       ARG  35  -8.561 -13.553   3.208
  278   1HD   ARG  35          1HD       ARG  35  -8.230 -13.796   0.492
  279   2HD   ARG  35          2HD       ARG  35  -9.855 -14.475   0.696
  280    HE   ARG  35           HE       ARG  35  -9.380 -11.946   2.092
  281   1HH1  ARG  35          2HH2      ARG  35 -10.064 -13.162  -1.095
  282   2HH1  ARG  35          1HH2      ARG  35 -10.791 -11.677  -1.657
  283   1HH2  ARG  35          2HH1      ARG  35 -10.387 -10.053   1.374
  284   2HH2  ARG  35          1HH1      ARG  35 -10.973  -9.956  -0.267
  285    H    TYR  36           H        TYR  36  -4.470 -16.399   3.250
  286    HA   TYR  36           HA       TYR  36  -3.516 -18.455   3.426
  287   1HB   TYR  36          1HB       TYR  36  -4.818 -18.064   6.121
  288   2HB   TYR  36          2HB       TYR  36  -3.955 -19.526   5.736
  289    HD1  TYR  36           1HD      TYR  36  -1.755 -19.680   6.379
  290    HD2  TYR  36           2HD      TYR  36  -3.369 -15.790   5.480
  291    HE1  TYR  36           1HE      TYR  36   0.417 -18.624   7.010
  292    HE2  TYR  36           2HE      TYR  36  -1.193 -14.749   6.053
  293    HH   TYR  36           HH       TYR  36   1.074 -15.198   6.481
  294   1HN   NH2  37          1HN       NH2  37  -4.805 -19.350   1.561
  295   2HN   NH2  37          2HN       NH2  37  -6.002 -20.564   2.006
  Start of MODEL   11
    1   1H    ALA   1          1H        ALA   1 -26.275  33.385  -0.526
    2   2H    ALA   1          2H        ALA   1 -25.975  31.768  -0.701
    3   3H    ALA   1          3H        ALA   1 -25.568  32.535   0.694
    4    HA   ALA   1           HA       ALA   1 -24.431  33.209  -1.909
    5   1HB   ALA   1          1HB       ALA   1 -23.640  35.010  -0.858
    6   2HB   ALA   1          2HB       ALA   1 -24.155  34.431   0.740
    7   3HB   ALA   1          3HB       ALA   1 -22.593  33.934   0.072
    8    HA   PRO   2           HA       PRO   2 -21.420  29.954  -0.304
    9   1HB   PRO   2          1HB       PRO   2 -21.936  28.569   2.046
   10   2HB   PRO   2          2HB       PRO   2 -20.903  30.016   1.913
   11   1HG   PRO   2          1HG       PRO   2 -23.653  29.789   3.037
   12   2HG   PRO   2          2HG       PRO   2 -22.366  30.985   3.388
   13   1HD   PRO   2          1HD       PRO   2 -24.631  31.283   1.693
   14   2HD   PRO   2          2HD       PRO   2 -23.277  32.439   1.898
   15    H    LEU   3           H        LEU   3 -21.511  27.495  -0.244
   16    HA   LEU   3           HA       LEU   3 -23.972  26.572  -1.587
   17   1HB   LEU   3          1HB       LEU   3 -21.119  25.973  -1.784
   18   2HB   LEU   3          2HB       LEU   3 -21.972  24.513  -1.301
   19    HG   LEU   3           HG       LEU   3 -23.558  24.840  -3.194
   20   1HD1  LEU   3          1HD1      LEU   3 -22.998  27.394  -3.426
   21   2HD1  LEU   3          2HD1      LEU   3 -21.632  26.851  -4.409
   22   3HD1  LEU   3          3HD1      LEU   3 -23.303  26.439  -4.881
   23   1HD2  LEU   3          1HD2      LEU   3 -22.260  23.472  -4.394
   24   2HD2  LEU   3          2HD2      LEU   3 -21.062  24.727  -4.738
   25   3HD2  LEU   3          3HD2      LEU   3 -20.951  23.786  -3.247
   26    H    GLU   4           H        GLU   4 -25.441  25.298  -0.682
   27    HA   GLU   4           HA       GLU   4 -25.409  24.640   2.112
   28   1HB   GLU   4          1HB       GLU   4 -27.299  24.416  -0.146
   29   2HB   GLU   4          2HB       GLU   4 -27.310  22.967   0.836
   30   1HG   GLU   4          1HG       GLU   4 -28.821  24.034   2.057
   31   2HG   GLU   4          2HG       GLU   4 -27.442  24.761   2.853
   32    HA   PRO   5           HA       PRO   5 -24.473  20.168   0.939
   33   1HB   PRO   5          1HB       PRO   5 -23.692  19.475  -1.634
   34   2HB   PRO   5          2HB       PRO   5 -25.356  19.388  -1.008
   35   1HG   PRO   5          1HG       PRO   5 -24.168  21.378  -2.878
   36   2HG   PRO   5          2HG       PRO   5 -25.876  20.877  -2.675
   37   1HD   PRO   5          1HD       PRO   5 -24.601  23.215  -1.657
   38   2HD   PRO   5          2HD       PRO   5 -26.263  22.646  -1.300
   39    H    VAL   6           H        VAL   6 -22.481  18.984   0.783
   40    HA   VAL   6           HA       VAL   6 -20.126  20.556   1.283
   41    HB   VAL   6           HB       VAL   6 -18.960  18.486   1.542
   42   1HG1  VAL   6          1HG1      VAL   6 -21.282  17.287   2.755
   43   2HG1  VAL   6          2HG1      VAL   6 -19.941  18.160   3.506
   44   3HG1  VAL   6          3HG1      VAL   6 -21.372  19.043   2.988
   45   1HG2  VAL   6          1HG2      VAL   6 -19.620  17.236  -0.413
   46   2HG2  VAL   6          2HG2      VAL   6 -20.007  16.276   1.010
   47   3HG2  VAL   6          3HG2      VAL   6 -21.302  17.131   0.143
   48    H    TYR   7           H        TYR   7 -17.996  19.694   0.103
   49    HA   TYR   7           HA       TYR   7 -18.298  20.582  -2.689
   50   1HB   TYR   7          1HB       TYR   7 -15.773  20.814  -2.445
   51   2HB   TYR   7          2HB       TYR   7 -16.769  21.855  -1.449
   52    HD1  TYR   7           1HD      TYR   7 -14.719  18.725  -1.343
   53    HD2  TYR   7           2HD      TYR   7 -16.660  21.801   0.960
   54    HE1  TYR   7           1HE      TYR   7 -13.448  18.004   0.637
   55    HE2  TYR   7           2HE      TYR   7 -15.425  21.015   2.991
   56    HH   TYR   7           HH       TYR   7 -12.907  18.504   2.830
   57    HA   PRO   8           HA       PRO   8 -17.217  16.473  -4.191
   58   1HB   PRO   8          1HB       PRO   8 -16.094  17.101  -6.646
   59   2HB   PRO   8          2HB       PRO   8 -17.844  17.063  -6.304
   60   1HG   PRO   8          1HG       PRO   8 -16.046  19.432  -6.617
   61   2HG   PRO   8          2HG       PRO   8 -17.802  19.284  -6.928
   62   1HD   PRO   8          1HD       PRO   8 -16.561  20.428  -4.648
   63   2HD   PRO   8          2HD       PRO   8 -18.299  20.024  -4.825
   64    H    GLY   9           H        GLY   9 -14.904  18.898  -3.584
   65   1HA   GLY   9          1HA       GLY   9 -12.821  18.532  -2.477
   66   2HA   GLY   9          2HA       GLY   9 -12.783  16.874  -3.090
   67    H    ASP  10           H        ASP  10 -11.950  20.236  -3.699
   68    HA   ASP  10           HA       ASP  10 -10.664  19.504  -6.269
   69   1HB   ASP  10          1HB       ASP  10 -10.741  21.805  -6.843
   70   2HB   ASP  10          2HB       ASP  10 -12.366  21.355  -6.329
   71    H    ASN  11           H        ASN  11  -8.515  19.943  -6.491
   72    HA   ASN  11           HA       ASN  11  -6.366  20.211  -5.968
   73   1HB   ASN  11          1HB       ASN  11  -7.503  22.457  -4.882
   74   2HB   ASN  11          2HB       ASN  11  -6.742  21.759  -3.457
   75   1HD2  ASN  11          1HD2      ASN  11  -6.240  23.471  -6.435
   76   2HD2  ASN  11          2HD2      ASN  11  -4.473  23.464  -6.314
   77    H    ALA  12           H        ALA  12  -5.211  18.545  -5.337
   78    HA   ALA  12           HA       ALA  12  -6.007  16.839  -3.129
   79   1HB   ALA  12          1HB       ALA  12  -4.431  16.444  -5.362
   80   2HB   ALA  12          2HB       ALA  12  -3.216  16.556  -4.080
   81   3HB   ALA  12          3HB       ALA  12  -4.536  15.369  -3.964
   82    H    THR  13           H        THR  13  -3.597  16.321  -1.771
   83    HA   THR  13           HA       THR  13  -2.964  18.844  -0.405
   84    HB   THR  13           HB       THR  13  -4.730  18.485   0.939
   85    HG1  THR  13           1HG      THR  13  -3.258  18.443   2.441
   86   1HG2  THR  13          1HG2      THR  13  -4.668  15.647   0.147
   87   2HG2  THR  13          2HG2      THR  13  -5.159  15.954   1.827
   88   3HG2  THR  13          3HG2      THR  13  -6.021  16.730   0.488
   89    HA   PRO  14           HA       PRO  14   0.956  16.884  -0.250
   90   1HB   PRO  14          1HB       PRO  14   2.176  18.294   1.814
   91   2HB   PRO  14          2HB       PRO  14   1.963  18.900   0.147
   92   1HG   PRO  14          1HG       PRO  14   0.424  19.618   2.613
   93   2HG   PRO  14          2HG       PRO  14   0.770  20.606   1.162
   94   1HD   PRO  14          1HD       PRO  14  -1.623  19.259   1.753
   95   2HD   PRO  14          2HD       PRO  14  -1.171  19.922   0.160
   96    H    GLU  15           H        GLU  15   2.178  15.408   1.034
   97    HA   GLU  15           HA       GLU  15   2.351  13.527   2.252
   98   1HB   GLU  15          1HB       GLU  15   2.928  14.861   4.056
   99   2HB   GLU  15          2HB       GLU  15   1.301  15.476   4.303
  100   1HG   GLU  15          1HG       GLU  15   0.545  13.433   5.284
  101   2HG   GLU  15          2HG       GLU  15   1.968  12.567   4.663
  102    H    GLN  16           H        GLN  16  -0.745  14.530   1.405
  103    HA   GLN  16           HA       GLN  16  -2.017  12.001   2.253
  104   1HB   GLN  16          1HB       GLN  16  -3.201  14.090   2.579
  105   2HB   GLN  16          2HB       GLN  16  -2.978  14.521   0.892
  106   1HG   GLN  16          1HG       GLN  16  -5.286  13.747   1.345
  107   2HG   GLN  16          2HG       GLN  16  -4.466  12.741   0.155
  108   1HE2  GLN  16          1HE2      GLN  16  -5.945  10.948   0.608
  109   2HE2  GLN  16          2HE2      GLN  16  -5.834  10.158   2.188
  110    H    MET  17           H        MET  17  -0.741  13.494  -0.726
  111    HA   MET  17           HA       MET  17  -1.998  11.632  -2.549
  112   1HB   MET  17          1HB       MET  17  -0.090  13.928  -2.634
  113   2HB   MET  17          2HB       MET  17   0.237  12.683  -3.820
  114   1HG   MET  17          1HG       MET  17  -2.492  13.958  -3.422
  115   2HG   MET  17          2HG       MET  17  -1.302  14.465  -4.629
  116   1HE   MET  17          1HE       MET  17  -3.034  13.163  -7.364
  117   2HE   MET  17          2HE       MET  17  -4.332  13.258  -6.143
  118    H    ALA  18           H        ALA  18   1.243  11.840  -1.010
  119    HA   ALA  18           HA       ALA  18   2.265   9.480  -2.279
  120   1HB   ALA  18          1HB       ALA  18   3.934   9.543  -0.428
  121   2HB   ALA  18          2HB       ALA  18   3.714  11.142  -1.166
  122   3HB   ALA  18          3HB       ALA  18   2.961  10.777   0.402
  123    H    ARG  19           H        ARG  19   0.165  10.003   0.438
  124    HA   ARG  19           HA       ARG  19   0.249   7.189   1.291
  125   1HB   ARG  19          1HB       ARG  19  -0.636   9.562   2.553
  126   2HB   ARG  19          2HB       ARG  19  -2.102   8.634   2.249
  127   1HG   ARG  19          1HG       ARG  19  -1.360   7.828   4.352
  128   2HG   ARG  19          2HG       ARG  19  -0.834   6.594   3.214
  129   1HD   ARG  19          1HD       ARG  19   1.077   6.917   4.542
  130   2HD   ARG  19          2HD       ARG  19   1.427   7.934   3.133
  131    HE   ARG  19           HE       ARG  19   0.035   9.432   5.147
  132   1HH1  ARG  19          2HH2      ARG  19   3.277   8.267   4.458
  133   2HH1  ARG  19          1HH2      ARG  19   4.007   9.453   5.506
  134   1HH2  ARG  19          2HH1      ARG  19   1.000  10.880   6.446
  135   2HH2  ARG  19          1HH1      ARG  19   2.684  11.168   6.429
  136    H    TYR  20           H        TYR  20  -1.863   9.147  -0.747
  137    HA   TYR  20           HA       TYR  20  -3.980   7.386  -1.144
  138   1HB   TYR  20          1HB       TYR  20  -3.620   9.794  -1.966
  139   2HB   TYR  20          2HB       TYR  20  -2.681   9.135  -3.286
  140    HD1  TYR  20           1HD      TYR  20  -6.020   9.609  -1.891
  141    HD2  TYR  20           2HD      TYR  20  -3.759   7.880  -5.127
  142    HE1  TYR  20           1HE      TYR  20  -8.118   9.408  -3.256
  143    HE2  TYR  20           2HE      TYR  20  -5.842   7.687  -6.478
  144    HH   TYR  20           HH       TYR  20  -8.686   7.577  -5.546
  145    H    TYR  21           H        TYR  21  -0.992   7.566  -3.089
  146    HA   TYR  21           HA       TYR  21  -1.600   5.168  -4.638
  147   1HB   TYR  21          1HB       TYR  21   0.771   7.022  -4.339
  148   2HB   TYR  21          2HB       TYR  21   0.952   5.486  -5.172
  149    HD1  TYR  21           1HD      TYR  21  -1.360   8.497  -5.194
  150    HD2  TYR  21           2HD      TYR  21   0.615   5.403  -7.458
  151    HE1  TYR  21           1HE      TYR  21  -2.335   9.408  -7.274
  152    HE2  TYR  21           2HE      TYR  21  -0.322   6.361  -9.564
  153    HH   TYR  21           HH       TYR  21  -2.488   9.182  -9.519
  154    H    SER  22           H        SER  22   0.433   5.831  -1.790
  155    HA   SER  22           HA       SER  22   1.666   3.264  -1.559
  156   1HB   SER  22          1HB       SER  22   2.420   5.276  -0.357
  157   2HB   SER  22          2HB       SER  22   0.902   5.310   0.556
  158    HG   SER  22           HG       SER  22   3.111   3.626   0.826
  159    H    ALA  23           H        ALA  23  -1.464   4.504  -0.278
  160    HA   ALA  23           HA       ALA  23  -2.256   2.086   1.027
  161   1HB   ALA  23          1HB       ALA  23  -4.619   3.106   0.491
  162   2HB   ALA  23          2HB       ALA  23  -3.538   3.926   1.635
  163   3HB   ALA  23          3HB       ALA  23  -3.700   4.525  -0.035
  164    H    LEU  24           H        LEU  24  -2.699   3.179  -2.413
  165    HA   LEU  24           HA       LEU  24  -4.256   0.913  -3.198
  166   1HB   LEU  24          1HB       LEU  24  -4.317   2.673  -4.713
  167   2HB   LEU  24          2HB       LEU  24  -2.617   3.040  -4.523
  168    HG   LEU  24           HG       LEU  24  -2.083   0.927  -5.804
  169   1HD1  LEU  24          1HD1      LEU  24  -3.867   0.121  -7.355
  170   2HD1  LEU  24          2HD1      LEU  24  -4.301  -0.190  -5.661
  171   3HD1  LEU  24          3HD1      LEU  24  -5.046   1.157  -6.542
  172   1HD2  LEU  24          1HD2      LEU  24  -2.033   3.293  -6.719
  173   2HD2  LEU  24          2HD2      LEU  24  -2.179   1.980  -7.893
  174   3HD2  LEU  24          3HD2      LEU  24  -3.616   2.942  -7.456
  175    H    ARG  25           H        ARG  25  -0.699   1.391  -3.100
  176    HA   ARG  25           HA       ARG  25  -0.036  -1.171  -4.148
  177   1HB   ARG  25          1HB       ARG  25   1.348   1.085  -2.953
  178   2HB   ARG  25          2HB       ARG  25   1.926  -0.368  -2.161
  179   1HG   ARG  25          1HG       ARG  25   1.805   0.049  -5.175
  180   2HG   ARG  25          2HG       ARG  25   3.240   0.273  -4.188
  181   1HD   ARG  25          1HD       ARG  25   2.057  -2.376  -3.705
  182   2HD   ARG  25          2HD       ARG  25   2.328  -2.110  -5.432
  183    HE   ARG  25           HE       ARG  25   4.635  -1.347  -3.879
  184   1HH1  ARG  25          2HH2      ARG  25   3.028  -4.201  -5.127
  185   2HH1  ARG  25          1HH2      ARG  25   4.500  -5.145  -5.188
  186   1HH2  ARG  25          2HH1      ARG  25   6.517  -2.574  -4.018
  187   2HH2  ARG  25          1HH1      ARG  25   6.430  -4.214  -4.594
  188    H    ARG  26           H        ARG  26  -0.368  -0.196  -0.722
  189    HA   ARG  26           HA       ARG  26   0.086  -2.876   0.262
  190   1HB   ARG  26          1HB       ARG  26   0.181  -0.520   1.475
  191   2HB   ARG  26          2HB       ARG  26  -1.531  -0.832   1.809
  192   1HG   ARG  26          1HG       ARG  26  -0.925  -2.985   2.883
  193   2HG   ARG  26          2HG       ARG  26   0.780  -2.729   2.482
  194   1HD   ARG  26          1HD       ARG  26   0.958  -0.837   3.926
  195   2HD   ARG  26          2HD       ARG  26  -0.800  -0.733   4.111
  196    HE   ARG  26           HE       ARG  26   0.219  -3.277   5.044
  197   1HH1  ARG  26          2HH2      ARG  26  -0.290   0.018   6.004
  198   2HH1  ARG  26          1HH2      ARG  26  -0.280  -0.334   7.719
  199   1HH2  ARG  26          2HH1      ARG  26   0.115  -3.756   7.241
  200   2HH2  ARG  26          1HH1      ARG  26  -0.171  -2.489   8.392
  201    H    TYR  27           H        TYR  27  -2.915  -1.110  -0.528
  202    HA   TYR  27           HA       TYR  27  -4.815  -2.990   0.342
  203   1HB   TYR  27          1HB       TYR  27  -5.328  -0.693  -0.324
  204   2HB   TYR  27          2HB       TYR  27  -4.815  -1.023  -1.974
  205    HD1  TYR  27           1HD      TYR  27  -7.088  -2.825   0.440
  206    HD2  TYR  27           2HD      TYR  27  -6.645  -0.915  -3.407
  207    HE1  TYR  27           1HE      TYR  27  -9.445  -3.377  -0.114
  208    HE2  TYR  27           2HE      TYR  27  -9.012  -1.436  -3.940
  209    HH   TYR  27           HH       TYR  27 -11.031  -2.415  -3.150
  210    H    ILE  28           H        ILE  28  -3.228  -2.687  -2.890
  211    HA   ILE  28           HA       ILE  28  -4.375  -5.011  -4.075
  212    HB   ILE  28           HB       ILE  28  -1.701  -3.637  -4.488
  213   2HG1  ILE  28          2HG1      ILE  28  -3.997  -2.542  -5.146
  214   1HG2  ILE  28          1HG2      ILE  28  -1.410  -5.992  -5.172
  215   2HG2  ILE  28          2HG2      ILE  28  -2.942  -5.942  -6.075
  216   3HG2  ILE  28          3HG2      ILE  28  -1.531  -5.002  -6.611
  217   1HD1  ILE  28          1HD1      ILE  28  -3.092  -2.073  -7.567
  218   2HD1  ILE  28          2HD1      ILE  28  -2.196  -1.461  -6.157
  219   3HD1  ILE  28          3HD1      ILE  28  -1.628  -2.890  -7.009
  220    H    ASN  29           H        ASN  29  -1.374  -4.729  -2.084
  221    HA   ASN  29           HA       ASN  29  -0.762  -7.508  -2.157
  222   1HB   ASN  29          1HB       ASN  29   0.650  -5.525  -1.300
  223   2HB   ASN  29          2HB       ASN  29  -0.223  -5.699   0.228
  224   1HD2  ASN  29          1HD2      ASN  29   2.651  -6.066  -0.085
  225   2HD2  ASN  29          2HD2      ASN  29   2.888  -7.769   0.331
  226    H    MET  30           H        MET  30  -2.754  -5.695   0.266
  227    HA   MET  30           HA       MET  30  -3.500  -7.955   1.831
  228   1HB   MET  30          1HB       MET  30  -4.735  -5.237   1.301
  229   2HB   MET  30          2HB       MET  30  -5.533  -6.402   2.360
  230   1HG   MET  30          1HG       MET  30  -3.940  -6.266   3.997
  231   2HG   MET  30          2HG       MET  30  -2.620  -6.026   2.865
  232   1HE   MET  30          1HE       MET  30  -5.101  -2.762   4.903
  233   2HE   MET  30          2HE       MET  30  -5.946  -3.791   3.723
  234    H    LEU  31           H        LEU  31  -4.988  -6.741  -1.219
  235    HA   LEU  31           HA       LEU  31  -7.198  -8.538  -1.188
  236   1HB   LEU  31          1HB       LEU  31  -5.674  -6.973  -3.293
  237   2HB   LEU  31          2HB       LEU  31  -6.964  -8.045  -3.754
  238    HG   LEU  31           HG       LEU  31  -7.355  -5.805  -1.725
  239   1HD1  LEU  31          1HD1      LEU  31  -6.615  -4.932  -3.974
  240   2HD1  LEU  31          2HD1      LEU  31  -8.045  -5.720  -4.689
  241   3HD1  LEU  31          3HD1      LEU  31  -8.233  -4.437  -3.479
  242   1HD2  LEU  31          1HD2      LEU  31  -9.273  -7.527  -3.351
  243   2HD2  LEU  31          2HD2      LEU  31  -9.106  -7.472  -1.583
  244   3HD2  LEU  31          3HD2      LEU  31  -9.763  -6.078  -2.448
  245    H    THR  32           H        THR  32  -3.845  -8.949  -2.155
  246    HA   THR  32           HA       THR  32  -4.236 -11.874  -2.487
  247    HB   THR  32           HB       THR  32  -3.009 -11.848  -4.652
  248    HG1  THR  32           1HG      THR  32  -3.372  -9.683  -5.735
  249   1HG2  THR  32          1HG2      THR  32  -4.894 -11.336  -6.047
  250   2HG2  THR  32          2HG2      THR  32  -5.542 -11.975  -4.524
  251   3HG2  THR  32          3HG2      THR  32  -5.584 -10.229  -4.843
  252    H    ARG  33           H        ARG  33  -3.108 -11.510  -0.391
  253    HA   ARG  33           HA       ARG  33  -0.510 -10.665  -0.078
  254   1HB   ARG  33          1HB       ARG  33  -0.366 -12.503   1.795
  255   2HB   ARG  33          2HB       ARG  33  -1.501 -11.186   1.958
  256   1HG   ARG  33          1HG       ARG  33  -2.468 -13.713   0.602
  257   2HG   ARG  33          2HG       ARG  33  -2.141 -13.793   2.331
  258   1HD   ARG  33          1HD       ARG  33  -3.874 -12.531   2.923
  259   2HD   ARG  33          2HD       ARG  33  -3.655 -11.358   1.619
  260    HE   ARG  33           HE       ARG  33  -4.643 -13.557   0.296
  261   1HH1  ARG  33          2HH2      ARG  33  -5.748 -11.559   2.923
  262   2HH1  ARG  33          1HH2      ARG  33  -7.405 -12.059   2.793
  263   1HH2  ARG  33          2HH1      ARG  33  -6.825 -13.840  -0.163
  264   2HH2  ARG  33          1HH1      ARG  33  -8.029 -13.223   0.917
  265    HA   PRO  34           HA       PRO  34   2.166 -13.600  -2.048
  266   1HB   PRO  34          1HB       PRO  34   4.518 -13.372  -0.643
  267   2HB   PRO  34          2HB       PRO  34   3.874 -12.103  -1.719
  268   1HG   PRO  34          1HG       PRO  34   3.808 -12.237   1.283
  269   2HG   PRO  34          2HG       PRO  34   3.974 -10.812   0.211
  270   1HD   PRO  34          1HD       PRO  34   1.611 -11.716   1.455
  271   2HD   PRO  34          2HD       PRO  34   1.710 -10.544   0.120
  272    H    ARG  35           H        ARG  35   0.519 -14.447   0.450
  273    HA   ARG  35           HA       ARG  35   1.723 -16.590   1.853
  274   1HB   ARG  35          1HB       ARG  35  -0.525 -15.498   2.261
  275   2HB   ARG  35          2HB       ARG  35  -1.169 -16.401   0.885
  276   1HG   ARG  35          1HG       ARG  35  -0.920 -18.485   1.981
  277   2HG   ARG  35          2HG       ARG  35   0.212 -17.847   3.172
  278   1HD   ARG  35          1HD       ARG  35  -2.546 -16.642   3.129
  279   2HD   ARG  35          2HD       ARG  35  -2.380 -18.306   3.719
  280    HE   ARG  35           HE       ARG  35  -0.380 -16.850   5.011
  281   1HH1  ARG  35          2HH2      ARG  35  -3.876 -16.845   5.029
  282   2HH1  ARG  35          1HH2      ARG  35  -3.985 -16.372   6.704
  283   1HH2  ARG  35          2HH1      ARG  35  -0.555 -16.198   7.154
  284   2HH2  ARG  35          1HH1      ARG  35  -2.119 -16.015   7.870
  285    H    TYR  36           H        TYR  36   0.661 -16.377  -1.406
  286    HA   TYR  36           HA       TYR  36   1.240 -19.238  -1.984
  287   1HB   TYR  36          1HB       TYR  36  -0.881 -17.577  -2.743
  288   2HB   TYR  36          2HB       TYR  36   0.150 -17.538  -4.153
  289    HD1  TYR  36           1HD      TYR  36   0.559 -19.581  -5.466
  290    HD2  TYR  36           2HD      TYR  36  -1.901 -19.630  -1.921
  291    HE1  TYR  36           1HE      TYR  36  -0.319 -21.845  -6.090
  292    HE2  TYR  36           2HE      TYR  36  -2.762 -21.874  -2.536
  293    HH   TYR  36           HH       TYR  36  -2.623 -23.568  -3.988
  294   1HN   NH2  37          1HN       NH2  37   2.035 -15.912  -3.287
  295   2HN   NH2  37          2HN       NH2  37   3.527 -16.477  -4.022
  Start of MODEL   12
    1   1H    ALA   1          1H        ALA   1  -3.412   6.829 -27.757
    2   2H    ALA   1          2H        ALA   1  -4.856   7.509 -27.351
    3   3H    ALA   1          3H        ALA   1  -4.775   6.407 -28.578
    4    HA   ALA   1           HA       ALA   1  -3.872   7.808 -30.053
    5   1HB   ALA   1          1HB       ALA   1  -4.986  10.235 -29.216
    6   2HB   ALA   1          2HB       ALA   1  -5.749   9.003 -30.223
    7   3HB   ALA   1          3HB       ALA   1  -6.023   9.010 -28.467
    8    HA   PRO   2           HA       PRO   2  -1.097  11.031 -28.051
    9   1HB   PRO   2          1HB       PRO   2  -0.983  11.332 -25.284
   10   2HB   PRO   2          2HB       PRO   2  -1.958  12.304 -26.399
   11   1HG   PRO   2          1HG       PRO   2  -2.877  10.187 -24.554
   12   2HG   PRO   2          2HG       PRO   2  -3.787  11.527 -25.263
   13   1HD   PRO   2          1HD       PRO   2  -3.734   8.779 -26.042
   14   2HD   PRO   2          2HD       PRO   2  -4.577  10.127 -26.867
   15    H    LEU   3           H        LEU   3  -0.942   9.018 -25.108
   16    HA   LEU   3           HA       LEU   3   0.871   7.032 -26.143
   17   1HB   LEU   3          1HB       LEU   3   2.904   7.761 -24.899
   18   2HB   LEU   3          2HB       LEU   3   2.500   8.776 -26.247
   19    HG   LEU   3           HG       LEU   3   1.174   9.870 -23.907
   20   1HD1  LEU   3          1HD1      LEU   3   2.811  10.237 -22.328
   21   2HD1  LEU   3          2HD1      LEU   3   3.093   8.544 -22.756
   22   3HD1  LEU   3          3HD1      LEU   3   4.150   9.810 -23.420
   23   1HD2  LEU   3          1HD2      LEU   3   2.091  10.985 -26.093
   24   2HD2  LEU   3          2HD2      LEU   3   2.157  11.881 -24.569
   25   3HD2  LEU   3          3HD2      LEU   3   3.616  11.097 -25.209
   26    H    GLU   4           H        GLU   4  -1.487   6.819 -24.713
   27    HA   GLU   4           HA       GLU   4  -2.567   6.348 -22.761
   28   1HB   GLU   4          1HB       GLU   4  -1.145   4.258 -23.598
   29   2HB   GLU   4          2HB       GLU   4  -0.366   4.428 -22.045
   30   1HG   GLU   4          1HG       GLU   4  -3.315   3.973 -22.654
   31   2HG   GLU   4          2HG       GLU   4  -2.196   2.837 -21.900
   32    HA   PRO   5           HA       PRO   5   0.112   8.983 -20.003
   33   1HB   PRO   5          1HB       PRO   5  -1.374  11.300 -19.955
   34   2HB   PRO   5          2HB       PRO   5  -0.210  10.898 -21.236
   35   1HG   PRO   5          1HG       PRO   5  -3.209  10.706 -21.302
   36   2HG   PRO   5          2HG       PRO   5  -2.058  11.153 -22.600
   37   1HD   PRO   5          1HD       PRO   5  -3.243   8.606 -22.204
   38   2HD   PRO   5          2HD       PRO   5  -1.818   8.957 -23.227
   39    H    VAL   6           H        VAL   6  -1.221   6.924 -19.110
   40    HA   VAL   6           HA       VAL   6  -2.400   5.934 -17.497
   41    HB   VAL   6           HB       VAL   6  -1.971   6.713 -15.247
   42   1HG1  VAL   6          1HG1      VAL   6   0.672   7.329 -15.777
   43   2HG1  VAL   6          2HG1      VAL   6  -0.024   5.702 -15.671
   44   3HG1  VAL   6          3HG1      VAL   6   0.196   6.473 -17.241
   45   1HG2  VAL   6          1HG2      VAL   6  -2.360   9.181 -15.560
   46   2HG2  VAL   6          2HG2      VAL   6  -0.888   8.776 -14.658
   47   3HG2  VAL   6          3HG2      VAL   6  -0.778   9.276 -16.352
   48    H    TYR   7           H        TYR   7  -3.832   7.206 -15.233
   49    HA   TYR   7           HA       TYR   7  -6.191   8.332 -16.684
   50   1HB   TYR   7          1HB       TYR   7  -6.102   6.613 -14.196
   51   2HB   TYR   7          2HB       TYR   7  -7.546   7.379 -14.861
   52    HD1  TYR   7           1HD      TYR   7  -7.752   6.933 -17.595
   53    HD2  TYR   7           2HD      TYR   7  -5.885   4.329 -14.703
   54    HE1  TYR   7           1HE      TYR   7  -8.098   4.989 -19.116
   55    HE2  TYR   7           2HE      TYR   7  -6.242   2.392 -16.227
   56    HH   TYR   7           HH       TYR   7  -6.525   2.071 -18.775
   57    HA   PRO   8           HA       PRO   8  -4.750  11.674 -13.883
   58   1HB   PRO   8          1HB       PRO   8  -5.160  13.778 -15.632
   59   2HB   PRO   8          2HB       PRO   8  -3.657  12.820 -15.556
   60   1HG   PRO   8          1HG       PRO   8  -5.846  12.715 -17.584
   61   2HG   PRO   8          2HG       PRO   8  -4.104  12.351 -17.766
   62   1HD   PRO   8          1HD       PRO   8  -6.239  10.493 -17.418
   63   2HD   PRO   8          2HD       PRO   8  -4.495  10.142 -17.371
   64    H    GLY   9           H        GLY   9  -6.007  13.674 -13.262
   65   1HA   GLY   9          1HA       GLY   9  -8.257  14.802 -13.410
   66   2HA   GLY   9          2HA       GLY   9  -8.968  13.192 -13.338
   67    H    ASP  10           H        ASP  10  -6.960  12.182 -11.333
   68    HA   ASP  10           HA       ASP  10  -8.219  12.929  -8.900
   69   1HB   ASP  10          1HB       ASP  10  -6.306  11.803  -7.829
   70   2HB   ASP  10          2HB       ASP  10  -6.982  10.833  -9.136
   71    H    ASN  11           H        ASN  11  -7.424  14.128  -7.139
   72    HA   ASN  11           HA       ASN  11  -5.230  15.980  -7.466
   73   1HB   ASN  11          1HB       ASN  11  -7.233  16.958  -8.793
   74   2HB   ASN  11          2HB       ASN  11  -7.999  17.231  -7.227
   75   1HD2  ASN  11          1HD2      ASN  11  -7.518  19.414  -8.799
   76   2HD2  ASN  11          2HD2      ASN  11  -6.095  20.271  -8.173
   77    H    ALA  12           H        ALA  12  -4.365  15.527  -5.552
   78    HA   ALA  12           HA       ALA  12  -5.964  15.965  -3.098
   79   1HB   ALA  12          1HB       ALA  12  -4.955  13.398  -3.944
   80   2HB   ALA  12          2HB       ALA  12  -4.069  13.906  -2.494
   81   3HB   ALA  12          3HB       ALA  12  -5.839  13.838  -2.481
   82    H    THR  13           H        THR  13  -4.072  15.709  -1.221
   83    HA   THR  13           HA       THR  13  -2.602  18.190  -1.653
   84    HB   THR  13           HB       THR  13  -2.440  18.392   0.582
   85    HG1  THR  13           1HG      THR  13  -2.124  16.753   2.008
   86   1HG2  THR  13          1HG2      THR  13  -4.339  17.615   1.790
   87   2HG2  THR  13          2HG2      THR  13  -4.865  17.882   0.124
   88   3HG2  THR  13          3HG2      THR  13  -4.571  16.231   0.707
   89    HA   PRO  14           HA       PRO  14   1.328  16.415  -2.606
   90   1HB   PRO  14          1HB       PRO  14   3.145  17.978  -1.207
   91   2HB   PRO  14          2HB       PRO  14   2.309  18.455  -2.714
   92   1HG   PRO  14          1HG       PRO  14   1.773  19.346   0.083
   93   2HG   PRO  14          2HG       PRO  14   1.462  20.192  -1.463
   94   1HD   PRO  14          1HD       PRO  14  -0.394  18.782   0.145
   95   2HD   PRO  14          2HD       PRO  14  -0.689  19.405  -1.511
   96    H    GLU  15           H        GLU  15   0.190  16.304   0.621
   97    HA   GLU  15           HA       GLU  15   2.215  14.244   1.321
   98   1HB   GLU  15          1HB       GLU  15   1.704  16.609   2.630
   99   2HB   GLU  15          2HB       GLU  15   0.596  15.552   3.488
  100   1HG   GLU  15          1HG       GLU  15   2.345  14.219   4.349
  101   2HG   GLU  15          2HG       GLU  15   3.461  14.666   3.053
  102    H    GLN  16           H        GLN  16  -1.032  14.683   0.532
  103    HA   GLN  16           HA       GLN  16  -1.847  12.119   1.760
  104   1HB   GLN  16          1HB       GLN  16  -3.229  14.262   1.939
  105   2HB   GLN  16          2HB       GLN  16  -3.541  14.088   0.209
  106   1HG   GLN  16          1HG       GLN  16  -5.422  13.198   1.317
  107   2HG   GLN  16          2HG       GLN  16  -4.537  11.782   0.763
  108   1HE2  GLN  16          1HE2      GLN  16  -6.291  12.895   3.391
  109   2HE2  GLN  16          2HE2      GLN  16  -5.386  12.002   4.619
  110    H    MET  17           H        MET  17  -0.962  13.473  -1.402
  111    HA   MET  17           HA       MET  17  -2.077  11.402  -3.034
  112   1HB   MET  17          1HB       MET  17  -0.081  13.653  -3.269
  113   2HB   MET  17          2HB       MET  17   0.070  12.354  -4.417
  114   1HG   MET  17          1HG       MET  17  -2.722  13.125  -4.068
  115   2HG   MET  17          2HG       MET  17  -1.746  14.494  -4.560
  116   1HE   MET  17          1HE       MET  17  -1.394  14.236  -8.108
  117   2HE   MET  17          2HE       MET  17  -0.971  15.004  -6.564
  118    H    ALA  18           H        ALA  18   1.146  11.840  -1.498
  119    HA   ALA  18           HA       ALA  18   2.213   9.376  -2.508
  120   1HB   ALA  18          1HB       ALA  18   2.891  11.269  -0.226
  121   2HB   ALA  18          2HB       ALA  18   3.734   9.720  -0.397
  122   3HB   ALA  18          3HB       ALA  18   3.809  10.908  -1.703
  123    H    ARG  19           H        ARG  19  -0.051  10.079  -0.007
  124    HA   ARG  19           HA       ARG  19   0.246   7.460   1.296
  125   1HB   ARG  19          1HB       ARG  19  -0.673   9.961   2.147
  126   2HB   ARG  19          2HB       ARG  19  -2.165   9.038   2.001
  127   1HG   ARG  19          1HG       ARG  19  -1.573   7.540   3.669
  128   2HG   ARG  19          2HG       ARG  19   0.176   7.706   3.396
  129   1HD   ARG  19          1HD       ARG  19   0.283   9.840   4.391
  130   2HD   ARG  19          2HD       ARG  19  -1.483  10.002   4.458
  131    HE   ARG  19           HE       ARG  19  -0.865   7.703   5.925
  132   1HH1  ARG  19          2HH2      ARG  19  -0.225  11.105   6.161
  133   2HH1  ARG  19          1HH2      ARG  19  -0.079  11.129   7.891
  134   1HH2  ARG  19          2HH1      ARG  19  -0.583   7.681   8.172
  135   2HH2  ARG  19          1HH1      ARG  19  -0.294   9.184   8.998
  136    H    TYR  20           H        TYR  20  -2.228   9.059  -0.749
  137    HA   TYR  20           HA       TYR  20  -4.086   6.981  -0.940
  138   1HB   TYR  20          1HB       TYR  20  -3.182   9.314  -2.577
  139   2HB   TYR  20          2HB       TYR  20  -4.038   8.076  -3.442
  140    HD1  TYR  20           1HD      TYR  20  -6.188   7.111  -2.001
  141    HD2  TYR  20           2HD      TYR  20  -4.573  11.111  -1.931
  142    HE1  TYR  20           1HE      TYR  20  -8.412   7.996  -1.316
  143    HE2  TYR  20           2HE      TYR  20  -6.816  11.990  -1.241
  144    HH   TYR  20           HH       TYR  20  -9.676  10.012  -1.318
  145    H    TYR  21           H        TYR  21  -1.164   7.544  -2.935
  146    HA   TYR  21           HA       TYR  21  -1.456   5.167  -4.506
  147   1HB   TYR  21          1HB       TYR  21  -0.098   7.339  -4.879
  148   2HB   TYR  21          2HB       TYR  21   1.149   6.600  -3.896
  149    HD1  TYR  21           1HD      TYR  21   2.102   4.312  -4.680
  150    HD2  TYR  21           2HD      TYR  21  -0.401   6.807  -7.147
  151    HE1  TYR  21           1HE      TYR  21   2.964   3.167  -6.725
  152    HE2  TYR  21           2HE      TYR  21   0.465   5.682  -9.179
  153    HH   TYR  21           HH       TYR  21   1.982   4.189  -9.985
  154    H    SER  22           H        SER  22   0.498   5.823  -1.509
  155    HA   SER  22           HA       SER  22   1.718   3.227  -1.471
  156   1HB   SER  22          1HB       SER  22   2.489   3.749   0.717
  157   2HB   SER  22          2HB       SER  22   2.588   5.214  -0.253
  158    HG   SER  22           HG       SER  22   0.875   4.589   1.884
  159    H    ALA  23           H        ALA  23  -1.302   4.473  -0.041
  160    HA   ALA  23           HA       ALA  23  -2.109   2.054   1.271
  161   1HB   ALA  23          1HB       ALA  23  -4.486   3.155   0.539
  162   2HB   ALA  23          2HB       ALA  23  -3.529   3.754   1.903
  163   3HB   ALA  23          3HB       ALA  23  -3.467   4.575   0.324
  164    H    LEU  24           H        LEU  24  -2.573   3.181  -2.155
  165    HA   LEU  24           HA       LEU  24  -4.083   0.921  -2.917
  166   1HB   LEU  24          1HB       LEU  24  -2.646   3.065  -4.306
  167   2HB   LEU  24          2HB       LEU  24  -2.423   1.542  -5.148
  168    HG   LEU  24           HG       LEU  24  -5.091   2.781  -4.392
  169   1HD1  LEU  24          1HD1      LEU  24  -3.342   2.907  -6.824
  170   2HD1  LEU  24          2HD1      LEU  24  -5.077   2.713  -7.109
  171   3HD1  LEU  24          3HD1      LEU  24  -4.492   4.086  -6.169
  172   1HD2  LEU  24          1HD2      LEU  24  -4.919   0.535  -6.385
  173   2HD2  LEU  24          2HD2      LEU  24  -4.871   0.117  -4.683
  174   3HD2  LEU  24          3HD2      LEU  24  -6.237   1.029  -5.308
  175    H    ARG  25           H        ARG  25  -0.517   1.312  -2.923
  176    HA   ARG  25           HA       ARG  25   0.060  -1.305  -3.877
  177   1HB   ARG  25          1HB       ARG  25   1.642   0.812  -3.182
  178   2HB   ARG  25          2HB       ARG  25   1.878  -0.169  -1.746
  179   1HG   ARG  25          1HG       ARG  25   3.615  -0.660  -3.352
  180   2HG   ARG  25          2HG       ARG  25   2.585  -2.094  -3.218
  181   1HD   ARG  25          1HD       ARG  25   1.656  -1.802  -5.345
  182   2HD   ARG  25          2HD       ARG  25   1.864  -0.043  -5.304
  183    HE   ARG  25           HE       ARG  25   4.345  -1.599  -5.440
  184   1HH1  ARG  25          2HH2      ARG  25   1.922   0.058  -7.366
  185   2HH1  ARG  25          1HH2      ARG  25   2.982   0.309  -8.733
  186   1HH2  ARG  25          2HH1      ARG  25   5.698  -1.238  -7.190
  187   2HH2  ARG  25          1HH1      ARG  25   5.056  -0.380  -8.590
  188    H    ARG  26           H        ARG  26  -0.222  -0.272  -0.475
  189    HA   ARG  26           HA       ARG  26   0.121  -2.872   0.664
  190   1HB   ARG  26          1HB       ARG  26   0.164  -0.574   1.829
  191   2HB   ARG  26          2HB       ARG  26  -1.595  -0.626   1.809
  192   1HG   ARG  26          1HG       ARG  26  -1.562  -1.855   3.700
  193   2HG   ARG  26          2HG       ARG  26  -0.810  -3.169   2.810
  194   1HD   ARG  26          1HD       ARG  26   1.389  -1.594   3.289
  195   2HD   ARG  26          2HD       ARG  26   0.414  -1.219   4.711
  196    HE   ARG  26           HE       ARG  26   1.902  -3.585   4.187
  197   1HH1  ARG  26          2HH2      ARG  26  -1.152  -2.737   5.631
  198   2HH1  ARG  26          1HH2      ARG  26  -1.312  -4.229   6.519
  199   1HH2  ARG  26          2HH1      ARG  26   1.757  -5.452   5.394
  200   2HH2  ARG  26          1HH1      ARG  26   0.409  -5.668   6.475
  201    H    TYR  27           H        TYR  27  -2.843  -1.156  -0.309
  202    HA   TYR  27           HA       TYR  27  -4.725  -3.084   0.538
  203   1HB   TYR  27          1HB       TYR  27  -5.222  -0.721   0.007
  204   2HB   TYR  27          2HB       TYR  27  -4.848  -1.019  -1.683
  205    HD1  TYR  27           1HD      TYR  27  -6.800  -0.901  -2.965
  206    HD2  TYR  27           2HD      TYR  27  -6.924  -2.852   0.891
  207    HE1  TYR  27           1HE      TYR  27  -9.230  -1.394  -3.266
  208    HE2  TYR  27           2HE      TYR  27  -9.312  -3.357   0.574
  209    HH   TYR  27           HH       TYR  27 -11.116  -3.039  -0.728
  210    H    ILE  28           H        ILE  28  -3.430  -2.517  -2.785
  211    HA   ILE  28           HA       ILE  28  -4.650  -4.711  -4.090
  212    HB   ILE  28           HB       ILE  28  -1.981  -3.336  -4.549
  213   2HG1  ILE  28          2HG1      ILE  28  -4.279  -2.069  -4.826
  214   1HG2  ILE  28          1HG2      ILE  28  -2.160  -4.320  -6.901
  215   2HG2  ILE  28          2HG2      ILE  28  -1.823  -5.506  -5.640
  216   3HG2  ILE  28          3HG2      ILE  28  -3.469  -5.354  -6.298
  217   1HD1  ILE  28          1HD1      ILE  28  -3.323  -1.479  -7.366
  218   2HD1  ILE  28          2HD1      ILE  28  -2.784  -0.714  -5.865
  219   3HD1  ILE  28          3HD1      ILE  28  -1.864  -2.056  -6.539
  220    H    ASN  29           H        ASN  29  -1.523  -4.557  -2.302
  221    HA   ASN  29           HA       ASN  29  -0.866  -7.317  -2.536
  222   1HB   ASN  29          1HB       ASN  29  -0.063  -5.049  -0.793
  223   2HB   ASN  29          2HB       ASN  29  -0.039  -6.589   0.043
  224   1HD2  ASN  29          1HD2      ASN  29   1.399  -8.239  -0.628
  225   2HD2  ASN  29          2HD2      ASN  29   2.710  -7.821  -1.748
  226    H    MET  30           H        MET  30  -2.644  -5.728   0.211
  227    HA   MET  30           HA       MET  30  -3.343  -8.141   1.478
  228   1HB   MET  30          1HB       MET  30  -3.458  -5.871   2.448
  229   2HB   MET  30          2HB       MET  30  -4.872  -5.528   1.452
  230   1HG   MET  30          1HG       MET  30  -5.383  -7.980   2.878
  231   2HG   MET  30          2HG       MET  30  -4.692  -6.839   4.010
  232   1HE   MET  30          1HE       MET  30  -8.251  -6.412   5.123
  233   2HE   MET  30          2HE       MET  30  -6.884  -7.556   5.147
  234    H    LEU  31           H        LEU  31  -4.924  -6.640  -1.319
  235    HA   LEU  31           HA       LEU  31  -7.228  -8.367  -1.336
  236   1HB   LEU  31          1HB       LEU  31  -5.783  -6.506  -3.223
  237   2HB   LEU  31          2HB       LEU  31  -7.044  -7.528  -3.855
  238    HG   LEU  31           HG       LEU  31  -7.515  -5.755  -1.414
  239   1HD1  LEU  31          1HD1      LEU  31  -7.460  -5.020  -4.349
  240   2HD1  LEU  31          2HD1      LEU  31  -8.600  -4.224  -3.249
  241   3HD1  LEU  31          3HD1      LEU  31  -6.867  -4.141  -2.923
  242   1HD2  LEU  31          1HD2      LEU  31  -9.258  -7.291  -3.362
  243   2HD2  LEU  31          2HD2      LEU  31  -9.290  -7.260  -1.585
  244   3HD2  LEU  31          3HD2      LEU  31  -9.901  -5.883  -2.497
  245    H    THR  32           H        THR  32  -3.911  -8.838  -2.316
  246    HA   THR  32           HA       THR  32  -4.579 -11.532  -3.284
  247    HB   THR  32           HB       THR  32  -2.723  -9.987  -5.059
  248    HG1  THR  32           1HG      THR  32  -4.380  -8.634  -5.117
  249   1HG2  THR  32          1HG2      THR  32  -2.839 -12.125  -5.910
  250   2HG2  THR  32          2HG2      THR  32  -4.438 -12.462  -5.199
  251   3HG2  THR  32          3HG2      THR  32  -4.316 -11.512  -6.665
  252    H    ARG  33           H        ARG  33  -3.577 -11.552  -1.069
  253    HA   ARG  33           HA       ARG  33  -1.052 -12.931  -1.272
  254   1HB   ARG  33          1HB       ARG  33  -0.856 -10.113  -0.625
  255   2HB   ARG  33          2HB       ARG  33  -0.480 -11.003   0.810
  256   1HG   ARG  33          1HG       ARG  33   1.034 -12.299  -1.198
  257   2HG   ARG  33          2HG       ARG  33   1.035 -10.601  -1.675
  258   1HD   ARG  33          1HD       ARG  33   2.930 -10.993  -0.206
  259   2HD   ARG  33          2HD       ARG  33   1.747  -9.981   0.647
  260    HE   ARG  33           HE       ARG  33   1.266 -12.761   1.184
  261   1HH1  ARG  33          2HH2      ARG  33   3.495 -10.241   2.119
  262   2HH1  ARG  33          1HH2      ARG  33   3.794 -10.921   3.696
  263   1HH2  ARG  33          2HH1      ARG  33   1.723 -13.667   3.193
  264   2HH2  ARG  33          1HH1      ARG  33   2.814 -12.865   4.259
  265    HA   PRO  34           HA       PRO  34  -2.505 -13.364   3.229
  266   1HB   PRO  34          1HB       PRO  34  -4.652 -11.941   4.211
  267   2HB   PRO  34          2HB       PRO  34  -2.951 -11.388   4.292
  268   1HG   PRO  34          1HG       PRO  34  -5.142 -10.501   2.495
  269   2HG   PRO  34          2HG       PRO  34  -3.710  -9.598   3.083
  270   1HD   PRO  34          1HD       PRO  34  -4.049 -10.844   0.547
  271   2HD   PRO  34          2HD       PRO  34  -2.538 -10.161   1.194
  272    H    ARG  35           H        ARG  35  -3.417 -15.202   3.340
  273    HA   ARG  35           HA       ARG  35  -6.148 -15.903   3.124
  274   1HB   ARG  35          1HB       ARG  35  -6.184 -17.294   1.090
  275   2HB   ARG  35          2HB       ARG  35  -5.961 -15.600   0.714
  276   1HG   ARG  35          1HG       ARG  35  -3.484 -16.015   0.445
  277   2HG   ARG  35          2HG       ARG  35  -3.782 -17.734   0.707
  278   1HD   ARG  35          1HD       ARG  35  -4.306 -18.048  -1.412
  279   2HD   ARG  35          2HD       ARG  35  -5.611 -16.875  -1.328
  280    HE   ARG  35           HE       ARG  35  -2.914 -16.500  -2.400
  281   1HH1  ARG  35          2HH2      ARG  35  -5.708 -14.750  -1.245
  282   2HH1  ARG  35          1HH2      ARG  35  -5.407 -13.346  -2.207
  283   1HH2  ARG  35          2HH1      ARG  35  -2.433 -14.671  -3.541
  284   2HH2  ARG  35          1HH1      ARG  35  -3.515 -13.332  -3.522
  285    H    TYR  36           H        TYR  36  -2.838 -16.978   2.757
  286    HA   TYR  36           HA       TYR  36  -3.197 -19.314   4.531
  287   1HB   TYR  36          1HB       TYR  36  -3.687 -19.964   2.151
  288   2HB   TYR  36          2HB       TYR  36  -2.090 -19.408   1.684
  289    HD1  TYR  36           1HD      TYR  36  -3.923 -21.848   3.844
  290    HD2  TYR  36           2HD      TYR  36  -0.187 -20.834   1.942
  291    HE1  TYR  36           1HE      TYR  36  -3.006 -24.083   4.464
  292    HE2  TYR  36           2HE      TYR  36   0.716 -23.088   2.531
  293    HH   TYR  36           HH       TYR  36  -0.737 -25.165   4.805
  294   1HN   NH2  37          1HN       NH2  37  -1.725 -18.444   6.132
  295   2HN   NH2  37          2HN       NH2  37  -0.066 -18.066   5.669
  Start of MODEL   13
    1   1H    ALA   1          1H        ALA   1 -36.198  12.573   6.085
    2   2H    ALA   1          2H        ALA   1 -35.778  11.549   4.866
    3   3H    ALA   1          3H        ALA   1 -35.185  11.308   6.376
    4    HA   ALA   1           HA       ALA   1 -34.600  13.675   4.734
    5   1HB   ALA   1          1HB       ALA   1 -34.276  14.412   6.905
    6   2HB   ALA   1          2HB       ALA   1 -33.759  12.816   7.501
    7   3HB   ALA   1          3HB       ALA   1 -32.662  13.792   6.501
    8    HA   PRO   2           HA       PRO   2 -32.195  10.320   2.809
    9   1HB   PRO   2          1HB       PRO   2 -32.175  11.443   0.269
   10   2HB   PRO   2          2HB       PRO   2 -33.437  10.357   0.896
   11   1HG   PRO   2          1HG       PRO   2 -33.549  13.312   0.496
   12   2HG   PRO   2          2HG       PRO   2 -34.873  12.114   0.502
   13   1HD   PRO   2          1HD       PRO   2 -34.103  13.859   2.616
   14   2HD   PRO   2          2HD       PRO   2 -35.280  12.510   2.715
   15    H    LEU   3           H        LEU   3 -30.033  10.376   1.895
   16    HA   LEU   3           HA       LEU   3 -28.241  12.183   3.106
   17   1HB   LEU   3          1HB       LEU   3 -27.739   9.861   2.212
   18   2HB   LEU   3          2HB       LEU   3 -27.830  10.530   0.588
   19    HG   LEU   3           HG       LEU   3 -25.967  12.234   1.623
   20   1HD1  LEU   3          1HD1      LEU   3 -24.448  11.110   3.112
   21   2HD1  LEU   3          2HD1      LEU   3 -26.046  11.121   3.866
   22   3HD1  LEU   3          3HD1      LEU   3 -25.435   9.635   3.104
   23   1HD2  LEU   3          1HD2      LEU   3 -25.657  10.935  -0.392
   24   2HD2  LEU   3          2HD2      LEU   3 -24.239  10.785   0.648
   25   3HD2  LEU   3          3HD2      LEU   3 -25.411   9.447   0.557
   26    H    GLU   4           H        GLU   4 -27.287  14.109   2.482
   27    HA   GLU   4           HA       GLU   4 -28.389  15.402   0.065
   28   1HB   GLU   4          1HB       GLU   4 -27.540  16.389   2.765
   29   2HB   GLU   4          2HB       GLU   4 -27.120  17.422   1.416
   30   1HG   GLU   4          1HG       GLU   4 -29.708  16.853   0.728
   31   2HG   GLU   4          2HG       GLU   4 -29.825  16.668   2.472
   32    HA   PRO   5           HA       PRO   5 -24.601  15.488  -2.091
   33   1HB   PRO   5          1HB       PRO   5 -24.664  17.895  -3.431
   34   2HB   PRO   5          2HB       PRO   5 -25.682  16.486  -3.835
   35   1HG   PRO   5          1HG       PRO   5 -26.435  18.992  -2.361
   36   2HG   PRO   5          2HG       PRO   5 -27.426  17.978  -3.455
   37   1HD   PRO   5          1HD       PRO   5 -27.471  17.946  -0.659
   38   2HD   PRO   5          2HD       PRO   5 -28.119  16.656  -1.711
   39    H    VAL   6           H        VAL   6 -22.740  15.558  -1.044
   40    HA   VAL   6           HA       VAL   6 -21.756  18.104   0.184
   41    HB   VAL   6           HB       VAL   6 -21.320  15.253   1.167
   42   1HG1  VAL   6          1HG1      VAL   6 -19.364  16.731   1.641
   43   2HG1  VAL   6          2HG1      VAL   6 -20.454  17.902   2.421
   44   3HG1  VAL   6          3HG1      VAL   6 -20.222  16.281   3.109
   45   1HG2  VAL   6          1HG2      VAL   6 -22.881  17.517   2.496
   46   2HG2  VAL   6          2HG2      VAL   6 -23.626  16.130   1.684
   47   3HG2  VAL   6          3HG2      VAL   6 -22.644  15.867   3.121
   48    H    TYR   7           H        TYR   7 -19.584  18.570  -0.155
   49    HA   TYR   7           HA       TYR   7 -18.019  16.800  -1.940
   50   1HB   TYR   7          1HB       TYR   7 -19.265  19.339  -2.682
   51   2HB   TYR   7          2HB       TYR   7 -17.533  19.506  -2.729
   52    HD1  TYR   7           1HD      TYR   7 -16.408  18.905  -4.709
   53    HD2  TYR   7           2HD      TYR   7 -20.237  17.122  -3.839
   54    HE1  TYR   7           1HE      TYR   7 -16.364  17.766  -6.895
   55    HE2  TYR   7           2HE      TYR   7 -20.208  16.003  -6.067
   56    HH   TYR   7           HH       TYR   7 -17.491  16.436  -8.328
   57    HA   PRO   8           HA       PRO   8 -14.748  18.208   0.783
   58   1HB   PRO   8          1HB       PRO   8 -12.514  17.831  -0.792
   59   2HB   PRO   8          2HB       PRO   8 -13.402  16.527   0.033
   60   1HG   PRO   8          1HG       PRO   8 -13.446  17.286  -2.865
   61   2HG   PRO   8          2HG       PRO   8 -13.665  15.683  -2.106
   62   1HD   PRO   8          1HD       PRO   8 -15.703  17.391  -3.050
   63   2HD   PRO   8          2HD       PRO   8 -15.933  15.982  -1.987
   64    H    GLY   9           H        GLY   9 -15.546  19.813  -2.095
   65   1HA   GLY   9          1HA       GLY   9 -15.310  21.969  -2.873
   66   2HA   GLY   9          2HA       GLY   9 -15.100  22.402  -1.174
   67    H    ASP  10           H        ASP  10 -13.110  20.638  -3.533
   68    HA   ASP  10           HA       ASP  10 -10.990  20.696  -4.206
   69   1HB   ASP  10          1HB       ASP  10 -10.803  23.635  -3.585
   70   2HB   ASP  10          2HB       ASP  10  -9.995  22.706  -4.841
   71    H    ASN  11           H        ASN  11 -10.152  19.308  -2.623
   72    HA   ASN  11           HA       ASN  11  -8.396  20.559  -0.624
   73   1HB   ASN  11          1HB       ASN  11 -10.881  20.033   0.188
   74   2HB   ASN  11          2HB       ASN  11 -10.244  18.409   0.411
   75   1HD2  ASN  11          1HD2      ASN  11 -11.147  20.571   2.321
   76   2HD2  ASN  11          2HD2      ASN  11  -9.719  20.824   3.345
   77    H    ALA  12           H        ALA  12  -6.574  19.753  -1.576
   78    HA   ALA  12           HA       ALA  12  -5.999  16.905  -1.208
   79   1HB   ALA  12          1HB       ALA  12  -6.105  18.282  -3.916
   80   2HB   ALA  12          2HB       ALA  12  -4.992  16.935  -3.632
   81   3HB   ALA  12          3HB       ALA  12  -6.736  16.690  -3.437
   82    H    THR  13           H        THR  13  -3.599  16.488  -1.517
   83    HA   THR  13           HA       THR  13  -1.825  18.766  -1.572
   84    HB   THR  13           HB       THR  13  -2.967  18.387   0.852
   85    HG1  THR  13           1HG      THR  13  -1.470  19.696   1.592
   86   1HG2  THR  13          1HG2      THR  13  -1.850  16.221   1.279
   87   2HG2  THR  13          2HG2      THR  13  -0.280  17.034   1.172
   88   3HG2  THR  13          3HG2      THR  13  -1.413  17.467   2.450
   89    HA   PRO  14           HA       PRO  14   0.930  15.627  -2.932
   90   1HB   PRO  14          1HB       PRO  14   3.427  16.482  -2.108
   91   2HB   PRO  14          2HB       PRO  14   2.501  17.139  -3.481
   92   1HG   PRO  14          1HG       PRO  14   2.950  18.331  -0.791
   93   2HG   PRO  14          2HG       PRO  14   2.575  19.139  -2.340
   94   1HD   PRO  14          1HD       PRO  14   0.824  18.540  -0.195
   95   2HD   PRO  14          2HD       PRO  14   0.311  19.167  -1.774
   96    H    GLU  15           H        GLU  15   1.559  16.444   0.480
   97    HA   GLU  15           HA       GLU  15   2.824  13.995   1.208
   98   1HB   GLU  15          1HB       GLU  15   2.417  16.431   2.484
   99   2HB   GLU  15          2HB       GLU  15   1.288  15.398   3.359
  100   1HG   GLU  15          1HG       GLU  15   3.229  13.728   3.610
  101   2HG   GLU  15          2HG       GLU  15   4.282  14.969   2.930
  102    H    GLN  16           H        GLN  16  -0.482  14.755   0.736
  103    HA   GLN  16           HA       GLN  16  -1.449  12.243   1.971
  104   1HB   GLN  16          1HB       GLN  16  -2.707  14.397   2.219
  105   2HB   GLN  16          2HB       GLN  16  -3.003  14.398   0.474
  106   1HG   GLN  16          1HG       GLN  16  -4.937  13.599   1.775
  107   2HG   GLN  16          2HG       GLN  16  -4.337  12.362   0.673
  108   1HE2  GLN  16          1HE2      GLN  16  -4.755  10.399   1.740
  109   2HE2  GLN  16          2HE2      GLN  16  -4.275  10.162   3.431
  110    H    MET  17           H        MET  17  -0.473  13.461  -1.160
  111    HA   MET  17           HA       MET  17  -1.944  11.574  -2.794
  112   1HB   MET  17          1HB       MET  17  -0.064  13.793  -3.144
  113   2HB   MET  17          2HB       MET  17   0.363  12.468  -4.187
  114   1HG   MET  17          1HG       MET  17  -2.529  13.364  -4.075
  115   2HG   MET  17          2HG       MET  17  -1.337  14.371  -4.889
  116   1HE   MET  17          1HE       MET  17  -2.604  10.151  -6.320
  117   2HE   MET  17          2HE       MET  17  -1.990  10.436  -4.687
  118    H    ALA  18           H        ALA  18   1.424  11.770  -1.548
  119    HA   ALA  18           HA       ALA  18   2.287   9.247  -2.558
  120   1HB   ALA  18          1HB       ALA  18   3.841  10.907  -1.658
  121   2HB   ALA  18          2HB       ALA  18   3.104  10.770  -0.042
  122   3HB   ALA  18          3HB       ALA  18   3.995   9.398  -0.742
  123    H    ARG  19           H        ARG  19   0.224  10.027   0.123
  124    HA   ARG  19           HA       ARG  19   0.292   7.358   1.297
  125   1HB   ARG  19          1HB       ARG  19  -0.725   9.943   2.095
  126   2HB   ARG  19          2HB       ARG  19  -2.065   8.810   2.136
  127   1HG   ARG  19          1HG       ARG  19   0.661   8.323   3.408
  128   2HG   ARG  19          2HG       ARG  19  -0.718   8.970   4.286
  129   1HD   ARG  19          1HD       ARG  19  -1.061   6.339   2.827
  130   2HD   ARG  19          2HD       ARG  19  -0.094   6.361   4.299
  131    HE   ARG  19           HE       ARG  19  -2.312   7.661   5.133
  132   1HH1  ARG  19          2HH2      ARG  19  -2.063   4.556   3.472
  133   2HH1  ARG  19          1HH2      ARG  19  -3.561   3.980   4.204
  134   1HH2  ARG  19          2HH1      ARG  19  -4.120   6.695   6.142
  135   2HH2  ARG  19          1HH1      ARG  19  -4.650   5.126   5.535
  136    H    TYR  20           H        TYR  20  -2.111   9.131  -0.731
  137    HA   TYR  20           HA       TYR  20  -4.093   7.165  -0.952
  138   1HB   TYR  20          1HB       TYR  20  -3.072   9.468  -2.559
  139   2HB   TYR  20          2HB       TYR  20  -3.910   8.267  -3.481
  140    HD1  TYR  20           1HD      TYR  20  -6.269   7.494  -2.606
  141    HD2  TYR  20           2HD      TYR  20  -4.317  11.175  -1.502
  142    HE1  TYR  20           1HE      TYR  20  -8.475   8.468  -1.970
  143    HE2  TYR  20           2HE      TYR  20  -6.529  12.146  -0.853
  144    HH   TYR  20           HH       TYR  20  -9.503  10.264  -0.793
  145    H    TYR  21           H        TYR  21  -1.120   7.521  -2.910
  146    HA   TYR  21           HA       TYR  21  -1.587   5.144  -4.462
  147   1HB   TYR  21          1HB       TYR  21  -0.185   7.253  -4.969
  148   2HB   TYR  21          2HB       TYR  21   1.079   6.511  -3.998
  149    HD1  TYR  21           1HD      TYR  21  -1.292   5.701  -6.821
  150    HD2  TYR  21           2HD      TYR  21   2.657   5.176  -5.157
  151    HE1  TYR  21           1HE      TYR  21  -0.578   4.502  -8.891
  152    HE2  TYR  21           2HE      TYR  21   3.372   3.995  -7.218
  153    HH   TYR  21           HH       TYR  21   2.791   3.439  -9.349
  154    H    SER  22           H        SER  22   0.431   5.753  -1.549
  155    HA   SER  22           HA       SER  22   1.583   3.123  -1.358
  156   1HB   SER  22          1HB       SER  22   1.174   5.435   0.501
  157   2HB   SER  22          2HB       SER  22   1.410   3.854   1.246
  158    HG   SER  22           HG       SER  22   3.109   5.073  -0.668
  159    H    ALA  23           H        ALA  23  -1.495   4.457  -0.094
  160    HA   ALA  23           HA       ALA  23  -2.330   2.071   1.233
  161   1HB   ALA  23          1HB       ALA  23  -3.370   4.621   1.039
  162   2HB   ALA  23          2HB       ALA  23  -4.459   3.726  -0.031
  163   3HB   ALA  23          3HB       ALA  23  -4.250   3.213   1.651
  164    H    LEU  24           H        LEU  24  -2.696   3.170  -2.177
  165    HA   LEU  24           HA       LEU  24  -4.240   0.948  -3.046
  166   1HB   LEU  24          1HB       LEU  24  -2.972   3.194  -4.265
  167   2HB   LEU  24          2HB       LEU  24  -2.299   1.790  -5.075
  168    HG   LEU  24           HG       LEU  24  -5.246   2.467  -4.796
  169   1HD1  LEU  24          1HD1      LEU  24  -3.258   3.402  -6.642
  170   2HD1  LEU  24          2HD1      LEU  24  -4.281   2.271  -7.533
  171   3HD1  LEU  24          3HD1      LEU  24  -5.015   3.644  -6.690
  172   1HD2  LEU  24          1HD2      LEU  24  -4.980   0.015  -4.880
  173   2HD2  LEU  24          2HD2      LEU  24  -5.668   0.621  -6.381
  174   3HD2  LEU  24          3HD2      LEU  24  -3.950   0.167  -6.319
  175    H    ARG  25           H        ARG  25  -0.665   1.358  -2.991
  176    HA   ARG  25           HA       ARG  25  -0.064  -1.252  -3.924
  177   1HB   ARG  25          1HB       ARG  25   1.532   0.823  -3.277
  178   2HB   ARG  25          2HB       ARG  25   1.684  -0.049  -1.757
  179   1HG   ARG  25          1HG       ARG  25   3.493  -0.681  -3.222
  180   2HG   ARG  25          2HG       ARG  25   2.443  -2.089  -3.033
  181   1HD   ARG  25          1HD       ARG  25   1.616  -1.952  -5.211
  182   2HD   ARG  25          2HD       ARG  25   1.910  -0.205  -5.329
  183    HE   ARG  25           HE       ARG  25   4.436  -1.372  -5.139
  184   1HH1  ARG  25          2HH2      ARG  25   1.795  -1.432  -7.410
  185   2HH1  ARG  25          1HH2      ARG  25   2.827  -1.708  -8.800
  186   1HH2  ARG  25          2HH1      ARG  25   5.742  -1.677  -6.950
  187   2HH2  ARG  25          1HH1      ARG  25   5.031  -1.851  -8.525
  188    H    ARG  26           H        ARG  26  -0.435  -0.209  -0.525
  189    HA   ARG  26           HA       ARG  26  -0.118  -2.825   0.556
  190   1HB   ARG  26          1HB       ARG  26  -0.201  -0.442   1.707
  191   2HB   ARG  26          2HB       ARG  26  -1.911  -0.768   1.884
  192   1HG   ARG  26          1HG       ARG  26  -1.513  -2.138   3.647
  193   2HG   ARG  26          2HG       ARG  26  -0.466  -3.158   2.667
  194   1HD   ARG  26          1HD       ARG  26   1.224  -1.073   3.143
  195   2HD   ARG  26          2HD       ARG  26   0.211  -1.002   4.603
  196    HE   ARG  26           HE       ARG  26   0.957  -3.693   4.230
  197   1HH1  ARG  26          2HH2      ARG  26   2.559  -0.683   4.906
  198   2HH1  ARG  26          1HH2      ARG  26   3.941  -1.416   5.679
  199   1HH2  ARG  26          2HH1      ARG  26   2.799  -4.654   5.170
  200   2HH2  ARG  26          1HH1      ARG  26   4.049  -3.648   5.836
  201    H    TYR  27           H        TYR  27  -3.143  -1.116  -0.324
  202    HA   TYR  27           HA       TYR  27  -5.017  -3.104   0.393
  203   1HB   TYR  27          1HB       TYR  27  -5.541  -0.771  -0.138
  204   2HB   TYR  27          2HB       TYR  27  -5.004  -0.991  -1.796
  205    HD1  TYR  27           1HD      TYR  27  -7.514  -2.299   0.673
  206    HD2  TYR  27           2HD      TYR  27  -6.583  -1.492  -3.462
  207    HE1  TYR  27           1HE      TYR  27  -9.857  -2.832   0.043
  208    HE2  TYR  27           2HE      TYR  27  -8.938  -2.007  -4.092
  209    HH   TYR  27           HH       TYR  27 -11.381  -2.929  -1.665
  210    H    ILE  28           H        ILE  28  -3.210  -2.650  -2.686
  211    HA   ILE  28           HA       ILE  28  -4.403  -4.922  -4.004
  212    HB   ILE  28           HB       ILE  28  -1.919  -3.264  -4.505
  213   2HG1  ILE  28          2HG1      ILE  28  -3.171  -2.069  -6.061
  214   1HG2  ILE  28          1HG2      ILE  28  -1.315  -5.278  -5.558
  215   2HG2  ILE  28          2HG2      ILE  28  -2.972  -5.606  -6.109
  216   3HG2  ILE  28          3HG2      ILE  28  -2.018  -4.302  -6.855
  217   1HD1  ILE  28          1HD1      ILE  28  -5.606  -2.684  -6.605
  218   2HD1  ILE  28          2HD1      ILE  28  -4.342  -3.583  -7.453
  219   3HD1  ILE  28          3HD1      ILE  28  -5.201  -4.329  -6.084
  220    H    ASN  29           H        ASN  29  -1.309  -4.497  -2.204
  221    HA   ASN  29           HA       ASN  29  -0.471  -7.215  -2.420
  222   1HB   ASN  29          1HB       ASN  29   0.530  -4.860  -1.192
  223   2HB   ASN  29          2HB       ASN  29   0.269  -5.959   0.140
  224   1HD2  ASN  29          1HD2      ASN  29   1.095  -8.387  -0.512
  225   2HD2  ASN  29          2HD2      ASN  29   2.744  -8.288  -1.169
  226    H    MET  30           H        MET  30  -2.813  -5.693  -0.258
  227    HA   MET  30           HA       MET  30  -3.160  -8.087   1.361
  228   1HB   MET  30          1HB       MET  30  -4.140  -5.292   1.512
  229   2HB   MET  30          2HB       MET  30  -5.188  -6.521   2.179
  230   1HG   MET  30          1HG       MET  30  -3.978  -6.743   3.998
  231   2HG   MET  30          2HG       MET  30  -2.555  -7.178   3.090
  232   1HE   MET  30          1HE       MET  30  -3.611  -2.904   4.451
  233   2HE   MET  30          2HE       MET  30  -4.098  -3.417   2.821
  234    H    LEU  31           H        LEU  31  -4.848  -6.663  -1.428
  235    HA   LEU  31           HA       LEU  31  -7.232  -8.154  -1.276
  236   1HB   LEU  31          1HB       LEU  31  -7.326  -6.419  -2.753
  237   2HB   LEU  31          2HB       LEU  31  -5.666  -6.586  -3.280
  238    HG   LEU  31           HG       LEU  31  -6.139  -8.326  -4.758
  239   1HD1  LEU  31          1HD1      LEU  31  -7.796  -9.781  -4.477
  240   2HD1  LEU  31          2HD1      LEU  31  -8.583  -8.761  -3.261
  241   3HD1  LEU  31          3HD1      LEU  31  -8.980  -8.565  -4.969
  242   1HD2  LEU  31          1HD2      LEU  31  -8.118  -6.961  -6.101
  243   2HD2  LEU  31          2HD2      LEU  31  -7.533  -5.737  -4.967
  244   3HD2  LEU  31          3HD2      LEU  31  -6.407  -6.551  -6.073
  245    H    THR  32           H        THR  32  -4.260  -8.799  -3.023
  246    HA   THR  32           HA       THR  32  -5.118 -11.642  -3.475
  247    HB   THR  32           HB       THR  32  -2.963  -9.988  -4.790
  248    HG1  THR  32           1HG      THR  32  -5.446 -10.116  -5.169
  249   1HG2  THR  32          1HG2      THR  32  -2.023 -12.189  -4.926
  250   2HG2  THR  32          2HG2      THR  32  -3.620 -12.938  -5.166
  251   3HG2  THR  32          3HG2      THR  32  -2.891 -11.955  -6.445
  252    H    ARG  33           H        ARG  33  -3.727 -10.216  -0.963
  253    HA   ARG  33           HA       ARG  33  -1.463 -11.694  -0.210
  254   1HB   ARG  33          1HB       ARG  33  -3.356 -10.010   1.023
  255   2HB   ARG  33          2HB       ARG  33  -3.339 -11.392   2.043
  256   1HG   ARG  33          1HG       ARG  33  -0.739 -10.033   1.244
  257   2HG   ARG  33          2HG       ARG  33  -1.755  -9.425   2.547
  258   1HD   ARG  33          1HD       ARG  33  -0.606 -10.777   3.852
  259   2HD   ARG  33          2HD       ARG  33  -1.646 -12.068   3.240
  260    HE   ARG  33           HE       ARG  33   0.354 -12.078   1.384
  261   1HH1  ARG  33          2HH2      ARG  33   0.417 -12.209   4.852
  262   2HH1  ARG  33          1HH2      ARG  33   2.011 -12.879   4.960
  263   1HH2  ARG  33          2HH1      ARG  33   2.333 -13.049   1.456
  264   2HH2  ARG  33          1HH1      ARG  33   3.107 -13.367   2.986
  265    HA   PRO  34           HA       PRO  34  -4.005 -15.369   1.285
  266   1HB   PRO  34          1HB       PRO  34  -6.720 -15.573   0.949
  267   2HB   PRO  34          2HB       PRO  34  -5.959 -14.747   2.334
  268   1HG   PRO  34          1HG       PRO  34  -7.254 -13.544  -0.092
  269   2HG   PRO  34          2HG       PRO  34  -7.173 -12.923   1.585
  270   1HD   PRO  34          1HD       PRO  34  -5.533 -12.195  -0.608
  271   2HD   PRO  34          2HD       PRO  34  -5.278 -11.758   1.098
  272    H    ARG  35           H        ARG  35  -3.714 -14.199  -1.664
  273    HA   ARG  35           HA       ARG  35  -3.532 -14.972  -3.765
  274   1HB   ARG  35          1HB       ARG  35  -2.746 -17.069  -1.945
  275   2HB   ARG  35          2HB       ARG  35  -3.458 -17.837  -3.327
  276   1HG   ARG  35          1HG       ARG  35  -1.448 -15.628  -3.837
  277   2HG   ARG  35          2HG       ARG  35  -0.876 -17.146  -3.141
  278   1HD   ARG  35          1HD       ARG  35  -2.150 -18.345  -5.019
  279   2HD   ARG  35          2HD       ARG  35  -2.283 -16.755  -5.804
  280    HE   ARG  35           HE       ARG  35   0.415 -17.127  -5.077
  281   1HH1  ARG  35          2HH2      ARG  35  -1.812 -18.616  -7.286
  282   2HH1  ARG  35          1HH2      ARG  35  -0.570 -19.359  -8.264
  283   1HH2  ARG  35          2HH1      ARG  35   2.012 -18.043  -6.321
  284   2HH2  ARG  35          1HH1      ARG  35   1.589 -19.037  -7.681
  285    H    TYR  36           H        TYR  36  -5.665 -14.105  -4.171
  286    HA   TYR  36           HA       TYR  36  -7.519 -16.175  -5.148
  287   1HB   TYR  36          1HB       TYR  36  -7.902 -14.710  -2.701
  288   2HB   TYR  36          2HB       TYR  36  -9.026 -14.049  -3.859
  289    HD1  TYR  36           1HD      TYR  36  -8.872 -16.286  -1.293
  290    HD2  TYR  36           2HD      TYR  36 -10.079 -16.173  -5.430
  291    HE1  TYR  36           1HE      TYR  36 -10.392 -18.225  -0.915
  292    HE2  TYR  36           2HE      TYR  36 -11.559 -18.124  -5.062
  293    HH   TYR  36           HH       TYR  36 -12.160 -19.775  -3.569
  294   1HN   NH2  37          1HN       NH2  37  -8.563 -15.587  -7.107
  295   2HN   NH2  37          2HN       NH2  37  -8.435 -13.932  -7.702
  Start of MODEL   14
    1   1H    ALA   1          1H        ALA   1 -23.929  -0.831 -10.613
    2   2H    ALA   1          2H        ALA   1 -23.432  -2.351 -10.239
    3   3H    ALA   1          3H        ALA   1 -22.482  -1.062  -9.865
    4    HA   ALA   1           HA       ALA   1 -22.045  -2.528 -11.946
    5   1HB   ALA   1          1HB       ALA   1 -23.565  -2.344 -13.546
    6   2HB   ALA   1          2HB       ALA   1 -24.452  -1.071 -12.678
    7   3HB   ALA   1          3HB       ALA   1 -23.108  -0.652 -13.761
    8    HA   PRO   2           HA       PRO   2 -19.722   1.418 -12.916
    9   1HB   PRO   2          1HB       PRO   2 -20.295   3.822 -11.645
   10   2HB   PRO   2          2HB       PRO   2 -20.898   3.321 -13.247
   11   1HG   PRO   2          1HG       PRO   2 -22.343   3.378 -10.644
   12   2HG   PRO   2          2HG       PRO   2 -22.989   3.536 -12.302
   13   1HD   PRO   2          1HD       PRO   2 -23.067   1.242 -10.668
   14   2HD   PRO   2          2HD       PRO   2 -23.384   1.288 -12.426
   15    H    LEU   3           H        LEU   3 -20.818   1.207  -9.592
   16    HA   LEU   3           HA       LEU   3 -19.863   1.000  -7.568
   17   1HB   LEU   3          1HB       LEU   3 -17.590   0.028  -9.278
   18   2HB   LEU   3          2HB       LEU   3 -17.281   0.332  -7.582
   19    HG   LEU   3           HG       LEU   3 -19.638  -1.374  -8.420
   20   1HD1  LEU   3          1HD1      LEU   3 -17.256  -2.162  -9.328
   21   2HD1  LEU   3          2HD1      LEU   3 -17.038  -2.705  -7.662
   22   3HD1  LEU   3          3HD1      LEU   3 -18.402  -3.305  -8.624
   23   1HD2  LEU   3          1HD2      LEU   3 -19.390  -0.529  -6.025
   24   2HD2  LEU   3          2HD2      LEU   3 -19.421  -2.294  -6.175
   25   3HD2  LEU   3          3HD2      LEU   3 -17.880  -1.443  -5.922
   26    H    GLU   4           H        GLU   4 -19.532   2.631  -6.166
   27    HA   GLU   4           HA       GLU   4 -19.419   4.832  -5.700
   28   1HB   GLU   4          1HB       GLU   4 -16.837   3.436  -5.733
   29   2HB   GLU   4          2HB       GLU   4 -16.649   5.179  -5.785
   30   1HG   GLU   4          1HG       GLU   4 -16.674   4.540  -3.513
   31   2HG   GLU   4          2HG       GLU   4 -18.171   5.411  -3.828
   32    HA   PRO   5           HA       PRO   5 -19.186   6.458 -10.021
   33   1HB   PRO   5          1HB       PRO   5 -21.753   7.432 -10.263
   34   2HB   PRO   5          2HB       PRO   5 -21.269   5.751 -10.596
   35   1HG   PRO   5          1HG       PRO   5 -22.636   6.867  -8.152
   36   2HG   PRO   5          2HG       PRO   5 -22.875   5.288  -8.959
   37   1HD   PRO   5          1HD       PRO   5 -21.328   5.727  -6.667
   38   2HD   PRO   5          2HD       PRO   5 -21.172   4.322  -7.757
   39    H    VAL   6           H        VAL   6 -17.685   7.787  -8.884
   40    HA   VAL   6           HA       VAL   6 -18.583  10.615  -8.582
   41    HB   VAL   6           HB       VAL   6 -16.624   9.080  -6.812
   42   1HG1  VAL   6          1HG1      VAL   6 -16.516  11.196  -5.472
   43   2HG1  VAL   6          2HG1      VAL   6 -15.746  11.331  -7.040
   44   3HG1  VAL   6          3HG1      VAL   6 -17.370  12.042  -6.780
   45   1HG2  VAL   6          1HG2      VAL   6 -18.303   9.843  -5.011
   46   2HG2  VAL   6          2HG2      VAL   6 -19.405  10.248  -6.345
   47   3HG2  VAL   6          3HG2      VAL   6 -18.853   8.573  -6.109
   48    H    TYR   7           H        TYR   7 -16.976  12.185  -9.052
   49    HA   TYR   7           HA       TYR   7 -14.844  11.311 -10.919
   50   1HB   TYR   7          1HB       TYR   7 -15.410  13.370 -12.232
   51   2HB   TYR   7          2HB       TYR   7 -16.661  12.142 -12.239
   52    HD1  TYR   7           1HD      TYR   7 -18.777  12.457 -10.985
   53    HD2  TYR   7           2HD      TYR   7 -15.788  15.564 -11.177
   54    HE1  TYR   7           1HE      TYR   7 -20.416  14.104 -10.080
   55    HE2  TYR   7           2HE      TYR   7 -17.425  17.199 -10.299
   56    HH   TYR   7           HH       TYR   7 -19.523  17.433  -9.299
   57    HA   PRO   8           HA       PRO   8 -12.313  13.992  -8.395
   58   1HB   PRO   8          1HB       PRO   8 -10.287  14.640 -10.160
   59   2HB   PRO   8          2HB       PRO   8 -10.443  13.072  -9.322
   60   1HG   PRO   8          1HG       PRO   8 -11.063  13.745 -12.174
   61   2HG   PRO   8          2HG       PRO   8 -10.508  12.199 -11.464
   62   1HD   PRO   8          1HD       PRO   8 -13.158  12.885 -12.181
   63   2HD   PRO   8          2HD       PRO   8 -12.664  11.490 -11.178
   64    H    GLY   9           H        GLY   9 -12.550  16.083  -7.849
   65   1HA   GLY   9          1HA       GLY   9 -13.063  18.186  -9.925
   66   2HA   GLY   9          2HA       GLY   9 -14.166  17.949  -8.562
   67    H    ASP  10           H        ASP  10 -10.641  18.079  -8.925
   68    HA   ASP  10           HA       ASP  10  -8.945  19.082  -7.812
   69   1HB   ASP  10          1HB       ASP  10 -10.055  21.005  -8.968
   70   2HB   ASP  10          2HB       ASP  10 -10.803  21.444  -7.429
   71    H    ASN  11           H        ASN  11  -8.788  17.614  -6.168
   72    HA   ASN  11           HA       ASN  11  -8.976  18.663  -3.508
   73   1HB   ASN  11          1HB       ASN  11 -11.359  17.902  -3.867
   74   2HB   ASN  11          2HB       ASN  11 -10.764  16.265  -4.140
   75   1HD2  ASN  11          1HD2      ASN  11 -11.201  18.855  -1.722
   76   2HD2  ASN  11          2HD2      ASN  11 -10.976  17.721  -0.374
   77    H    ALA  12           H        ALA  12  -6.684  18.234  -3.661
   78    HA   ALA  12           HA       ALA  12  -6.005  15.671  -2.588
   79   1HB   ALA  12          1HB       ALA  12  -6.019  15.078  -5.031
   80   2HB   ALA  12          2HB       ALA  12  -4.803  16.344  -5.315
   81   3HB   ALA  12          3HB       ALA  12  -4.427  14.939  -4.287
   82    H    THR  13           H        THR  13  -3.605  15.590  -2.089
   83    HA   THR  13           HA       THR  13  -2.273  18.206  -1.967
   84    HB   THR  13           HB       THR  13  -2.111  18.373   0.355
   85    HG1  THR  13           1HG      THR  13  -3.311  15.949   0.901
   86   1HG2  THR  13          1HG2      THR  13  -4.467  18.865  -0.252
   87   2HG2  THR  13          2HG2      THR  13  -4.904  17.180   0.110
   88   3HG2  THR  13          3HG2      THR  13  -4.301  18.237   1.398
   89    HA   PRO  14           HA       PRO  14   1.249  15.514  -2.338
   90   1HB   PRO  14          1HB       PRO  14   3.276  16.918  -1.075
   91   2HB   PRO  14          2HB       PRO  14   2.626  17.280  -2.696
   92   1HG   PRO  14          1HG       PRO  14   2.113  18.705  -0.113
   93   2HG   PRO  14          2HG       PRO  14   2.120  19.346  -1.784
   94   1HD   PRO  14          1HD       PRO  14  -0.125  18.662  -0.237
   95   2HD   PRO  14          2HD       PRO  14  -0.132  18.971  -1.995
   96    H    GLU  15           H        GLU  15  -0.190  16.064   0.702
   97    HA   GLU  15           HA       GLU  15   1.501  13.979   1.990
   98   1HB   GLU  15          1HB       GLU  15   1.025  16.362   3.006
   99   2HB   GLU  15          2HB       GLU  15  -0.584  15.725   3.370
  100   1HG   GLU  15          1HG       GLU  15   0.439  13.938   4.748
  101   2HG   GLU  15          2HG       GLU  15   2.051  14.464   4.251
  102    H    GLN  16           H        GLN  16  -1.551  14.495   0.564
  103    HA   GLN  16           HA       GLN  16  -2.728  12.056   1.808
  104   1HB   GLN  16          1HB       GLN  16  -3.957  14.346   1.499
  105   2HB   GLN  16          2HB       GLN  16  -4.099  13.870  -0.185
  106   1HG   GLN  16          1HG       GLN  16  -6.059  12.963   0.547
  107   2HG   GLN  16          2HG       GLN  16  -5.035  11.590   0.952
  108   1HE2  GLN  16          1HE2      GLN  16  -7.014  11.218   2.433
  109   2HE2  GLN  16          2HE2      GLN  16  -6.876  12.015   4.019
  110    H    MET  17           H        MET  17  -1.505  13.280  -1.359
  111    HA   MET  17           HA       MET  17  -2.366  11.048  -2.946
  112   1HB   MET  17          1HB       MET  17  -0.551  13.452  -3.211
  113   2HB   MET  17          2HB       MET  17  -0.338  12.143  -4.328
  114   1HG   MET  17          1HG       MET  17  -3.168  12.991  -3.894
  115   2HG   MET  17          2HG       MET  17  -2.124  14.145  -4.726
  116   1HE   MET  17          1HE       MET  17  -4.811  11.809  -5.757
  117   2HE   MET  17          2HE       MET  17  -4.460  13.498  -6.198
  118    H    ALA  18           H        ALA  18   0.688  11.900  -1.188
  119    HA   ALA  18           HA       ALA  18   2.088   9.562  -2.093
  120   1HB   ALA  18          1HB       ALA  18   3.705  10.817  -1.162
  121   2HB   ALA  18          2HB       ALA  18   2.559  11.806  -0.259
  122   3HB   ALA  18          3HB       ALA  18   3.132  10.278   0.424
  123    H    ARG  19           H        ARG  19  -0.278  10.126   0.398
  124    HA   ARG  19           HA       ARG  19   0.143   7.456   1.573
  125   1HB   ARG  19          1HB       ARG  19  -1.159   9.906   2.425
  126   2HB   ARG  19          2HB       ARG  19  -2.345   8.626   2.461
  127   1HG   ARG  19          1HG       ARG  19   0.376   8.645   3.817
  128   2HG   ARG  19          2HG       ARG  19  -1.173   8.819   4.618
  129   1HD   ARG  19          1HD       ARG  19  -0.853   6.270   3.057
  130   2HD   ARG  19          2HD       ARG  19   0.257   6.483   4.388
  131    HE   ARG  19           HE       ARG  19  -1.441   6.268   5.908
  132   1HH1  ARG  19          2HH2      ARG  19  -2.933   6.386   2.715
  133   2HH1  ARG  19          1HH2      ARG  19  -4.529   6.081   3.369
  134   1HH2  ARG  19          2HH1      ARG  19  -3.458   5.866   6.660
  135   2HH2  ARG  19          1HH1      ARG  19  -4.810   5.778   5.581
  136    H    TYR  20           H        TYR  20  -1.908   8.849  -0.862
  137    HA   TYR  20           HA       TYR  20  -3.835   6.715  -1.047
  138   1HB   TYR  20          1HB       TYR  20  -4.231   8.932  -1.991
  139   2HB   TYR  20          2HB       TYR  20  -2.848   8.794  -3.042
  140    HD1  TYR  20           1HD      TYR  20  -6.320   7.650  -2.492
  141    HD2  TYR  20           2HD      TYR  20  -2.862   7.472  -5.078
  142    HE1  TYR  20           1HE      TYR  20  -7.696   6.591  -4.272
  143    HE2  TYR  20           2HE      TYR  20  -4.251   6.397  -6.846
  144    HH   TYR  20           HH       TYR  20  -7.644   5.515  -6.314
  145    H    TYR  21           H        TYR  21  -1.001   7.501  -3.061
  146    HA   TYR  21           HA       TYR  21  -1.068   5.157  -4.665
  147   1HB   TYR  21          1HB       TYR  21   0.218   7.188  -5.171
  148   2HB   TYR  21          2HB       TYR  21   1.308   6.856  -3.832
  149    HD1  TYR  21           1HD      TYR  21   0.126   5.616  -7.155
  150    HD2  TYR  21           2HD      TYR  21   3.141   5.309  -4.081
  151    HE1  TYR  21           1HE      TYR  21   1.551   4.288  -8.692
  152    HE2  TYR  21           2HE      TYR  21   4.562   3.961  -5.628
  153    HH   TYR  21           HH       TYR  21   3.929   3.668  -8.985
  154    H    SER  22           H        SER  22   0.826   5.687  -1.667
  155    HA   SER  22           HA       SER  22   1.934   3.040  -1.513
  156   1HB   SER  22          1HB       SER  22   1.530   5.324   0.405
  157   2HB   SER  22          2HB       SER  22   1.934   3.724   1.060
  158    HG   SER  22           HG       SER  22   3.795   5.013   0.502
  159    H    ALA  23           H        ALA  23  -1.144   4.397  -0.246
  160    HA   ALA  23           HA       ALA  23  -1.941   1.955   1.055
  161   1HB   ALA  23          1HB       ALA  23  -2.983   4.054   1.659
  162   2HB   ALA  23          2HB       ALA  23  -3.624   4.266   0.007
  163   3HB   ALA  23          3HB       ALA  23  -4.201   2.936   1.029
  164    H    LEU  24           H        LEU  24  -2.374   3.161  -2.347
  165    HA   LEU  24           HA       LEU  24  -4.068   1.056  -3.223
  166   1HB   LEU  24          1HB       LEU  24  -3.877   2.941  -4.621
  167   2HB   LEU  24          2HB       LEU  24  -2.149   3.034  -4.452
  168    HG   LEU  24           HG       LEU  24  -1.973   0.916  -5.826
  169   1HD1  LEU  24          1HD1      LEU  24  -3.893   0.498  -7.365
  170   2HD1  LEU  24          2HD1      LEU  24  -4.296   0.145  -5.675
  171   3HD1  LEU  24          3HD1      LEU  24  -4.871   1.646  -6.443
  172   1HD2  LEU  24          1HD2      LEU  24  -2.612   3.656  -6.752
  173   2HD2  LEU  24          2HD2      LEU  24  -1.225   2.603  -7.100
  174   3HD2  LEU  24          3HD2      LEU  24  -2.743   2.392  -7.982
  175    H    ARG  25           H        ARG  25  -0.486   1.282  -3.061
  176    HA   ARG  25           HA       ARG  25  -0.023  -1.339  -4.114
  177   1HB   ARG  25          1HB       ARG  25   1.728   0.529  -3.674
  178   2HB   ARG  25          2HB       ARG  25   1.686   0.046  -1.980
  179   1HG   ARG  25          1HG       ARG  25   3.563  -1.032  -2.994
  180   2HG   ARG  25          2HG       ARG  25   2.366  -2.296  -2.684
  181   1HD   ARG  25          1HD       ARG  25   1.756  -2.444  -4.979
  182   2HD   ARG  25          2HD       ARG  25   2.501  -0.879  -5.369
  183    HE   ARG  25           HE       ARG  25   4.625  -2.358  -4.499
  184   1HH1  ARG  25          2HH2      ARG  25   2.277  -2.898  -7.029
  185   2HH1  ARG  25          1HH2      ARG  25   3.371  -3.812  -8.032
  186   1HH2  ARG  25          2HH1      ARG  25   6.030  -3.528  -5.804
  187   2HH2  ARG  25          1HH1      ARG  25   5.477  -4.115  -7.338
  188    H    ARG  26           H        ARG  26  -0.251  -0.311  -0.668
  189    HA   ARG  26           HA       ARG  26  -0.069  -2.990   0.339
  190   1HB   ARG  26          1HB       ARG  26   0.185  -0.838   1.678
  191   2HB   ARG  26          2HB       ARG  26  -1.580  -0.732   1.722
  192   1HG   ARG  26          1HG       ARG  26  -0.707  -3.448   2.451
  193   2HG   ARG  26          2HG       ARG  26   0.164  -2.276   3.423
  194   1HD   ARG  26          1HD       ARG  26  -1.825  -1.415   4.388
  195   2HD   ARG  26          2HD       ARG  26  -2.837  -2.098   3.115
  196    HE   ARG  26           HE       ARG  26  -2.977  -4.070   4.216
  197   1HH1  ARG  26          2HH2      ARG  26  -0.385  -2.307   5.788
  198   2HH1  ARG  26          1HH2      ARG  26  -0.244  -3.442   7.084
  199   1HH2  ARG  26          2HH1      ARG  26  -2.693  -5.572   5.843
  200   2HH2  ARG  26          1HH1      ARG  26  -1.475  -5.330   7.057
  201    H    TYR  27           H        TYR  27  -2.938  -1.060  -0.523
  202    HA   TYR  27           HA       TYR  27  -4.949  -2.893   0.204
  203   1HB   TYR  27          1HB       TYR  27  -5.295  -0.528  -0.471
  204   2HB   TYR  27          2HB       TYR  27  -4.855  -0.925  -2.125
  205    HD1  TYR  27           1HD      TYR  27  -6.369  -2.705  -3.356
  206    HD2  TYR  27           2HD      TYR  27  -7.524  -0.517   0.170
  207    HE1  TYR  27           1HE      TYR  27  -8.748  -3.187  -3.847
  208    HE2  TYR  27           2HE      TYR  27  -9.923  -0.970  -0.353
  209    HH   TYR  27           HH       TYR  27 -11.219  -2.807  -1.621
  210    H    ILE  28           H        ILE  28  -3.238  -2.629  -2.980
  211    HA   ILE  28           HA       ILE  28  -4.559  -4.945  -4.074
  212    HB   ILE  28           HB       ILE  28  -1.979  -3.524  -4.794
  213   2HG1  ILE  28          2HG1      ILE  28  -4.227  -2.320  -5.056
  214   1HG2  ILE  28          1HG2      ILE  28  -2.820  -6.160  -5.709
  215   2HG2  ILE  28          2HG2      ILE  28  -3.004  -5.048  -7.035
  216   3HG2  ILE  28          3HG2      ILE  28  -1.439  -5.174  -6.221
  217   1HD1  ILE  28          1HD1      ILE  28  -2.465  -1.559  -6.516
  218   2HD1  ILE  28          2HD1      ILE  28  -2.681  -2.933  -7.612
  219   3HD1  ILE  28          3HD1      ILE  28  -3.962  -1.740  -7.470
  220    H    ASN  29           H        ASN  29  -1.367  -4.602  -2.428
  221    HA   ASN  29           HA       ASN  29  -0.753  -7.406  -2.530
  222   1HB   ASN  29          1HB       ASN  29   0.744  -5.290  -2.137
  223   2HB   ASN  29          2HB       ASN  29   0.303  -5.472  -0.438
  224   1HD2  ASN  29          1HD2      ASN  29   0.575  -8.033   0.213
  225   2HD2  ASN  29          2HD2      ASN  29   2.188  -8.615  -0.268
  226    H    MET  30           H        MET  30  -3.013  -5.713  -0.551
  227    HA   MET  30           HA       MET  30  -3.138  -7.862   1.485
  228   1HB   MET  30          1HB       MET  30  -2.985  -5.516   2.246
  229   2HB   MET  30          2HB       MET  30  -4.451  -5.118   1.335
  230   1HG   MET  30          1HG       MET  30  -5.688  -6.777   2.727
  231   2HG   MET  30          2HG       MET  30  -4.223  -7.057   3.664
  232   1HE   MET  30          1HE       MET  30  -7.281  -6.235   4.226
  233   2HE   MET  30          2HE       MET  30  -7.502  -4.629   4.954
  234    H    LEU  31           H        LEU  31  -5.020  -6.492  -1.235
  235    HA   LEU  31           HA       LEU  31  -7.528  -7.526  -0.764
  236   1HB   LEU  31          1HB       LEU  31  -7.589  -6.201  -2.591
  237   2HB   LEU  31          2HB       LEU  31  -5.945  -6.564  -3.052
  238    HG   LEU  31           HG       LEU  31  -6.549  -8.528  -4.220
  239   1HD1  LEU  31          1HD1      LEU  31  -8.370  -9.693  -3.432
  240   2HD1  LEU  31          2HD1      LEU  31  -9.205  -8.233  -2.892
  241   3HD1  LEU  31          3HD1      LEU  31  -9.255  -8.728  -4.596
  242   1HD2  LEU  31          1HD2      LEU  31  -6.733  -6.308  -5.337
  243   2HD2  LEU  31          2HD2      LEU  31  -7.674  -7.611  -6.073
  244   3HD2  LEU  31          3HD2      LEU  31  -8.500  -6.386  -5.071
  245    H    THR  32           H        THR  32  -4.953  -9.059  -2.593
  246    HA   THR  32           HA       THR  32  -6.383 -11.626  -2.626
  247    HB   THR  32           HB       THR  32  -4.865 -11.065  -4.458
  248    HG1  THR  32           1HG      THR  32  -5.382 -13.218  -3.794
  249   1HG2  THR  32          1HG2      THR  32  -2.905 -10.057  -3.784
  250   2HG2  THR  32          2HG2      THR  32  -2.717 -11.062  -2.333
  251   3HG2  THR  32          3HG2      THR  32  -2.346 -11.732  -3.922
  252    H    ARG  33           H        ARG  33  -4.298 -10.066  -0.498
  253    HA   ARG  33           HA       ARG  33  -3.215 -10.431   1.424
  254   1HB   ARG  33          1HB       ARG  33  -5.416 -11.133   2.202
  255   2HB   ARG  33          2HB       ARG  33  -5.165 -12.755   1.595
  256   1HG   ARG  33          1HG       ARG  33  -4.837 -13.083   3.795
  257   2HG   ARG  33          2HG       ARG  33  -3.186 -12.897   3.262
  258   1HD   ARG  33          1HD       ARG  33  -3.442 -10.391   3.940
  259   2HD   ARG  33          2HD       ARG  33  -4.924 -10.883   4.739
  260    HE   ARG  33           HE       ARG  33  -2.233 -11.287   5.687
  261   1HH1  ARG  33          2HH2      ARG  33  -5.347 -12.854   5.795
  262   2HH1  ARG  33          1HH2      ARG  33  -4.915 -13.875   7.139
  263   1HH2  ARG  33          2HH1      ARG  33  -1.703 -12.590   7.468
  264   2HH2  ARG  33          1HH1      ARG  33  -2.898 -13.660   8.097
  265    HA   PRO  34           HA       PRO  34  -0.072 -13.543   0.395
  266   1HB   PRO  34          1HB       PRO  34   1.690 -13.198   2.452
  267   2HB   PRO  34          2HB       PRO  34   1.522 -12.061   1.091
  268   1HG   PRO  34          1HG       PRO  34   0.452 -11.799   3.884
  269   2HG   PRO  34          2HG       PRO  34   1.116 -10.535   2.808
  270   1HD   PRO  34          1HD       PRO  34  -1.595 -11.104   3.222
  271   2HD   PRO  34          2HD       PRO  34  -0.949 -10.166   1.846
  272    H    ARG  35           H        ARG  35  -2.288 -14.680   1.042
  273    HA   ARG  35           HA       ARG  35  -2.190 -16.361   3.450
  274   1HB   ARG  35          1HB       ARG  35  -4.321 -15.726   2.377
  275   2HB   ARG  35          2HB       ARG  35  -3.866 -16.579   0.901
  276   1HG   ARG  35          1HG       ARG  35  -4.130 -18.681   1.846
  277   2HG   ARG  35          2HG       ARG  35  -3.850 -18.123   3.500
  278   1HD   ARG  35          1HD       ARG  35  -6.007 -17.202   3.725
  279   2HD   ARG  35          2HD       ARG  35  -6.350 -17.298   1.995
  280    HE   ARG  35           HE       ARG  35  -6.657 -19.401   3.969
  281   1HH1  ARG  35          2HH2      ARG  35  -6.096 -18.900   0.565
  282   2HH1  ARG  35          1HH2      ARG  35  -6.569 -20.521   0.109
  283   1HH2  ARG  35          2HH1      ARG  35  -7.275 -21.467   3.369
  284   2HH2  ARG  35          1HH1      ARG  35  -7.238 -21.948   1.690
  285    H    TYR  36           H        TYR  36  -0.504 -16.369   0.542
  286    HA   TYR  36           HA       TYR  36  -0.063 -19.250   0.329
  287   1HB   TYR  36          1HB       TYR  36  -0.164 -17.402  -1.544
  288   2HB   TYR  36          2HB       TYR  36   1.497 -17.066  -1.083
  289    HD1  TYR  36           1HD      TYR  36   3.251 -18.448  -2.014
  290    HD2  TYR  36           2HD      TYR  36  -0.851 -19.780  -2.133
  291    HE1  TYR  36           1HE      TYR  36   3.902 -20.300  -3.534
  292    HE2  TYR  36           2HE      TYR  36  -0.193 -21.652  -3.646
  293    HH   TYR  36           HH       TYR  36   3.080 -21.940  -4.954
  294   1HN   NH2  37          1HN       NH2  37   1.970 -20.362   0.849
  295   2HN   NH2  37          2HN       NH2  37   3.117 -19.537   1.901
  Start of MODEL   15
    1   1H    ALA   1          1H        ALA   1 -12.167   6.605 -21.333
    2   2H    ALA   1          2H        ALA   1 -13.549   5.709 -21.481
    3   3H    ALA   1          3H        ALA   1 -13.617   7.195 -20.776
    4    HA   ALA   1           HA       ALA   1 -12.728   4.691 -19.654
    5   1HB   ALA   1          1HB       ALA   1 -10.664   5.866 -19.535
    6   2HB   ALA   1          2HB       ALA   1 -11.450   7.390 -19.065
    7   3HB   ALA   1          3HB       ALA   1 -11.388   6.020 -17.937
    8    HA   PRO   2           HA       PRO   2 -16.240   5.938 -17.155
    9   1HB   PRO   2          1HB       PRO   2 -15.902   4.473 -14.844
   10   2HB   PRO   2          2HB       PRO   2 -16.387   3.772 -16.415
   11   1HG   PRO   2          1HG       PRO   2 -13.705   3.699 -15.058
   12   2HG   PRO   2          2HG       PRO   2 -14.471   2.485 -16.125
   13   1HD   PRO   2          1HD       PRO   2 -12.504   4.367 -16.874
   14   2HD   PRO   2          2HD       PRO   2 -13.543   3.445 -17.998
   15    H    LEU   3           H        LEU   3 -13.147   6.074 -15.404
   16    HA   LEU   3           HA       LEU   3 -14.114   8.441 -13.884
   17   1HB   LEU   3          1HB       LEU   3 -13.297   6.143 -12.700
   18   2HB   LEU   3          2HB       LEU   3 -11.724   6.860 -12.959
   19    HG   LEU   3           HG       LEU   3 -12.971   9.038 -11.958
   20   1HD1  LEU   3          1HD1      LEU   3 -15.141   7.660 -11.816
   21   2HD1  LEU   3          2HD1      LEU   3 -14.386   6.772 -10.487
   22   3HD1  LEU   3          3HD1      LEU   3 -14.665   8.520 -10.337
   23   1HD2  LEU   3          1HD2      LEU   3 -10.968   7.604 -10.986
   24   2HD2  LEU   3          2HD2      LEU   3 -11.853   8.764  -9.984
   25   3HD2  LEU   3          3HD2      LEU   3 -12.200   7.030  -9.853
   26    H    GLU   4           H        GLU   4 -13.580  10.009 -15.403
   27    HA   GLU   4           HA       GLU   4 -10.671  10.302 -15.953
   28   1HB   GLU   4          1HB       GLU   4 -11.209  11.371 -18.051
   29   2HB   GLU   4          2HB       GLU   4 -11.886   9.763 -17.981
   30   1HG   GLU   4          1HG       GLU   4 -13.771  11.921 -17.111
   31   2HG   GLU   4          2HG       GLU   4 -13.218  12.056 -18.770
   32    HA   PRO   5           HA       PRO   5 -10.952  14.309 -14.058
   33   1HB   PRO   5          1HB       PRO   5  -8.818  15.631 -15.206
   34   2HB   PRO   5          2HB       PRO   5  -8.678  14.379 -13.933
   35   1HG   PRO   5          1HG       PRO   5  -8.146  14.143 -16.877
   36   2HG   PRO   5          2HG       PRO   5  -7.395  13.265 -15.507
   37   1HD   PRO   5          1HD       PRO   5  -9.436  12.315 -17.213
   38   2HD   PRO   5          2HD       PRO   5  -8.935  11.582 -15.663
   39    H    VAL   6           H        VAL   6 -12.549  15.654 -14.514
   40    HA   VAL   6           HA       VAL   6 -13.011  16.665 -17.226
   41    HB   VAL   6           HB       VAL   6 -14.735  15.927 -15.344
   42   1HG1  VAL   6          1HG1      VAL   6 -15.786  17.708 -14.156
   43   2HG1  VAL   6          2HG1      VAL   6 -14.066  17.743 -13.730
   44   3HG1  VAL   6          3HG1      VAL   6 -14.733  18.928 -14.877
   45   1HG2  VAL   6          1HG2      VAL   6 -16.465  17.279 -16.501
   46   2HG2  VAL   6          2HG2      VAL   6 -15.168  18.172 -17.342
   47   3HG2  VAL   6          3HG2      VAL   6 -15.362  16.422 -17.599
   48    H    TYR   7           H        TYR   7 -11.268  17.701 -14.517
   49    HA   TYR   7           HA       TYR   7 -10.484  20.241 -15.696
   50   1HB   TYR   7          1HB       TYR   7 -12.856  20.453 -14.479
   51   2HB   TYR   7          2HB       TYR   7 -11.893  20.588 -13.045
   52    HD1  TYR   7           1HD      TYR   7 -10.776  22.685 -12.551
   53    HD2  TYR   7           2HD      TYR   7 -12.455  21.954 -16.458
   54    HE1  TYR   7           1HE      TYR   7 -10.542  25.117 -13.125
   55    HE2  TYR   7           2HE      TYR   7 -12.223  24.372 -17.016
   56    HH   TYR   7           HH       TYR   7 -12.101  26.537 -15.822
   57    HA   PRO   8           HA       PRO   8  -7.391  18.396 -12.775
   58   1HB   PRO   8          1HB       PRO   8  -5.166  18.590 -14.395
   59   2HB   PRO   8          2HB       PRO   8  -6.302  17.212 -14.378
   60   1HG   PRO   8          1HG       PRO   8  -6.071  19.432 -16.377
   61   2HG   PRO   8          2HG       PRO   8  -6.595  17.736 -16.610
   62   1HD   PRO   8          1HD       PRO   8  -8.269  20.006 -16.364
   63   2HD   PRO   8          2HD       PRO   8  -8.793  18.299 -16.239
   64    H    GLY   9           H        GLY   9  -7.373  19.987 -11.282
   65   1HA   GLY   9          1HA       GLY   9  -5.383  22.162 -11.541
   66   2HA   GLY   9          2HA       GLY   9  -7.071  22.663 -11.382
   67    H    ASP  10           H        ASP  10  -4.543  20.712  -9.844
   68    HA   ASP  10           HA       ASP  10  -4.150  19.946  -7.765
   69   1HB   ASP  10          1HB       ASP  10  -5.037  22.737  -7.035
   70   2HB   ASP  10          2HB       ASP  10  -4.105  21.656  -6.016
   71    H    ASN  11           H        ASN  11  -5.760  18.311  -7.806
   72    HA   ASN  11           HA       ASN  11  -8.362  18.704  -6.564
   73   1HB   ASN  11          1HB       ASN  11  -6.856  16.328  -7.709
   74   2HB   ASN  11          2HB       ASN  11  -8.300  16.084  -6.719
   75   1HD2  ASN  11          1HD2      ASN  11  -9.666  15.260  -8.295
   76   2HD2  ASN  11          2HD2      ASN  11 -10.182  16.320  -9.608
   77    H    ALA  12           H        ALA  12  -6.305  16.050  -5.607
   78    HA   ALA  12           HA       ALA  12  -6.922  16.520  -2.762
   79   1HB   ALA  12          1HB       ALA  12  -6.392  14.265  -2.440
   80   2HB   ALA  12          2HB       ALA  12  -7.028  14.237  -4.095
   81   3HB   ALA  12          3HB       ALA  12  -5.274  14.208  -3.820
   82    H    THR  13           H        THR  13  -5.274  16.652  -1.163
   83    HA   THR  13           HA       THR  13  -3.066  18.295  -1.915
   84    HB   THR  13           HB       THR  13  -4.507  17.836   0.363
   85    HG1  THR  13           1HG      THR  13  -3.794  19.724   0.223
   86   1HG2  THR  13          1HG2      THR  13  -1.691  16.958   1.070
   87   2HG2  THR  13          2HG2      THR  13  -2.997  17.321   2.195
   88   3HG2  THR  13          3HG2      THR  13  -3.147  15.941   1.104
   89    HA   PRO  14           HA       PRO  14   0.165  15.497  -2.771
   90   1HB   PRO  14          1HB       PRO  14   2.422  16.675  -1.675
   91   2HB   PRO  14          2HB       PRO  14   1.609  17.154  -3.184
   92   1HG   PRO  14          1HG       PRO  14   1.547  18.498  -0.531
   93   2HG   PRO  14          2HG       PRO  14   1.293  19.192  -2.158
   94   1HD   PRO  14          1HD       PRO  14  -0.667  18.487  -0.233
   95   2HD   PRO  14          2HD       PRO  14  -1.019  18.946  -1.906
   96    H    GLU  15           H        GLU  15   0.270  16.470   0.653
   97    HA   GLU  15           HA       GLU  15   1.689  14.221   1.663
   98   1HB   GLU  15          1HB       GLU  15   0.788  16.629   2.663
   99   2HB   GLU  15          2HB       GLU  15  -0.309  15.538   3.480
  100   1HG   GLU  15          1HG       GLU  15   2.637  14.850   3.518
  101   2HG   GLU  15          2HG       GLU  15   2.161  16.303   4.361
  102    H    GLN  16           H        GLN  16  -1.612  14.609   0.772
  103    HA   GLN  16           HA       GLN  16  -2.463  12.028   1.947
  104   1HB   GLN  16          1HB       GLN  16  -3.951  14.014   1.936
  105   2HB   GLN  16          2HB       GLN  16  -4.014  13.955   0.174
  106   1HG   GLN  16          1HG       GLN  16  -5.621  12.364   0.219
  107   2HG   GLN  16          2HG       GLN  16  -4.697  11.350   1.317
  108   1HE2  GLN  16          1HE2      GLN  16  -7.107  14.032   1.198
  109   2HE2  GLN  16          2HE2      GLN  16  -7.559  13.745   2.886
  110    H    MET  17           H        MET  17  -1.194  13.244  -1.073
  111    HA   MET  17           HA       MET  17  -2.188  11.120  -2.802
  112   1HB   MET  17          1HB       MET  17  -0.602  13.587  -2.996
  113   2HB   MET  17          2HB       MET  17   0.120  12.312  -3.926
  114   1HG   MET  17          1HG       MET  17  -2.853  12.778  -4.165
  115   2HG   MET  17          2HG       MET  17  -1.766  13.964  -4.864
  116   1HE   MET  17          1HE       MET  17   0.220  13.419  -6.186
  117   2HE   MET  17          2HE       MET  17   0.731  11.718  -6.243
  118    H    ALA  18           H        ALA  18   0.929  11.857  -1.166
  119    HA   ALA  18           HA       ALA  18   2.258   9.480  -2.003
  120   1HB   ALA  18          1HB       ALA  18   2.622  10.953   0.644
  121   2HB   ALA  18          2HB       ALA  18   3.814   9.931  -0.194
  122   3HB   ALA  18          3HB       ALA  18   3.324  11.483  -0.900
  123    H    ARG  19           H        ARG  19  -0.060  10.031   0.534
  124    HA   ARG  19           HA       ARG  19   0.155   7.328   1.646
  125   1HB   ARG  19          1HB       ARG  19  -1.032   9.805   2.465
  126   2HB   ARG  19          2HB       ARG  19  -2.354   8.653   2.333
  127   1HG   ARG  19          1HG       ARG  19   0.232   8.191   3.893
  128   2HG   ARG  19          2HG       ARG  19  -1.284   8.760   4.592
  129   1HD   ARG  19          1HD       ARG  19  -1.988   6.407   3.180
  130   2HD   ARG  19          2HD       ARG  19  -0.445   6.014   3.923
  131    HE   ARG  19           HE       ARG  19  -3.008   6.370   5.213
  132   1HH1  ARG  19          2HH2      ARG  19   0.405   6.596   5.952
  133   2HH1  ARG  19          1HH2      ARG  19   0.158   6.474   7.685
  134   1HH2  ARG  19          2HH1      ARG  19  -3.275   6.149   7.420
  135   2HH2  ARG  19          1HH1      ARG  19  -1.872   6.281   8.458
  136    H    TYR  20           H        TYR  20  -1.998   8.933  -0.667
  137    HA   TYR  20           HA       TYR  20  -3.882   6.879  -1.088
  138   1HB   TYR  20          1HB       TYR  20  -4.049   9.194  -1.941
  139   2HB   TYR  20          2HB       TYR  20  -2.744   8.897  -3.057
  140    HD1  TYR  20           1HD      TYR  20  -6.304   8.485  -2.465
  141    HD2  TYR  20           2HD      TYR  20  -3.009   7.340  -4.998
  142    HE1  TYR  20           1HE      TYR  20  -7.905   7.744  -4.225
  143    HE2  TYR  20           2HE      TYR  20  -4.607   6.552  -6.733
  144    HH   TYR  20           HH       TYR  20  -7.812   7.448  -6.793
  145    H    TYR  21           H        TYR  21  -0.927   7.544  -2.993
  146    HA   TYR  21           HA       TYR  21  -1.146   5.243  -4.679
  147   1HB   TYR  21          1HB       TYR  21   0.232   7.243  -5.138
  148   2HB   TYR  21          2HB       TYR  21   1.327   6.800  -3.835
  149    HD1  TYR  21           1HD      TYR  21   0.242   6.061  -7.280
  150    HD2  TYR  21           2HD      TYR  21   2.846   4.844  -4.061
  151    HE1  TYR  21           1HE      TYR  21   1.582   4.680  -8.871
  152    HE2  TYR  21           2HE      TYR  21   4.164   3.465  -5.637
  153    HH   TYR  21           HH       TYR  21   4.551   3.028  -7.901
  154    H    SER  22           H        SER  22   0.638   5.670  -1.611
  155    HA   SER  22           HA       SER  22   1.729   2.992  -1.546
  156   1HB   SER  22          1HB       SER  22   1.717   5.317   0.218
  157   2HB   SER  22          2HB       SER  22   1.392   3.840   1.125
  158    HG   SER  22           HG       SER  22   3.556   4.271  -0.655
  159    H    ALA  23           H        ALA  23  -1.304   4.425  -0.227
  160    HA   ALA  23           HA       ALA  23  -2.233   2.027   0.959
  161   1HB   ALA  23          1HB       ALA  23  -3.236   4.221   1.448
  162   2HB   ALA  23          2HB       ALA  23  -3.847   4.325  -0.223
  163   3HB   ALA  23          3HB       ALA  23  -4.451   3.066   0.877
  164    H    LEU  24           H        LEU  24  -2.567   3.220  -2.464
  165    HA   LEU  24           HA       LEU  24  -4.175   1.065  -3.395
  166   1HB   LEU  24          1HB       LEU  24  -3.981   2.866  -4.850
  167   2HB   LEU  24          2HB       LEU  24  -2.267   3.053  -4.567
  168    HG   LEU  24           HG       LEU  24  -1.870   0.922  -5.859
  169   1HD1  LEU  24          1HD1      LEU  24  -4.797   1.337  -6.590
  170   2HD1  LEU  24          2HD1      LEU  24  -3.675   0.303  -7.503
  171   3HD1  LEU  24          3HD1      LEU  24  -4.067  -0.090  -5.832
  172   1HD2  LEU  24          1HD2      LEU  24  -1.186   2.492  -7.248
  173   2HD2  LEU  24          2HD2      LEU  24  -2.736   2.331  -8.087
  174   3HD2  LEU  24          3HD2      LEU  24  -2.526   3.584  -6.853
  175    H    ARG  25           H        ARG  25  -0.579   1.367  -3.323
  176    HA   ARG  25           HA       ARG  25  -0.064  -1.245  -4.313
  177   1HB   ARG  25          1HB       ARG  25   1.628   0.663  -3.874
  178   2HB   ARG  25          2HB       ARG  25   1.622   0.157  -2.194
  179   1HG   ARG  25          1HG       ARG  25   3.483  -0.903  -3.161
  180   2HG   ARG  25          2HG       ARG  25   2.301  -2.186  -2.994
  181   1HD   ARG  25          1HD       ARG  25   1.992  -2.418  -5.286
  182   2HD   ARG  25          2HD       ARG  25   2.249  -0.704  -5.590
  183    HE   ARG  25           HE       ARG  25   4.452  -1.071  -5.967
  184   1HH1  ARG  25          2HH2      ARG  25   3.319  -3.930  -4.336
  185   2HH1  ARG  25          1HH2      ARG  25   4.867  -4.721  -4.369
  186   1HH2  ARG  25          2HH1      ARG  25   6.435  -2.068  -6.019
  187   2HH2  ARG  25          1HH1      ARG  25   6.642  -3.613  -5.257
  188    H    ARG  26           H        ARG  26  -0.412  -0.195  -0.922
  189    HA   ARG  26           HA       ARG  26  -0.101  -2.844   0.141
  190   1HB   ARG  26          1HB       ARG  26  -0.043  -0.419   1.283
  191   2HB   ARG  26          2HB       ARG  26  -1.725  -0.800   1.666
  192   1HG   ARG  26          1HG       ARG  26   0.525  -2.796   2.190
  193   2HG   ARG  26          2HG       ARG  26   0.253  -1.465   3.294
  194   1HD   ARG  26          1HD       ARG  26  -2.076  -3.263   2.560
  195   2HD   ARG  26          2HD       ARG  26  -0.887  -3.812   3.729
  196    HE   ARG  26           HE       ARG  26  -2.898  -1.732   4.125
  197   1HH1  ARG  26          2HH2      ARG  26   0.250  -2.764   5.243
  198   2HH1  ARG  26          1HH2      ARG  26   0.122  -1.924   6.753
  199   1HH2  ARG  26          2HH1      ARG  26  -2.961  -0.497   5.894
  200   2HH2  ARG  26          1HH1      ARG  26  -1.822  -0.775   7.205
  201    H    TYR  27           H        TYR  27  -3.068  -1.019  -0.690
  202    HA   TYR  27           HA       TYR  27  -4.990  -2.919   0.107
  203   1HB   TYR  27          1HB       TYR  27  -5.416  -0.551  -0.521
  204   2HB   TYR  27          2HB       TYR  27  -4.981  -0.908  -2.187
  205    HD1  TYR  27           1HD      TYR  27  -6.819  -0.964  -3.639
  206    HD2  TYR  27           2HD      TYR  27  -7.319  -2.226   0.451
  207    HE1  TYR  27           1HE      TYR  27  -9.215  -1.484  -4.091
  208    HE2  TYR  27           2HE      TYR  27  -9.710  -2.777  -0.015
  209    HH   TYR  27           HH       TYR  27 -11.000  -2.818  -3.289
  210    H    ILE  28           H        ILE  28  -3.215  -2.634  -3.020
  211    HA   ILE  28           HA       ILE  28  -4.463  -5.010  -4.121
  212    HB   ILE  28           HB       ILE  28  -1.878  -3.568  -4.781
  213   2HG1  ILE  28          2HG1      ILE  28  -3.049  -2.343  -6.393
  214   1HG2  ILE  28          1HG2      ILE  28  -1.708  -5.838  -5.666
  215   2HG2  ILE  28          2HG2      ILE  28  -3.316  -5.713  -6.395
  216   3HG2  ILE  28          3HG2      ILE  28  -1.978  -4.702  -6.986
  217   1HD1  ILE  28          1HD1      ILE  28  -5.543  -2.650  -6.815
  218   2HD1  ILE  28          2HD1      ILE  28  -4.476  -3.833  -7.588
  219   3HD1  ILE  28          3HD1      ILE  28  -5.379  -4.273  -6.125
  220    H    ASN  29           H        ASN  29  -1.575  -4.537  -2.070
  221    HA   ASN  29           HA       ASN  29  -0.697  -7.273  -2.266
  222   1HB   ASN  29          1HB       ASN  29   0.520  -5.050  -1.429
  223   2HB   ASN  29          2HB       ASN  29  -0.076  -5.560   0.149
  224   1HD2  ASN  29          1HD2      ASN  29   0.953  -7.421   1.135
  225   2HD2  ASN  29          2HD2      ASN  29   2.338  -8.164   0.323
  226    H    MET  30           H        MET  30  -2.723  -5.575   0.187
  227    HA   MET  30           HA       MET  30  -3.133  -7.899   1.843
  228   1HB   MET  30          1HB       MET  30  -4.860  -6.450   2.927
  229   2HB   MET  30          2HB       MET  30  -3.250  -5.729   2.845
  230   1HG   MET  30          1HG       MET  30  -4.089  -3.976   1.805
  231   2HG   MET  30          2HG       MET  30  -4.755  -5.007   0.563
  232   1HE   MET  30          1HE       MET  30  -6.891  -2.680   3.730
  233   2HE   MET  30          2HE       MET  30  -5.726  -3.877   4.357
  234    H    LEU  31           H        LEU  31  -5.056  -6.458  -0.876
  235    HA   LEU  31           HA       LEU  31  -7.280  -8.208  -0.637
  236   1HB   LEU  31          1HB       LEU  31  -5.939  -6.685  -2.881
  237   2HB   LEU  31          2HB       LEU  31  -7.329  -7.673  -3.202
  238    HG   LEU  31           HG       LEU  31  -7.392  -5.461  -1.120
  239   1HD1  LEU  31          1HD1      LEU  31  -7.079  -5.061  -3.870
  240   2HD1  LEU  31          2HD1      LEU  31  -8.836  -4.930  -3.631
  241   3HD1  LEU  31          3HD1      LEU  31  -7.696  -3.951  -2.686
  242   1HD2  LEU  31          1HD2      LEU  31  -9.574  -7.078  -2.458
  243   2HD2  LEU  31          2HD2      LEU  31  -9.162  -7.011  -0.727
  244   3HD2  LEU  31          3HD2      LEU  31  -9.857  -5.591  -1.522
  245    H    THR  32           H        THR  32  -4.071  -8.759  -1.806
  246    HA   THR  32           HA       THR  32  -4.777 -11.535  -2.636
  247    HB   THR  32           HB       THR  32  -2.606  -9.742  -3.777
  248    HG1  THR  32           1HG      THR  32  -4.192 -10.205  -5.618
  249   1HG2  THR  32          1HG2      THR  32  -2.687 -11.507  -5.656
  250   2HG2  THR  32          2HG2      THR  32  -1.869 -11.996  -4.176
  251   3HG2  THR  32          3HG2      THR  32  -3.525 -12.563  -4.484
  252    H    ARG  33           H        ARG  33  -3.963 -10.356   0.052
  253    HA   ARG  33           HA       ARG  33  -1.434 -11.621   0.730
  254   1HB   ARG  33          1HB       ARG  33  -3.535 -10.150   2.178
  255   2HB   ARG  33          2HB       ARG  33  -3.020 -11.558   3.079
  256   1HG   ARG  33          1HG       ARG  33  -0.637 -10.808   2.843
  257   2HG   ARG  33          2HG       ARG  33  -1.238  -9.326   2.062
  258   1HD   ARG  33          1HD       ARG  33  -2.780  -9.105   4.149
  259   2HD   ARG  33          2HD       ARG  33  -1.731 -10.321   4.895
  260    HE   ARG  33           HE       ARG  33   0.016  -8.388   3.926
  261   1HH1  ARG  33          2HH2      ARG  33  -2.659  -8.343   6.170
  262   2HH1  ARG  33          1HH2      ARG  33  -2.107  -6.926   7.013
  263   1HH2  ARG  33          2HH1      ARG  33   0.782  -6.592   5.088
  264   2HH2  ARG  33          1HH1      ARG  33  -0.135  -5.991   6.417
  265    HA   PRO  34           HA       PRO  34  -3.922 -15.326   2.228
  266   1HB   PRO  34          1HB       PRO  34  -6.620 -15.579   1.728
  267   2HB   PRO  34          2HB       PRO  34  -5.936 -14.809   3.182
  268   1HG   PRO  34          1HG       PRO  34  -7.188 -13.515   0.791
  269   2HG   PRO  34          2HG       PRO  34  -7.128 -12.960   2.494
  270   1HD   PRO  34          1HD       PRO  34  -5.480 -12.129   0.346
  271   2HD   PRO  34          2HD       PRO  34  -5.236 -11.759   2.073
  272    H    ARG  35           H        ARG  35  -4.096 -17.264   1.128
  273    HA   ARG  35           HA       ARG  35  -3.731 -18.729  -0.599
  274   1HB   ARG  35          1HB       ARG  35  -5.820 -17.039  -2.035
  275   2HB   ARG  35          2HB       ARG  35  -5.170 -18.563  -2.617
  276   1HG   ARG  35          1HG       ARG  35  -6.985 -19.424  -1.582
  277   2HG   ARG  35          2HG       ARG  35  -5.887 -19.447  -0.205
  278   1HD   ARG  35          1HD       ARG  35  -7.003 -16.883  -0.074
  279   2HD   ARG  35          2HD       ARG  35  -8.333 -17.846  -0.720
  280    HE   ARG  35           HE       ARG  35  -7.121 -19.189   1.518
  281   1HH1  ARG  35          2HH2      ARG  35  -9.214 -16.479   0.878
  282   2HH1  ARG  35          1HH2      ARG  35  -9.969 -16.528   2.454
  283   1HH2  ARG  35          2HH1      ARG  35  -8.065 -19.224   3.562
  284   2HH2  ARG  35          1HH1      ARG  35  -9.295 -18.070   3.954
  285    H    TYR  36           H        TYR  36  -1.560 -17.661  -0.463
  286    HA   TYR  36           HA       TYR  36  -0.604 -17.145  -3.188
  287   1HB   TYR  36          1HB       TYR  36  -1.178 -14.916  -2.521
  288   2HB   TYR  36          2HB       TYR  36  -0.551 -15.152  -0.898
  289    HD1  TYR  36           1HD      TYR  36   0.688 -15.295  -4.469
  290    HD2  TYR  36           2HD      TYR  36   1.465 -14.174  -0.381
  291    HE1  TYR  36           1HE      TYR  36   2.913 -14.366  -5.147
  292    HE2  TYR  36           2HE      TYR  36   3.678 -13.224  -1.066
  293    HH   TYR  36           HH       TYR  36   5.277 -13.955  -3.647
  294   1HN   NH2  37          1HN       NH2  37   1.539 -18.019  -3.442
  295   2HN   NH2  37          2HN       NH2  37   2.453 -18.571  -2.047
  Start of MODEL   16
    1   1H    ALA   1          1H        ALA   1   4.057  30.144  -4.884
    2   2H    ALA   1          2H        ALA   1   4.613  29.313  -6.191
    3   3H    ALA   1          3H        ALA   1   3.005  29.632  -6.039
    4    HA   ALA   1           HA       ALA   1   2.862  27.549  -5.282
    5   1HB   ALA   1          1HB       ALA   1   5.812  27.821  -4.623
    6   2HB   ALA   1          2HB       ALA   1   4.840  26.373  -4.262
    7   3HB   ALA   1          3HB       ALA   1   5.055  26.901  -5.943
    8    HA   PRO   2           HA       PRO   2   2.180  29.649  -1.242
    9   1HB   PRO   2          1HB       PRO   2  -0.551  29.570  -1.219
   10   2HB   PRO   2          2HB       PRO   2   0.386  30.831  -2.043
   11   1HG   PRO   2          1HG       PRO   2  -1.013  28.455  -3.269
   12   2HG   PRO   2          2HG       PRO   2  -0.805  30.107  -3.913
   13   1HD   PRO   2          1HD       PRO   2   0.724  27.837  -4.552
   14   2HD   PRO   2          2HD       PRO   2   1.184  29.527  -4.885
   15    H    LEU   3           H        LEU   3   1.605  28.727   0.766
   16    HA   LEU   3           HA       LEU   3   1.131  25.789   0.773
   17   1HB   LEU   3          1HB       LEU   3   2.646  25.607   2.606
   18   2HB   LEU   3          2HB       LEU   3   3.420  26.304   1.209
   19    HG   LEU   3           HG       LEU   3   2.482  28.492   2.894
   20   1HD1  LEU   3          1HD1      LEU   3   3.899  26.247   4.373
   21   2HD1  LEU   3          2HD1      LEU   3   4.116  27.944   4.845
   22   3HD1  LEU   3          3HD1      LEU   3   2.507  27.230   4.866
   23   1HD2  LEU   3          1HD2      LEU   3   5.221  27.482   2.068
   24   2HD2  LEU   3          2HD2      LEU   3   4.273  28.828   1.392
   25   3HD2  LEU   3          3HD2      LEU   3   4.959  28.965   3.013
   26    H    GLU   4           H        GLU   4  -1.132  26.365   0.889
   27    HA   GLU   4           HA       GLU   4  -2.440  25.970   3.327
   28   1HB   GLU   4          1HB       GLU   4  -1.679  28.807   2.985
   29   2HB   GLU   4          2HB       GLU   4  -3.408  28.626   3.080
   30   1HG   GLU   4          1HG       GLU   4  -2.132  27.074   5.214
   31   2HG   GLU   4          2HG       GLU   4  -1.543  28.714   5.194
   32    HA   PRO   5           HA       PRO   5  -5.657  27.139   0.036
   33   1HB   PRO   5          1HB       PRO   5  -5.076  28.528  -2.242
   34   2HB   PRO   5          2HB       PRO   5  -5.382  29.308  -0.667
   35   1HG   PRO   5          1HG       PRO   5  -2.777  28.806  -2.039
   36   2HG   PRO   5          2HG       PRO   5  -3.261  30.189  -1.018
   37   1HD   PRO   5          1HD       PRO   5  -1.748  27.939  -0.228
   38   2HD   PRO   5          2HD       PRO   5  -2.501  29.137   0.865
   39    H    VAL   6           H        VAL   6  -4.574  24.925   0.260
   40    HA   VAL   6           HA       VAL   6  -4.249  23.665  -2.446
   41    HB   VAL   6           HB       VAL   6  -3.493  21.646  -0.924
   42   1HG1  VAL   6          1HG1      VAL   6  -1.878  22.270  -2.378
   43   2HG1  VAL   6          2HG1      VAL   6  -1.988  23.991  -1.984
   44   3HG1  VAL   6          3HG1      VAL   6  -1.105  22.894  -0.910
   45   1HG2  VAL   6          1HG2      VAL   6  -3.994  22.834   1.253
   46   2HG2  VAL   6          2HG2      VAL   6  -2.356  22.181   1.097
   47   3HG2  VAL   6          3HG2      VAL   6  -2.628  23.911   0.894
   48    H    TYR   7           H        TYR   7  -6.519  24.121  -0.027
   49    HA   TYR   7           HA       TYR   7  -8.567  23.260   0.435
   50   1HB   TYR   7          1HB       TYR   7  -8.662  23.886  -2.016
   51   2HB   TYR   7          2HB       TYR   7  -8.578  22.177  -2.388
   52    HD1  TYR   7           1HD      TYR   7 -10.758  24.852  -2.072
   53    HD2  TYR   7           2HD      TYR   7 -10.428  20.720  -0.832
   54    HE1  TYR   7           1HE      TYR   7 -13.227  24.702  -1.847
   55    HE2  TYR   7           2HE      TYR   7 -12.872  20.597  -0.571
   56    HH   TYR   7           HH       TYR   7 -15.042  23.248  -1.493
   57    HA   PRO   8           HA       PRO   8  -7.002  19.032   1.362
   58   1HB   PRO   8          1HB       PRO   8  -7.726  18.965   4.035
   59   2HB   PRO   8          2HB       PRO   8  -6.174  19.577   3.409
   60   1HG   PRO   8          1HG       PRO   8  -8.547  21.120   4.384
   61   2HG   PRO   8          2HG       PRO   8  -6.815  21.559   4.422
   62   1HD   PRO   8          1HD       PRO   8  -8.762  22.439   2.561
   63   2HD   PRO   8          2HD       PRO   8  -6.991  22.627   2.393
   64    H    GLY   9           H        GLY   9  -8.163  17.136   1.430
   65   1HA   GLY   9          1HA       GLY   9 -10.521  16.277   2.319
   66   2HA   GLY   9          2HA       GLY   9 -11.091  17.328   1.015
   67    H    ASP  10           H        ASP  10  -9.933  16.968  -1.147
   68    HA   ASP  10           HA       ASP  10  -9.281  14.120  -1.692
   69   1HB   ASP  10          1HB       ASP  10 -11.412  15.850  -3.004
   70   2HB   ASP  10          2HB       ASP  10 -10.668  14.497  -3.841
   71    H    ASN  11           H        ASN  11  -7.477  13.975  -2.853
   72    HA   ASN  11           HA       ASN  11  -5.593  14.455  -4.015
   73   1HB   ASN  11          1HB       ASN  11  -7.381  16.102  -5.822
   74   2HB   ASN  11          2HB       ASN  11  -5.891  15.258  -6.240
   75   1HD2  ASN  11          1HD2      ASN  11  -9.311  14.955  -5.708
   76   2HD2  ASN  11          2HD2      ASN  11  -9.405  13.257  -6.210
   77    H    ALA  12           H        ALA  12  -4.822  15.754  -2.116
   78    HA   ALA  12           HA       ALA  12  -3.861  18.380  -2.957
   79   1HB   ALA  12          1HB       ALA  12  -5.767  19.273  -1.975
   80   2HB   ALA  12          2HB       ALA  12  -6.003  17.915  -0.873
   81   3HB   ALA  12          3HB       ALA  12  -4.755  19.129  -0.521
   82    H    THR  13           H        THR  13  -2.145  19.033  -1.604
   83    HA   THR  13           HA       THR  13  -0.164  18.783  -0.665
   84    HB   THR  13           HB       THR  13  -1.537  19.038   1.298
   85    HG1  THR  13           1HG      THR  13   0.487  19.086   1.803
   86   1HG2  THR  13          1HG2      THR  13  -2.876  17.075   1.579
   87   2HG2  THR  13          2HG2      THR  13  -1.457  16.021   1.448
   88   3HG2  THR  13          3HG2      THR  13  -1.695  17.009   2.890
   89    HA   PRO  14           HA       PRO  14   1.716  15.067  -2.076
   90   1HB   PRO  14          1HB       PRO  14   4.269  15.271  -1.010
   91   2HB   PRO  14          2HB       PRO  14   3.688  16.075  -2.493
   92   1HG   PRO  14          1HG       PRO  14   4.179  17.254   0.190
   93   2HG   PRO  14          2HG       PRO  14   4.183  18.042  -1.412
   94   1HD   PRO  14          1HD       PRO  14   2.153  18.072   0.548
   95   2HD   PRO  14          2HD       PRO  14   1.966  18.690  -1.102
   96    H    GLU  15           H        GLU  15   1.409  15.807   1.321
   97    HA   GLU  15           HA       GLU  15   2.335  13.211   2.241
   98   1HB   GLU  15          1HB       GLU  15   1.969  15.663   3.500
   99   2HB   GLU  15          2HB       GLU  15   0.547  14.808   4.053
  100   1HG   GLU  15          1HG       GLU  15   2.946  13.095   4.286
  101   2HG   GLU  15          2HG       GLU  15   3.246  14.668   4.990
  102    H    GLN  16           H        GLN  16  -0.577  14.307   0.898
  103    HA   GLN  16           HA       GLN  16  -2.066  11.931   1.902
  104   1HB   GLN  16          1HB       GLN  16  -2.980  14.476   1.841
  105   2HB   GLN  16          2HB       GLN  16  -3.375  14.000   0.185
  106   1HG   GLN  16          1HG       GLN  16  -5.288  13.620   1.500
  107   2HG   GLN  16          2HG       GLN  16  -4.618  12.022   1.155
  108   1HE2  GLN  16          1HE2      GLN  16  -6.431  12.348   3.288
  109   2HE2  GLN  16          2HE2      GLN  16  -5.475  12.209   4.779
  110    H    MET  17           H        MET  17  -0.834  13.541  -1.047
  111    HA   MET  17           HA       MET  17  -1.981  11.636  -2.910
  112   1HB   MET  17          1HB       MET  17  -0.212  14.013  -2.946
  113   2HB   MET  17          2HB       MET  17   0.289  12.792  -4.087
  114   1HG   MET  17          1HG       MET  17  -2.637  13.524  -3.944
  115   2HG   MET  17          2HG       MET  17  -1.514  14.635  -4.721
  116   1HE   MET  17          1HE       MET  17  -3.467  14.236  -6.487
  117   2HE   MET  17          2HE       MET  17  -3.350  12.986  -7.739
  118    H    ALA  18           H        ALA  18   1.234  11.860  -1.211
  119    HA   ALA  18           HA       ALA  18   2.203   9.459  -2.489
  120   1HB   ALA  18          1HB       ALA  18   3.032  10.775   0.136
  121   2HB   ALA  18          2HB       ALA  18   3.986   9.615  -0.813
  122   3HB   ALA  18          3HB       ALA  18   3.651  11.231  -1.468
  123    H    ARG  19           H        ARG  19   0.041  10.070   0.138
  124    HA   ARG  19           HA       ARG  19   0.307   7.363   1.310
  125   1HB   ARG  19          1HB       ARG  19  -0.768   9.822   2.273
  126   2HB   ARG  19          2HB       ARG  19  -2.159   8.790   2.045
  127   1HG   ARG  19          1HG       ARG  19  -1.657   8.051   4.122
  128   2HG   ARG  19          2HG       ARG  19  -0.518   6.990   3.299
  129   1HD   ARG  19          1HD       ARG  19   0.082   9.728   4.514
  130   2HD   ARG  19          2HD       ARG  19   0.491   8.163   5.232
  131    HE   ARG  19           HE       ARG  19   1.649   8.366   2.619
  132   1HH1  ARG  19          2HH2      ARG  19   2.059   9.916   5.713
  133   2HH1  ARG  19          1HH2      ARG  19   3.772  10.110   5.539
  134   1HH2  ARG  19          2HH1      ARG  19   3.896   8.608   2.412
  135   2HH2  ARG  19          1HH1      ARG  19   4.792   9.324   3.721
  136    H    TYR  20           H        TYR  20  -2.192   9.064  -0.648
  137    HA   TYR  20           HA       TYR  20  -4.062   7.046  -0.937
  138   1HB   TYR  20          1HB       TYR  20  -3.110   9.428  -2.492
  139   2HB   TYR  20          2HB       TYR  20  -3.970   8.248  -3.419
  140    HD1  TYR  20           1HD      TYR  20  -4.472  11.228  -1.814
  141    HD2  TYR  20           2HD      TYR  20  -6.199   7.285  -2.028
  142    HE1  TYR  20           1HE      TYR  20  -6.690  12.159  -1.132
  143    HE2  TYR  20           2HE      TYR  20  -8.401   8.214  -1.341
  144    HH   TYR  20           HH       TYR  20  -9.455  11.098  -1.536
  145    H    TYR  21           H        TYR  21  -1.146   7.583  -2.953
  146    HA   TYR  21           HA       TYR  21  -1.464   5.237  -4.553
  147   1HB   TYR  21          1HB       TYR  21  -0.152   7.250  -5.138
  148   2HB   TYR  21          2HB       TYR  21   1.016   6.854  -3.881
  149    HD1  TYR  21           1HD      TYR  21  -0.169   6.112  -7.267
  150    HD2  TYR  21           2HD      TYR  21   2.441   4.796  -4.093
  151    HE1  TYR  21           1HE      TYR  21   1.027   4.620  -8.863
  152    HE2  TYR  21           2HE      TYR  21   3.616   3.295  -5.667
  153    HH   TYR  21           HH       TYR  21   3.818   2.659  -7.821
  154    H    SER  22           H        SER  22   0.479   5.801  -1.563
  155    HA   SER  22           HA       SER  22   1.701   3.195  -1.531
  156   1HB   SER  22          1HB       SER  22   1.454   5.460   0.372
  157   2HB   SER  22          2HB       SER  22   1.638   3.887   1.117
  158    HG   SER  22           HG       SER  22   3.334   4.997  -0.866
  159    H    ALA  23           H        ALA  23  -1.331   4.454  -0.163
  160    HA   ALA  23           HA       ALA  23  -2.121   2.080   1.202
  161   1HB   ALA  23          1HB       ALA  23  -4.262   3.115   1.364
  162   2HB   ALA  23          2HB       ALA  23  -3.110   4.457   1.410
  163   3HB   ALA  23          3HB       ALA  23  -4.001   4.106  -0.084
  164    H    LEU  24           H        LEU  24  -2.634   3.202  -2.199
  165    HA   LEU  24           HA       LEU  24  -4.174   0.972  -3.026
  166   1HB   LEU  24          1HB       LEU  24  -2.662   3.121  -4.333
  167   2HB   LEU  24          2HB       LEU  24  -2.523   1.619  -5.235
  168    HG   LEU  24           HG       LEU  24  -5.167   2.860  -4.361
  169   1HD1  LEU  24          1HD1      LEU  24  -3.970   4.294  -5.989
  170   2HD1  LEU  24          2HD1      LEU  24  -3.777   2.901  -7.081
  171   3HD1  LEU  24          3HD1      LEU  24  -5.397   3.538  -6.721
  172   1HD2  LEU  24          1HD2      LEU  24  -4.605   0.688  -6.435
  173   2HD2  LEU  24          2HD2      LEU  24  -5.220   0.362  -4.809
  174   3HD2  LEU  24          3HD2      LEU  24  -6.192   1.298  -5.943
  175    H    ARG  25           H        ARG  25  -0.604   1.337  -3.007
  176    HA   ARG  25           HA       ARG  25  -0.050  -1.270  -3.994
  177   1HB   ARG  25          1HB       ARG  25   1.535   0.846  -3.233
  178   2HB   ARG  25          2HB       ARG  25   1.801  -0.216  -1.861
  179   1HG   ARG  25          1HG       ARG  25   3.506  -0.581  -3.546
  180   2HG   ARG  25          2HG       ARG  25   2.506  -2.041  -3.434
  181   1HD   ARG  25          1HD       ARG  25   1.484  -1.672  -5.509
  182   2HD   ARG  25          2HD       ARG  25   1.709   0.083  -5.405
  183    HE   ARG  25           HE       ARG  25   4.187  -1.456  -5.691
  184   1HH1  ARG  25          2HH2      ARG  25   1.604   0.098  -7.434
  185   2HH1  ARG  25          1HH2      ARG  25   2.587   0.562  -8.792
  186   1HH2  ARG  25          2HH1      ARG  25   5.501  -0.834  -7.489
  187   2HH2  ARG  25          1HH1      ARG  25   4.702  -0.191  -8.888
  188    H    ARG  26           H        ARG  26  -0.351  -0.280  -0.581
  189    HA   ARG  26           HA       ARG  26  -0.039  -2.938   0.484
  190   1HB   ARG  26          1HB       ARG  26   0.072  -0.705   1.759
  191   2HB   ARG  26          2HB       ARG  26  -1.692  -0.729   1.742
  192   1HG   ARG  26          1HG       ARG  26  -1.028  -3.309   2.668
  193   2HG   ARG  26          2HG       ARG  26   0.264  -2.327   3.324
  194   1HD   ARG  26          1HD       ARG  26  -2.155  -0.890   3.857
  195   2HD   ARG  26          2HD       ARG  26  -2.531  -2.597   4.124
  196    HE   ARG  26           HE       ARG  26  -0.044  -1.779   5.396
  197   1HH1  ARG  26          2HH2      ARG  26  -3.499  -1.957   5.915
  198   2HH1  ARG  26          1HH2      ARG  26  -3.334  -1.841   7.660
  199   1HH2  ARG  26          2HH1      ARG  26   0.071  -1.640   7.691
  200   2HH2  ARG  26          1HH1      ARG  26  -1.400  -1.593   8.613
  201    H    TYR  27           H        TYR  27  -2.997  -1.104  -0.382
  202    HA   TYR  27           HA       TYR  27  -4.942  -2.977   0.390
  203   1HB   TYR  27          1HB       TYR  27  -5.376  -0.638  -0.248
  204   2HB   TYR  27          2HB       TYR  27  -4.895  -0.971  -1.903
  205    HD1  TYR  27           1HD      TYR  27  -7.279  -2.407   0.643
  206    HD2  TYR  27           2HD      TYR  27  -6.671  -1.072  -3.414
  207    HE1  TYR  27           1HE      TYR  27  -9.665  -2.900   0.115
  208    HE2  TYR  27           2HE      TYR  27  -9.054  -1.545  -3.930
  209    HH   TYR  27           HH       TYR  27 -10.827  -3.353  -2.787
  210    H    ILE  28           H        ILE  28  -3.339  -2.635  -2.813
  211    HA   ILE  28           HA       ILE  28  -4.533  -4.942  -4.010
  212    HB   ILE  28           HB       ILE  28  -1.905  -3.535  -4.534
  213   2HG1  ILE  28          2HG1      ILE  28  -4.177  -2.275  -4.855
  214   1HG2  ILE  28          1HG2      ILE  28  -2.787  -6.066  -5.632
  215   2HG2  ILE  28          2HG2      ILE  28  -2.877  -4.873  -6.906
  216   3HG2  ILE  28          3HG2      ILE  28  -1.354  -5.105  -6.039
  217   1HD1  ILE  28          1HD1      ILE  28  -2.368  -2.563  -7.286
  218   2HD1  ILE  28          2HD1      ILE  28  -3.449  -1.217  -6.913
  219   3HD1  ILE  28          3HD1      ILE  28  -2.037  -1.522  -5.885
  220    H    ASN  29           H        ASN  29  -1.418  -4.591  -2.174
  221    HA   ASN  29           HA       ASN  29  -0.675  -7.326  -2.308
  222   1HB   ASN  29          1HB       ASN  29   0.291  -5.010  -0.976
  223   2HB   ASN  29          2HB       ASN  29  -0.083  -6.127   0.322
  224   1HD2  ASN  29          1HD2      ASN  29   1.523  -5.996  -2.883
  225   2HD2  ASN  29          2HD2      ASN  29   2.796  -7.129  -2.404
  226    H    MET  30           H        MET  30  -2.793  -5.708   0.038
  227    HA   MET  30           HA       MET  30  -3.367  -8.037   1.604
  228   1HB   MET  30          1HB       MET  30  -3.881  -5.265   1.738
  229   2HB   MET  30          2HB       MET  30  -5.473  -5.955   1.528
  230   1HG   MET  30          1HG       MET  30  -3.711  -7.302   3.548
  231   2HG   MET  30          2HG       MET  30  -4.117  -5.630   3.899
  232   1HE   MET  30          1HE       MET  30  -6.801  -4.980   2.994
  233   2HE   MET  30          2HE       MET  30  -7.970  -5.582   4.176
  234    H    LEU  31           H        LEU  31  -4.976  -6.686  -1.330
  235    HA   LEU  31           HA       LEU  31  -7.176  -8.517  -1.294
  236   1HB   LEU  31          1HB       LEU  31  -5.779  -6.782  -3.354
  237   2HB   LEU  31          2HB       LEU  31  -7.043  -7.871  -3.838
  238    HG   LEU  31           HG       LEU  31  -7.449  -5.736  -1.698
  239   1HD1  LEU  31          1HD1      LEU  31  -7.704  -5.654  -4.712
  240   2HD1  LEU  31          2HD1      LEU  31  -8.792  -4.683  -3.704
  241   3HD1  LEU  31          3HD1      LEU  31  -7.046  -4.448  -3.588
  242   1HD2  LEU  31          1HD2      LEU  31  -9.869  -6.134  -2.284
  243   2HD2  LEU  31          2HD2      LEU  31  -9.352  -7.552  -3.231
  244   3HD2  LEU  31          3HD2      LEU  31  -9.081  -7.477  -1.473
  245    H    THR  32           H        THR  32  -3.860  -8.856  -2.359
  246    HA   THR  32           HA       THR  32  -4.381 -11.501  -3.560
  247    HB   THR  32           HB       THR  32  -1.659 -10.256  -3.109
  248    HG1  THR  32           1HG      THR  32  -3.565  -9.799  -5.144
  249   1HG2  THR  32          1HG2      THR  32  -0.939 -11.523  -4.973
  250   2HG2  THR  32          2HG2      THR  32  -1.934 -12.699  -4.108
  251   3HG2  THR  32          3HG2      THR  32  -2.590 -11.879  -5.526
  252    H    ARG  33           H        ARG  33  -4.617 -10.792  -0.449
  253    HA   ARG  33           HA       ARG  33  -2.831 -12.479   0.943
  254   1HB   ARG  33          1HB       ARG  33  -5.434 -11.247   1.547
  255   2HB   ARG  33          2HB       ARG  33  -5.406 -12.870   2.104
  256   1HG   ARG  33          1HG       ARG  33  -2.967 -12.080   3.055
  257   2HG   ARG  33          2HG       ARG  33  -3.838 -10.535   3.068
  258   1HD   ARG  33          1HD       ARG  33  -5.645 -12.519   4.107
  259   2HD   ARG  33          2HD       ARG  33  -4.064 -12.883   4.805
  260    HE   ARG  33           HE       ARG  33  -4.512 -10.110   5.089
  261   1HH1  ARG  33          2HH2      ARG  33  -6.148 -13.006   6.143
  262   2HH1  ARG  33          1HH2      ARG  33  -6.754 -12.293   7.603
  263   1HH2  ARG  33          2HH1      ARG  33  -5.184  -9.232   7.048
  264   2HH2  ARG  33          1HH1      ARG  33  -6.130 -10.186   8.144
  265    HA   PRO  34           HA       PRO  34  -5.458 -16.343   0.276
  266   1HB   PRO  34          1HB       PRO  34  -7.667 -16.387  -1.379
  267   2HB   PRO  34          2HB       PRO  34  -7.717 -15.907   0.337
  268   1HG   PRO  34          1HG       PRO  34  -7.794 -14.167  -2.100
  269   2HG   PRO  34          2HG       PRO  34  -8.570 -13.933  -0.504
  270   1HD   PRO  34          1HD       PRO  34  -6.160 -12.767  -1.424
  271   2HD   PRO  34          2HD       PRO  34  -6.770 -12.763   0.252
  272    H    ARG  35           H        ARG  35  -3.744 -14.671  -1.747
  273    HA   ARG  35           HA       ARG  35  -2.441 -15.034  -3.524
  274   1HB   ARG  35          1HB       ARG  35  -2.716 -17.551  -2.525
  275   2HB   ARG  35          2HB       ARG  35  -3.509 -17.790  -4.075
  276   1HG   ARG  35          1HG       ARG  35  -1.279 -18.377  -4.435
  277   2HG   ARG  35          2HG       ARG  35  -1.383 -16.763  -5.152
  278   1HD   ARG  35          1HD       ARG  35  -0.287 -15.748  -3.265
  279   2HD   ARG  35          2HD       ARG  35  -0.495 -17.177  -2.259
  280    HE   ARG  35           HE       ARG  35   1.586 -16.698  -4.229
  281   1HH1  ARG  35          2HH2      ARG  35  -0.123 -19.248  -2.561
  282   2HH1  ARG  35          1HH2      ARG  35   1.142 -20.425  -2.807
  283   1HH2  ARG  35          2HH1      ARG  35   3.193 -18.280  -4.550
  284   2HH2  ARG  35          1HH1      ARG  35   2.914 -19.903  -3.991
  285    H    TYR  36           H        TYR  36  -5.723 -15.102  -3.764
  286    HA   TYR  36           HA       TYR  36  -7.272 -14.641  -5.333
  287   1HB   TYR  36          1HB       TYR  36  -5.526 -12.702  -5.442
  288   2HB   TYR  36          2HB       TYR  36  -5.170 -13.326  -7.040
  289    HD1  TYR  36           1HD      TYR  36  -7.354 -11.302  -5.010
  290    HD2  TYR  36           2HD      TYR  36  -7.178 -13.530  -8.699
  291    HE1  TYR  36           1HE      TYR  36  -9.336 -10.059  -5.859
  292    HE2  TYR  36           2HE      TYR  36  -9.189 -12.315  -9.527
  293    HH   TYR  36           HH       TYR  36 -11.043 -11.021  -8.743
  294   1HN   NH2  37          1HN       NH2  37  -7.381 -17.075  -5.686
  295   2HN   NH2  37          2HN       NH2  37  -6.978 -17.592  -7.324
  Start of MODEL   17
    1   1H    ALA   1          1H        ALA   1 -20.584   3.246  13.735
    2   2H    ALA   1          2H        ALA   1 -19.688   3.402  12.358
    3   3H    ALA   1          3H        ALA   1 -21.167   2.684  12.294
    4    HA   ALA   1           HA       ALA   1 -18.798   1.674  13.674
    5   1HB   ALA   1          1HB       ALA   1 -20.476  -0.451  13.738
    6   2HB   ALA   1          2HB       ALA   1 -20.278   0.721  15.050
    7   3HB   ALA   1          3HB       ALA   1 -21.643   0.879  13.927
    8    HA   PRO   2           HA       PRO   2 -19.086  -1.194   9.972
    9   1HB   PRO   2          1HB       PRO   2 -21.005  -0.889   7.991
   10   2HB   PRO   2          2HB       PRO   2 -21.152  -1.960   9.410
   11   1HG   PRO   2          1HG       PRO   2 -22.452   0.692   8.923
   12   2HG   PRO   2          2HG       PRO   2 -23.013  -0.691   9.909
   13   1HD   PRO   2          1HD       PRO   2 -21.791   1.671  10.842
   14   2HD   PRO   2          2HD       PRO   2 -22.045   0.173  11.782
   15    H    LEU   3           H        LEU   3 -20.507   1.862   8.639
   16    HA   LEU   3           HA       LEU   3 -17.956   2.842   7.759
   17   1HB   LEU   3          1HB       LEU   3 -19.037   1.053   6.035
   18   2HB   LEU   3          2HB       LEU   3 -19.963   2.439   5.517
   19    HG   LEU   3           HG       LEU   3 -17.012   2.915   5.785
   20   1HD1  LEU   3          1HD1      LEU   3 -16.476   0.924   4.847
   21   2HD1  LEU   3          2HD1      LEU   3 -18.064   0.673   4.102
   22   3HD1  LEU   3          3HD1      LEU   3 -16.888   1.754   3.345
   23   1HD2  LEU   3          1HD2      LEU   3 -18.623   4.559   4.794
   24   2HD2  LEU   3          2HD2      LEU   3 -17.291   4.115   3.723
   25   3HD2  LEU   3          3HD2      LEU   3 -18.909   3.416   3.463
   26    H    GLU   4           H        GLU   4 -18.148   5.047   7.247
   27    HA   GLU   4           HA       GLU   4 -20.015   6.889   6.800
   28   1HB   GLU   4          1HB       GLU   4 -20.667   5.786   9.473
   29   2HB   GLU   4          2HB       GLU   4 -20.368   7.489   9.511
   30   1HG   GLU   4          1HG       GLU   4 -22.282   6.312   7.474
   31   2HG   GLU   4          2HG       GLU   4 -22.776   6.698   9.123
   32    HA   PRO   5           HA       PRO   5 -16.783   9.141   9.366
   33   1HB   PRO   5          1HB       PRO   5 -15.039   7.875  11.070
   34   2HB   PRO   5          2HB       PRO   5 -16.665   8.440  11.550
   35   1HG   PRO   5          1HG       PRO   5 -15.751   5.650  10.923
   36   2HG   PRO   5          2HG       PRO   5 -16.989   6.200  12.089
   37   1HD   PRO   5          1HD       PRO   5 -17.445   5.173   9.507
   38   2HD   PRO   5          2HD       PRO   5 -18.636   6.066  10.500
   39    H    VAL   6           H        VAL   6 -15.569   9.690   7.729
   40    HA   VAL   6           HA       VAL   6 -13.843   9.911   6.284
   41    HB   VAL   6           HB       VAL   6 -12.487   7.605   7.738
   42   1HG1  VAL   6          1HG1      VAL   6 -11.517   9.436   5.538
   43   2HG1  VAL   6          2HG1      VAL   6 -10.405   8.734   6.730
   44   3HG1  VAL   6          3HG1      VAL   6 -11.363   7.663   5.711
   45   1HG2  VAL   6          1HG2      VAL   6 -12.856   9.506   9.232
   46   2HG2  VAL   6          2HG2      VAL   6 -11.155   9.424   8.786
   47   3HG2  VAL   6          3HG2      VAL   6 -12.215  10.631   8.012
   48    H    TYR   7           H        TYR   7 -13.225   9.159   4.192
   49    HA   TYR   7           HA       TYR   7 -14.397   6.628   3.308
   50   1HB   TYR   7          1HB       TYR   7 -15.795   7.723   1.628
   51   2HB   TYR   7          2HB       TYR   7 -16.259   8.206   3.240
   52    HD1  TYR   7           1HD      TYR   7 -15.261   9.362  -0.033
   53    HD2  TYR   7           2HD      TYR   7 -15.494  10.510   4.119
   54    HE1  TYR   7           1HE      TYR   7 -15.106  11.741  -0.688
   55    HE2  TYR   7           2HE      TYR   7 -15.287  12.891   3.460
   56    HH   TYR   7           HH       TYR   7 -15.545  13.934   0.122
   57    HA   PRO   8           HA       PRO   8 -10.977   7.012   0.443
   58   1HB   PRO   8          1HB       PRO   8 -11.712   5.217  -1.514
   59   2HB   PRO   8          2HB       PRO   8 -11.132   4.746   0.107
   60   1HG   PRO   8          1HG       PRO   8 -13.939   4.756  -0.956
   61   2HG   PRO   8          2HG       PRO   8 -13.174   3.653   0.233
   62   1HD   PRO   8          1HD       PRO   8 -14.835   5.874   0.803
   63   2HD   PRO   8          2HD       PRO   8 -13.794   5.010   1.973
   64    H    GLY   9           H        GLY   9 -10.467   7.578  -1.821
   65   1HA   GLY   9          1HA       GLY   9 -10.885   8.638  -3.893
   66   2HA   GLY   9          2HA       GLY   9 -12.575   8.857  -3.447
   67    H    ASP  10           H        ASP  10  -9.318  10.206  -3.224
   68    HA   ASP  10           HA       ASP  10 -10.328  12.885  -2.770
   69   1HB   ASP  10          1HB       ASP  10  -8.954  11.277  -0.636
   70   2HB   ASP  10          2HB       ASP  10  -8.186  12.816  -0.978
   71    H    ASN  11           H        ASN  11  -8.748  14.441  -3.368
   72    HA   ASN  11           HA       ASN  11  -6.107  13.626  -4.339
   73   1HB   ASN  11          1HB       ASN  11  -8.110  14.861  -6.286
   74   2HB   ASN  11          2HB       ASN  11  -6.394  14.579  -6.587
   75   1HD2  ASN  11          1HD2      ASN  11  -9.556  13.075  -6.392
   76   2HD2  ASN  11          2HD2      ASN  11  -8.938  11.556  -7.112
   77    H    ALA  12           H        ALA  12  -5.445  15.037  -2.616
   78    HA   ALA  12           HA       ALA  12  -4.928  17.710  -3.474
   79   1HB   ALA  12          1HB       ALA  12  -6.369  17.623  -0.808
   80   2HB   ALA  12          2HB       ALA  12  -6.188  18.962  -1.962
   81   3HB   ALA  12          3HB       ALA  12  -7.353  17.668  -2.275
   82    H    THR  13           H        THR  13  -3.321  18.620  -2.005
   83    HA   THR  13           HA       THR  13  -1.404  18.581  -0.883
   84    HB   THR  13           HB       THR  13  -2.928  18.805   0.960
   85    HG1  THR  13           1HG      THR  13  -0.950  18.960   1.671
   86   1HG2  THR  13          1HG2      THR  13  -3.104  16.834   2.609
   87   2HG2  THR  13          2HG2      THR  13  -4.162  16.746   1.189
   88   3HG2  THR  13          3HG2      THR  13  -2.646  15.807   1.254
   89    HA   PRO  14           HA       PRO  14   0.933  14.977  -1.879
   90   1HB   PRO  14          1HB       PRO  14   3.344  15.483  -0.610
   91   2HB   PRO  14          2HB       PRO  14   2.831  16.144  -2.186
   92   1HG   PRO  14          1HG       PRO  14   2.962  17.514   0.454
   93   2HG   PRO  14          2HG       PRO  14   3.049  18.210  -1.190
   94   1HD   PRO  14          1HD       PRO  14   0.856  18.148   0.571
   95   2HD   PRO  14          2HD       PRO  14   0.773  18.666  -1.121
   96    H    GLU  15           H        GLU  15   0.244  15.869   1.423
   97    HA   GLU  15           HA       GLU  15   1.267  13.438   2.630
   98   1HB   GLU  15          1HB       GLU  15   1.063  15.594   3.854
   99   2HB   GLU  15          2HB       GLU  15  -0.694  15.572   3.646
  100   1HG   GLU  15          1HG       GLU  15  -0.924  13.675   5.124
  101   2HG   GLU  15          2HG       GLU  15   0.818  13.380   5.110
  102    H    GLN  16           H        GLN  16  -1.620  14.205   0.976
  103    HA   GLN  16           HA       GLN  16  -3.002  11.740   1.938
  104   1HB   GLN  16          1HB       GLN  16  -4.074  14.214   1.499
  105   2HB   GLN  16          2HB       GLN  16  -4.267  13.503  -0.099
  106   1HG   GLN  16          1HG       GLN  16  -6.281  13.079   1.001
  107   2HG   GLN  16          2HG       GLN  16  -5.413  11.535   1.080
  108   1HE2  GLN  16          1HE2      GLN  16  -6.686  10.880   2.969
  109   2HE2  GLN  16          2HE2      GLN  16  -6.346  11.650   4.523
  110    H    MET  17           H        MET  17  -1.516  13.250  -0.953
  111    HA   MET  17           HA       MET  17  -2.316  11.155  -2.796
  112   1HB   MET  17          1HB       MET  17  -0.794  13.697  -2.839
  113   2HB   MET  17          2HB       MET  17  -0.106  12.479  -3.878
  114   1HG   MET  17          1HG       MET  17  -3.089  12.929  -3.972
  115   2HG   MET  17          2HG       MET  17  -2.024  14.106  -4.729
  116   1HE   MET  17          1HE       MET  17  -3.898  10.822  -5.153
  117   2HE   MET  17          2HE       MET  17  -4.335  12.229  -6.148
  118    H    ALA  18           H        ALA  18   0.715  11.830  -0.877
  119    HA   ALA  18           HA       ALA  18   2.107   9.562  -1.967
  120   1HB   ALA  18          1HB       ALA  18   2.434  11.036   0.686
  121   2HB   ALA  18          2HB       ALA  18   3.613   9.926  -0.040
  122   3HB   ALA  18          3HB       ALA  18   3.234  11.462  -0.844
  123    H    ARG  19           H        ARG  19  -0.272   9.975   0.543
  124    HA   ARG  19           HA       ARG  19   0.091   7.252   1.627
  125   1HB   ARG  19          1HB       ARG  19  -1.368   9.619   2.478
  126   2HB   ARG  19          2HB       ARG  19  -2.504   8.311   2.279
  127   1HG   ARG  19          1HG       ARG  19  -1.814   8.094   4.495
  128   2HG   ARG  19          2HG       ARG  19  -0.875   6.845   3.672
  129   1HD   ARG  19          1HD       ARG  19   1.113   7.864   4.138
  130   2HD   ARG  19          2HD       ARG  19   0.517   9.473   3.746
  131    HE   ARG  19           HE       ARG  19   0.543   8.184   6.378
  132   1HH1  ARG  19          2HH2      ARG  19  -0.809  10.954   4.542
  133   2HH1  ARG  19          1HH2      ARG  19  -1.361  11.687   5.999
  134   1HH2  ARG  19          2HH1      ARG  19  -0.175   9.313   8.204
  135   2HH2  ARG  19          1HH1      ARG  19  -0.927  10.852   8.002
  136    H    TYR  20           H        TYR  20  -2.095   8.843  -0.683
  137    HA   TYR  20           HA       TYR  20  -3.891   6.721  -1.146
  138   1HB   TYR  20          1HB       TYR  20  -4.211   9.029  -1.939
  139   2HB   TYR  20          2HB       TYR  20  -2.852   8.882  -3.029
  140    HD1  TYR  20           1HD      TYR  20  -6.402   8.384  -2.659
  141    HD2  TYR  20           2HD      TYR  20  -2.953   7.245  -4.997
  142    HE1  TYR  20           1HE      TYR  20  -7.890   7.579  -4.486
  143    HE2  TYR  20           2HE      TYR  20  -4.443   6.400  -6.781
  144    HH   TYR  20           HH       TYR  20  -7.865   6.970  -6.827
  145    H    TYR  21           H        TYR  21  -0.996   7.583  -3.055
  146    HA   TYR  21           HA       TYR  21  -1.085   5.353  -4.811
  147   1HB   TYR  21          1HB       TYR  21   0.252   7.415  -5.131
  148   2HB   TYR  21          2HB       TYR  21   1.336   6.931  -3.837
  149    HD1  TYR  21           1HD      TYR  21   0.862   6.923  -7.344
  150    HD2  TYR  21           2HD      TYR  21   2.493   4.515  -4.156
  151    HE1  TYR  21           1HE      TYR  21   2.205   5.657  -8.990
  152    HE2  TYR  21           2HE      TYR  21   3.795   3.221  -5.815
  153    HH   TYR  21           HH       TYR  21   3.401   3.608  -9.281
  154    H    SER  22           H        SER  22   0.721   5.719  -1.742
  155    HA   SER  22           HA       SER  22   1.880   3.077  -1.817
  156   1HB   SER  22          1HB       SER  22   1.585   5.189   0.320
  157   2HB   SER  22          2HB       SER  22   2.150   3.564   0.729
  158    HG   SER  22           HG       SER  22   3.902   4.821   0.231
  159    H    ALA  23           H        ALA  23  -1.077   4.405  -0.258
  160    HA   ALA  23           HA       ALA  23  -1.910   1.998   0.983
  161   1HB   ALA  23          1HB       ALA  23  -3.568   4.315  -0.103
  162   2HB   ALA  23          2HB       ALA  23  -4.181   3.000   0.916
  163   3HB   ALA  23          3HB       ALA  23  -2.960   4.109   1.562
  164    H    LEU  24           H        LEU  24  -2.522   3.227  -2.408
  165    HA   LEU  24           HA       LEU  24  -4.162   1.072  -3.229
  166   1HB   LEU  24          1HB       LEU  24  -4.073   2.875  -4.704
  167   2HB   LEU  24          2HB       LEU  24  -2.348   3.085  -4.516
  168    HG   LEU  24           HG       LEU  24  -1.971   1.015  -5.852
  169   1HD1  LEU  24          1HD1      LEU  24  -4.974   1.137  -6.058
  170   2HD1  LEU  24          2HD1      LEU  24  -4.051   0.592  -7.477
  171   3HD1  LEU  24          3HD1      LEU  24  -3.881  -0.260  -5.949
  172   1HD2  LEU  24          1HD2      LEU  24  -1.470   2.477  -7.391
  173   2HD2  LEU  24          2HD2      LEU  24  -3.142   2.534  -7.954
  174   3HD2  LEU  24          3HD2      LEU  24  -2.572   3.661  -6.720
  175    H    ARG  25           H        ARG  25  -0.577   1.351  -3.291
  176    HA   ARG  25           HA       ARG  25  -0.170  -1.266  -4.354
  177   1HB   ARG  25          1HB       ARG  25   1.477   0.894  -3.444
  178   2HB   ARG  25          2HB       ARG  25   1.992  -0.511  -2.515
  179   1HG   ARG  25          1HG       ARG  25   1.644  -0.464  -5.545
  180   2HG   ARG  25          2HG       ARG  25   3.180  -0.183  -4.730
  181   1HD   ARG  25          1HD       ARG  25   1.632  -2.736  -4.151
  182   2HD   ARG  25          2HD       ARG  25   2.533  -2.595  -5.643
  183    HE   ARG  25           HE       ARG  25   3.615  -2.832  -2.934
  184   1HH1  ARG  25          2HH2      ARG  25   4.371  -1.944  -6.219
  185   2HH1  ARG  25          1HH2      ARG  25   6.096  -2.135  -6.023
  186   1HH2  ARG  25          2HH1      ARG  25   5.851  -3.111  -2.704
  187   2HH2  ARG  25          1HH1      ARG  25   6.898  -2.833  -4.069
  188    H    ARG  26           H        ARG  26  -0.161  -0.232  -0.935
  189    HA   ARG  26           HA       ARG  26   0.181  -2.890   0.097
  190   1HB   ARG  26          1HB       ARG  26   0.537  -0.622   1.234
  191   2HB   ARG  26          2HB       ARG  26  -1.206  -0.601   1.563
  192   1HG   ARG  26          1HG       ARG  26  -1.053  -2.606   2.903
  193   2HG   ARG  26          2HG       ARG  26   0.578  -2.960   2.330
  194   1HD   ARG  26          1HD       ARG  26   1.539  -1.730   3.905
  195   2HD   ARG  26          2HD       ARG  26   0.570  -0.304   3.490
  196    HE   ARG  26           HE       ARG  26  -1.096  -2.038   4.950
  197   1HH1  ARG  26          2HH2      ARG  26   1.738  -0.109   5.523
  198   2HH1  ARG  26          1HH2      ARG  26   1.433   0.107   7.228
  199   1HH2  ARG  26          2HH1      ARG  26  -1.548  -1.697   7.115
  200   2HH2  ARG  26          1HH1      ARG  26  -0.448  -0.780   8.103
  201    H    TYR  27           H        TYR  27  -2.740  -1.055  -0.654
  202    HA   TYR  27           HA       TYR  27  -4.748  -2.784   0.313
  203   1HB   TYR  27          1HB       TYR  27  -5.167  -0.489  -0.383
  204   2HB   TYR  27          2HB       TYR  27  -4.661  -0.854  -2.028
  205    HD1  TYR  27           1HD      TYR  27  -6.395  -0.851  -3.559
  206    HD2  TYR  27           2HD      TYR  27  -7.098  -2.287   0.450
  207    HE1  TYR  27           1HE      TYR  27  -8.785  -1.294  -4.126
  208    HE2  TYR  27           2HE      TYR  27  -9.460  -2.746  -0.118
  209    HH   TYR  27           HH       TYR  27 -10.982  -2.837  -1.796
  210    H    ILE  28           H        ILE  28  -3.124  -2.712  -2.921
  211    HA   ILE  28           HA       ILE  28  -4.466  -5.051  -3.929
  212    HB   ILE  28           HB       ILE  28  -1.804  -3.757  -4.590
  213   2HG1  ILE  28          2HG1      ILE  28  -2.954  -3.144  -6.702
  214   1HG2  ILE  28          1HG2      ILE  28  -1.481  -6.097  -5.153
  215   2HG2  ILE  28          2HG2      ILE  28  -3.044  -6.161  -5.989
  216   3HG2  ILE  28          3HG2      ILE  28  -1.717  -5.167  -6.630
  217   1HD1  ILE  28          1HD1      ILE  28  -5.315  -3.224  -6.989
  218   2HD1  ILE  28          2HD1      ILE  28  -4.872  -4.884  -6.556
  219   3HD1  ILE  28          3HD1      ILE  28  -5.592  -3.805  -5.343
  220    H    ASN  29           H        ASN  29  -1.307  -4.768  -2.223
  221    HA   ASN  29           HA       ASN  29  -0.858  -7.566  -2.138
  222   1HB   ASN  29          1HB       ASN  29   0.640  -5.462  -1.415
  223   2HB   ASN  29          2HB       ASN  29   0.045  -5.897   0.187
  224   1HD2  ASN  29          1HD2      ASN  29   1.621  -7.184   1.234
  225   2HD2  ASN  29          2HD2      ASN  29   2.550  -8.391   0.336
  226    H    MET  30           H        MET  30  -2.810  -5.536   0.026
  227    HA   MET  30           HA       MET  30  -3.555  -7.618   1.867
  228   1HB   MET  30          1HB       MET  30  -4.147  -4.785   1.434
  229   2HB   MET  30          2HB       MET  30  -5.578  -5.679   1.910
  230   1HG   MET  30          1HG       MET  30  -4.593  -6.438   3.925
  231   2HG   MET  30          2HG       MET  30  -2.961  -6.054   3.377
  232   1HE   MET  30          1HE       MET  30  -6.022  -2.824   3.723
  233   2HE   MET  30          2HE       MET  30  -6.374  -4.562   3.667
  234    H    LEU  31           H        LEU  31  -5.173  -6.403  -1.117
  235    HA   LEU  31           HA       LEU  31  -7.472  -8.098  -0.871
  236   1HB   LEU  31          1HB       LEU  31  -6.091  -6.505  -3.052
  237   2HB   LEU  31          2HB       LEU  31  -7.453  -7.527  -3.439
  238    HG   LEU  31           HG       LEU  31  -7.613  -5.329  -1.339
  239   1HD1  LEU  31          1HD1      LEU  31  -9.014  -4.355  -3.441
  240   2HD1  LEU  31          2HD1      LEU  31  -7.281  -4.054  -3.189
  241   3HD1  LEU  31          3HD1      LEU  31  -7.811  -5.294  -4.335
  242   1HD2  LEU  31          1HD2      LEU  31  -9.691  -7.067  -2.723
  243   2HD2  LEU  31          2HD2      LEU  31  -9.364  -6.915  -0.980
  244   3HD2  LEU  31          3HD2      LEU  31 -10.088  -5.568  -1.850
  245    H    THR  32           H        THR  32  -4.255  -8.633  -2.107
  246    HA   THR  32           HA       THR  32  -5.024 -11.368  -3.018
  247    HB   THR  32           HB       THR  32  -3.712  -9.563  -4.396
  248    HG1  THR  32           1HG      THR  32  -4.254 -11.635  -5.062
  249   1HG2  THR  32          1HG2      THR  32  -1.400  -9.550  -4.312
  250   2HG2  THR  32          2HG2      THR  32  -1.791  -9.586  -2.583
  251   3HG2  THR  32          3HG2      THR  32  -1.303 -11.079  -3.418
  252    H    ARG  33           H        ARG  33  -3.784  -9.983  -0.265
  253    HA   ARG  33           HA       ARG  33  -1.876 -11.762   0.765
  254   1HB   ARG  33          1HB       ARG  33  -3.713  -9.742   1.786
  255   2HB   ARG  33          2HB       ARG  33  -3.623 -11.040   2.921
  256   1HG   ARG  33          1HG       ARG  33  -1.018  -9.913   1.895
  257   2HG   ARG  33          2HG       ARG  33  -2.009  -8.915   2.955
  258   1HD   ARG  33          1HD       ARG  33  -0.609 -10.031   4.455
  259   2HD   ARG  33          2HD       ARG  33  -2.139 -10.880   4.573
  260    HE   ARG  33           HE       ARG  33  -1.204 -12.780   3.595
  261   1HH1  ARG  33          2HH2      ARG  33   1.058 -10.155   3.239
  262   2HH1  ARG  33          1HH2      ARG  33   2.281 -11.161   2.492
  263   1HH2  ARG  33          2HH1      ARG  33   0.484 -14.086   2.911
  264   2HH2  ARG  33          1HH1      ARG  33   2.037 -13.395   2.562
  265    HA   PRO  34           HA       PRO  34  -5.203 -14.729   2.356
  266   1HB   PRO  34          1HB       PRO  34  -7.853 -14.474   1.681
  267   2HB   PRO  34          2HB       PRO  34  -7.096 -13.713   3.109
  268   1HG   PRO  34          1HG       PRO  34  -7.881 -12.449   0.504
  269   2HG   PRO  34          2HG       PRO  34  -7.839 -11.737   2.149
  270   1HD   PRO  34          1HD       PRO  34  -5.905 -11.446   0.126
  271   2HD   PRO  34          2HD       PRO  34  -5.700 -11.034   1.850
  272    H    ARG  35           H        ARG  35  -4.260 -16.194   1.058
  273    HA   ARG  35           HA       ARG  35  -5.735 -17.339  -1.146
  274   1HB   ARG  35          1HB       ARG  35  -3.546 -15.457  -1.739
  275   2HB   ARG  35          2HB       ARG  35  -3.207 -17.054  -2.383
  276   1HG   ARG  35          1HG       ARG  35  -5.410 -17.118  -3.491
  277   2HG   ARG  35          2HG       ARG  35  -5.757 -15.493  -2.919
  278   1HD   ARG  35          1HD       ARG  35  -4.569 -14.539  -4.557
  279   2HD   ARG  35          2HD       ARG  35  -3.146 -15.502  -4.212
  280    HE   ARG  35           HE       ARG  35  -5.110 -15.942  -6.304
  281   1HH1  ARG  35          2HH2      ARG  35  -2.755 -17.634  -4.352
  282   2HH1  ARG  35          1HH2      ARG  35  -2.600 -18.979  -5.446
  283   1HH2  ARG  35          2HH1      ARG  35  -5.011 -17.757  -7.645
  284   2HH2  ARG  35          1HH1      ARG  35  -3.906 -19.043  -7.273
  285    H    TYR  36           H        TYR  36  -5.790 -19.026   0.328
  286    HA   TYR  36           HA       TYR  36  -3.296 -20.650   0.459
  287   1HB   TYR  36          1HB       TYR  36  -4.223 -19.334   2.641
  288   2HB   TYR  36          2HB       TYR  36  -5.207 -20.777   2.766
  289    HD1  TYR  36           1HD      TYR  36  -1.873 -19.311   3.047
  290    HD2  TYR  36           2HD      TYR  36  -4.057 -23.032   3.096
  291    HE1  TYR  36           1HE      TYR  36   0.072 -20.444   4.117
  292    HE2  TYR  36           2HE      TYR  36  -2.089 -24.172   4.116
  293    HH   TYR  36           HH       TYR  36  -0.039 -23.191   5.688
  294   1HN   NH2  37          1HN       NH2  37  -3.700 -23.043   0.747
  295   2HN   NH2  37          2HN       NH2  37  -5.213 -23.619   0.032
  Start of MODEL   18
    1   1H    ALA   1          1H        ALA   1 -26.563  15.885   3.033
    2   2H    ALA   1          2H        ALA   1 -25.612  15.222   1.849
    3   3H    ALA   1          3H        ALA   1 -24.933  15.790   3.238
    4    HA   ALA   1           HA       ALA   1 -25.969  17.227   0.959
    5   1HB   ALA   1          1HB       ALA   1 -26.386  18.082   3.770
    6   2HB   ALA   1          2HB       ALA   1 -25.701  19.302   2.679
    7   3HB   ALA   1          3HB       ALA   1 -27.234  18.518   2.277
    8    HA   PRO   2           HA       PRO   2 -21.634  18.803   1.807
    9   1HB   PRO   2          1HB       PRO   2 -20.171  18.059   4.038
   10   2HB   PRO   2          2HB       PRO   2 -21.225  19.495   3.938
   11   1HG   PRO   2          1HG       PRO   2 -21.727  16.900   5.329
   12   2HG   PRO   2          2HG       PRO   2 -22.346  18.535   5.703
   13   1HD   PRO   2          1HD       PRO   2 -23.714  16.456   4.359
   14   2HD   PRO   2          2HD       PRO   2 -24.218  18.170   4.469
   15    H    LEU   3           H        LEU   3 -21.633  15.577   3.410
   16    HA   LEU   3           HA       LEU   3 -19.529  14.526   1.655
   17   1HB   LEU   3          1HB       LEU   3 -21.231  13.421   3.908
   18   2HB   LEU   3          2HB       LEU   3 -20.187  12.375   2.960
   19    HG   LEU   3           HG       LEU   3 -18.920  14.886   4.029
   20   1HD1  LEU   3          1HD1      LEU   3 -18.556  13.984   6.242
   21   2HD1  LEU   3          2HD1      LEU   3 -20.295  14.128   5.939
   22   3HD1  LEU   3          3HD1      LEU   3 -19.513  12.532   5.854
   23   1HD2  LEU   3          1HD2      LEU   3 -17.950  12.568   2.790
   24   2HD2  LEU   3          2HD2      LEU   3 -17.002  13.774   3.660
   25   3HD2  LEU   3          3HD2      LEU   3 -17.557  12.315   4.500
   26    H    GLU   4           H        GLU   4 -20.600  15.011  -0.351
   27    HA   GLU   4           HA       GLU   4 -22.891  13.283  -1.067
   28   1HB   GLU   4          1HB       GLU   4 -21.422  15.516  -2.469
   29   2HB   GLU   4          2HB       GLU   4 -22.500  14.445  -3.356
   30   1HG   GLU   4          1HG       GLU   4 -23.765  15.397  -0.885
   31   2HG   GLU   4          2HG       GLU   4 -23.217  16.737  -1.865
   32    HA   PRO   5           HA       PRO   5 -20.370  10.155  -2.949
   33   1HB   PRO   5          1HB       PRO   5 -22.172   8.942  -4.629
   34   2HB   PRO   5          2HB       PRO   5 -22.192   8.790  -2.856
   35   1HG   PRO   5          1HG       PRO   5 -23.949  10.477  -4.618
   36   2HG   PRO   5          2HG       PRO   5 -24.339   9.657  -3.067
   37   1HD   PRO   5          1HD       PRO   5 -23.692  12.390  -3.418
   38   2HD   PRO   5          2HD       PRO   5 -23.709  11.495  -1.864
   39    H    VAL   6           H        VAL   6 -18.878  11.475  -3.996
   40    HA   VAL   6           HA       VAL   6 -18.893  11.222  -6.882
   41    HB   VAL   6           HB       VAL   6 -20.097  13.388  -6.436
   42   1HG1  VAL   6          1HG1      VAL   6 -18.763  15.373  -5.744
   43   2HG1  VAL   6          2HG1      VAL   6 -19.001  14.199  -4.437
   44   3HG1  VAL   6          3HG1      VAL   6 -17.434  14.306  -5.265
   45   1HG2  VAL   6          1HG2      VAL   6 -19.238  14.442  -8.248
   46   2HG2  VAL   6          2HG2      VAL   6 -17.546  14.139  -7.815
   47   3HG2  VAL   6          3HG2      VAL   6 -18.560  12.827  -8.484
   48    H    TYR   7           H        TYR   7 -16.666  12.053  -7.689
   49    HA   TYR   7           HA       TYR   7 -14.458  10.844  -6.701
   50   1HB   TYR   7          1HB       TYR   7 -14.969  13.203  -8.416
   51   2HB   TYR   7          2HB       TYR   7 -13.379  13.172  -7.702
   52    HD1  TYR   7           1HD      TYR   7 -15.179  12.099 -10.522
   53    HD2  TYR   7           2HD      TYR   7 -12.090  10.867  -7.778
   54    HE1  TYR   7           1HE      TYR   7 -14.249  10.548 -12.242
   55    HE2  TYR   7           2HE      TYR   7 -11.182   9.309  -9.490
   56    HH   TYR   7           HH       TYR   7 -11.157   9.062 -11.933
   57    HA   PRO   8           HA       PRO   8 -14.066  13.288  -2.859
   58   1HB   PRO   8          1HB       PRO   8 -13.008  11.312  -1.252
   59   2HB   PRO   8          2HB       PRO   8 -14.751  11.525  -1.575
   60   1HG   PRO   8          1HG       PRO   8 -12.893   9.451  -2.648
   61   2HG   PRO   8          2HG       PRO   8 -14.663   9.399  -2.430
   62   1HD   PRO   8          1HD       PRO   8 -13.212   9.909  -4.845
   63   2HD   PRO   8          2HD       PRO   8 -14.967   9.965  -4.603
   64    H    GLY   9           H        GLY   9 -11.814  11.878  -4.894
   65   1HA   GLY   9          1HA       GLY   9  -9.417  13.077  -3.578
   66   2HA   GLY   9          2HA       GLY   9  -9.392  11.922  -4.924
   67    H    ASP  10           H        ASP  10  -9.137  12.752  -6.892
   68    HA   ASP  10           HA       ASP  10  -8.822  14.164  -8.616
   69   1HB   ASP  10          1HB       ASP  10 -11.419  14.355  -8.096
   70   2HB   ASP  10          2HB       ASP  10 -11.022  16.016  -7.706
   71    H    ASN  11           H        ASN  11  -6.790  14.995  -8.264
   72    HA   ASN  11           HA       ASN  11  -5.086  16.336  -7.568
   73   1HB   ASN  11          1HB       ASN  11  -7.298  18.261  -8.130
   74   2HB   ASN  11          2HB       ASN  11  -5.996  18.867  -7.132
   75   1HD2  ASN  11          1HD2      ASN  11  -5.627  20.345  -8.827
   76   2HD2  ASN  11          2HD2      ASN  11  -4.774  19.791 -10.285
   77    H    ALA  12           H        ALA  12  -4.440  15.457  -5.658
   78    HA   ALA  12           HA       ALA  12  -5.561  16.671  -3.173
   79   1HB   ALA  12          1HB       ALA  12  -5.025  13.879  -3.879
   80   2HB   ALA  12          2HB       ALA  12  -4.235  14.373  -2.367
   81   3HB   ALA  12          3HB       ALA  12  -5.982  14.576  -2.571
   82    H    THR  13           H        THR  13  -3.894  16.432  -1.367
   83    HA   THR  13           HA       THR  13  -1.813  18.334  -2.038
   84    HB   THR  13           HB       THR  13  -1.535  18.645   0.247
   85    HG1  THR  13           1HG      THR  13  -2.692  16.167   0.866
   86   1HG2  THR  13          1HG2      THR  13  -3.637  18.904   1.231
   87   2HG2  THR  13          2HG2      THR  13  -4.019  18.927  -0.498
   88   3HG2  THR  13          3HG2      THR  13  -4.315  17.463   0.457
   89    HA   PRO  14           HA       PRO  14   1.583  15.533  -2.529
   90   1HB   PRO  14          1HB       PRO  14   3.719  16.844  -1.330
   91   2HB   PRO  14          2HB       PRO  14   3.047  17.204  -2.945
   92   1HG   PRO  14          1HG       PRO  14   2.717  18.726  -0.402
   93   2HG   PRO  14          2HG       PRO  14   2.633  19.299  -2.090
   94   1HD   PRO  14          1HD       PRO  14   0.473  18.724  -0.356
   95   2HD   PRO  14          2HD       PRO  14   0.355  19.045  -2.109
   96    H    GLU  15           H        GLU  15   0.399  16.231   0.602
   97    HA   GLU  15           HA       GLU  15   1.986  14.055   1.854
   98   1HB   GLU  15          1HB       GLU  15   1.288  16.653   2.746
   99   2HB   GLU  15          2HB       GLU  15   0.095  15.636   3.524
  100   1HG   GLU  15          1HG       GLU  15   1.818  15.777   5.084
  101   2HG   GLU  15          2HG       GLU  15   2.076  14.199   4.344
  102    H    GLN  16           H        GLN  16  -1.022  14.598   0.420
  103    HA   GLN  16           HA       GLN  16  -2.286  12.306   1.875
  104   1HB   GLN  16          1HB       GLN  16  -3.431  14.574   1.812
  105   2HB   GLN  16          2HB       GLN  16  -3.701  14.307   0.092
  106   1HG   GLN  16          1HG       GLN  16  -5.532  13.071   0.553
  107   2HG   GLN  16          2HG       GLN  16  -4.572  11.938   1.490
  108   1HE2  GLN  16          1HE2      GLN  16  -5.818  11.561   3.356
  109   2HE2  GLN  16          2HE2      GLN  16  -6.445  12.888   4.319
  110    H    MET  17           H        MET  17  -1.184  13.414  -1.336
  111    HA   MET  17           HA       MET  17  -2.278  11.220  -2.855
  112   1HB   MET  17          1HB       MET  17  -0.326  13.504  -3.232
  113   2HB   MET  17          2HB       MET  17  -0.267  12.175  -4.353
  114   1HG   MET  17          1HG       MET  17  -2.986  13.179  -3.745
  115   2HG   MET  17          2HG       MET  17  -1.952  14.298  -4.627
  116   1HE   MET  17          1HE       MET  17  -2.038  13.250  -8.104
  117   2HE   MET  17          2HE       MET  17  -3.221  14.247  -7.226
  118    H    ALA  18           H        ALA  18   0.889  11.916  -1.218
  119    HA   ALA  18           HA       ALA  18   2.137   9.556  -2.259
  120   1HB   ALA  18          1HB       ALA  18   3.155  11.709  -1.133
  121   2HB   ALA  18          2HB       ALA  18   2.869  10.844   0.391
  122   3HB   ALA  18          3HB       ALA  18   3.924  10.138  -0.849
  123    H    ARG  19           H        ARG  19  -0.015  10.176   0.361
  124    HA   ARG  19           HA       ARG  19   0.349   7.561   1.651
  125   1HB   ARG  19          1HB       ARG  19  -0.620  10.056   2.476
  126   2HB   ARG  19          2HB       ARG  19  -2.096   9.107   2.363
  127   1HG   ARG  19          1HG       ARG  19  -1.524   7.740   4.109
  128   2HG   ARG  19          2HG       ARG  19   0.205   7.763   3.757
  129   1HD   ARG  19          1HD       ARG  19   0.617   9.726   4.908
  130   2HD   ARG  19          2HD       ARG  19  -1.021  10.334   4.696
  131    HE   ARG  19           HE       ARG  19  -1.664   9.374   6.631
  132   1HH1  ARG  19          2HH2      ARG  19   1.297   7.759   5.774
  133   2HH1  ARG  19          1HH2      ARG  19   1.298   6.724   7.184
  134   1HH2  ARG  19          2HH1      ARG  19  -1.676   8.057   8.421
  135   2HH2  ARG  19          1HH1      ARG  19  -0.339   6.977   8.710
  136    H    TYR  20           H        TYR  20  -1.936   9.010  -0.602
  137    HA   TYR  20           HA       TYR  20  -3.833   6.894  -0.769
  138   1HB   TYR  20          1HB       TYR  20  -4.232   9.136  -1.639
  139   2HB   TYR  20          2HB       TYR  20  -2.903   8.998  -2.767
  140    HD1  TYR  20           1HD      TYR  20  -6.124   7.275  -1.884
  141    HD2  TYR  20           2HD      TYR  20  -3.304   8.341  -4.978
  142    HE1  TYR  20           1HE      TYR  20  -7.621   6.276  -3.616
  143    HE2  TYR  20           2HE      TYR  20  -4.799   7.328  -6.691
  144    HH   TYR  20           HH       TYR  20  -6.561   5.597  -6.766
  145    H    TYR  21           H        TYR  21  -1.118   7.629  -2.983
  146    HA   TYR  21           HA       TYR  21  -1.307   5.318  -4.614
  147   1HB   TYR  21          1HB       TYR  21   0.082   7.230  -5.169
  148   2HB   TYR  21          2HB       TYR  21   1.119   6.949  -3.777
  149    HD1  TYR  21           1HD      TYR  21   2.547   4.830  -3.674
  150    HD2  TYR  21           2HD      TYR  21   0.526   6.121  -7.268
  151    HE1  TYR  21           1HE      TYR  21   3.906   3.243  -5.013
  152    HE2  TYR  21           2HE      TYR  21   1.932   4.572  -8.604
  153    HH   TYR  21           HH       TYR  21   3.474   2.851  -8.498
  154    H    SER  22           H        SER  22   0.623   5.740  -1.635
  155    HA   SER  22           HA       SER  22   1.744   3.110  -1.519
  156   1HB   SER  22          1HB       SER  22   2.588   4.970  -0.179
  157   2HB   SER  22          2HB       SER  22   1.039   5.098   0.676
  158    HG   SER  22           HG       SER  22   2.653   3.910   1.821
  159    H    ALA  23           H        ALA  23  -1.349   4.414  -0.238
  160    HA   ALA  23           HA       ALA  23  -2.218   2.000   0.983
  161   1HB   ALA  23          1HB       ALA  23  -3.268   4.382   1.156
  162   2HB   ALA  23          2HB       ALA  23  -4.119   3.951  -0.346
  163   3HB   ALA  23          3HB       ALA  23  -4.348   2.985   1.104
  164    H    LEU  24           H        LEU  24  -2.418   3.114  -2.438
  165    HA   LEU  24           HA       LEU  24  -4.057   0.952  -3.307
  166   1HB   LEU  24          1HB       LEU  24  -2.908   3.168  -4.552
  167   2HB   LEU  24          2HB       LEU  24  -1.941   1.866  -5.197
  168    HG   LEU  24           HG       LEU  24  -4.798   2.587  -5.642
  169   1HD1  LEU  24          1HD1      LEU  24  -2.442   2.397  -7.237
  170   2HD1  LEU  24          2HD1      LEU  24  -3.532   1.147  -7.832
  171   3HD1  LEU  24          3HD1      LEU  24  -4.074   2.833  -7.739
  172   1HD2  LEU  24          1HD2      LEU  24  -3.973  -0.283  -5.490
  173   2HD2  LEU  24          2HD2      LEU  24  -5.467   0.490  -4.941
  174   3HD2  LEU  24          3HD2      LEU  24  -5.200   0.222  -6.666
  175    H    ARG  25           H        ARG  25  -0.449   1.263  -3.322
  176    HA   ARG  25           HA       ARG  25   0.069  -1.339  -4.287
  177   1HB   ARG  25          1HB       ARG  25   1.628   0.824  -3.141
  178   2HB   ARG  25          2HB       ARG  25   2.070  -0.642  -2.296
  179   1HG   ARG  25          1HG       ARG  25   2.232  -0.092  -5.271
  180   2HG   ARG  25          2HG       ARG  25   3.567  -0.370  -4.160
  181   1HD   ARG  25          1HD       ARG  25   1.798  -2.689  -4.096
  182   2HD   ARG  25          2HD       ARG  25   2.109  -2.239  -5.777
  183    HE   ARG  25           HE       ARG  25   4.505  -2.374  -4.115
  184   1HH1  ARG  25          2HH2      ARG  25   2.292  -4.306  -5.984
  185   2HH1  ARG  25          1HH2      ARG  25   3.450  -5.555  -6.341
  186   1HH2  ARG  25          2HH1      ARG  25   6.011  -4.008  -4.561
  187   2HH2  ARG  25          1HH1      ARG  25   5.550  -5.342  -5.569
  188    H    ARG  26           H        ARG  26  -0.471  -0.264  -0.951
  189    HA   ARG  26           HA       ARG  26  -0.089  -2.880   0.208
  190   1HB   ARG  26          1HB       ARG  26   0.027  -0.537   1.320
  191   2HB   ARG  26          2HB       ARG  26  -1.742  -0.638   1.428
  192   1HG   ARG  26          1HG       ARG  26  -1.586  -2.706   2.725
  193   2HG   ARG  26          2HG       ARG  26   0.169  -2.779   2.498
  194   1HD   ARG  26          1HD       ARG  26   0.612  -1.231   4.079
  195   2HD   ARG  26          2HD       ARG  26  -0.748  -0.198   3.610
  196    HE   ARG  26           HE       ARG  26  -1.787  -2.515   4.872
  197   1HH1  ARG  26          2HH2      ARG  26   0.026   0.343   5.748
  198   2HH1  ARG  26          1HH2      ARG  26  -0.589   0.378   7.383
  199   1HH2  ARG  26          2HH1      ARG  26  -2.649  -2.363   6.973
  200   2HH2  ARG  26          1HH1      ARG  26  -2.081  -1.113   8.038
  201    H    TYR  27           H        TYR  27  -3.087  -1.057  -0.557
  202    HA   TYR  27           HA       TYR  27  -5.009  -2.962   0.169
  203   1HB   TYR  27          1HB       TYR  27  -5.501  -0.615  -0.434
  204   2HB   TYR  27          2HB       TYR  27  -4.981  -0.907  -2.091
  205    HD1  TYR  27           1HD      TYR  27  -7.645  -1.523   0.405
  206    HD2  TYR  27           2HD      TYR  27  -6.432  -1.991  -3.706
  207    HE1  TYR  27           1HE      TYR  27  -9.964  -2.192  -0.197
  208    HE2  TYR  27           2HE      TYR  27  -8.755  -2.653  -4.318
  209    HH   TYR  27           HH       TYR  27 -11.246  -3.209  -1.850
  210    H    ILE  28           H        ILE  28  -3.045  -2.796  -2.797
  211    HA   ILE  28           HA       ILE  28  -4.362  -5.093  -4.013
  212    HB   ILE  28           HB       ILE  28  -1.756  -3.676  -4.571
  213   2HG1  ILE  28          2HG1      ILE  28  -4.059  -2.512  -4.942
  214   1HG2  ILE  28          1HG2      ILE  28  -1.667  -4.925  -6.690
  215   2HG2  ILE  28          2HG2      ILE  28  -1.668  -6.073  -5.371
  216   3HG2  ILE  28          3HG2      ILE  28  -3.162  -5.781  -6.286
  217   1HD1  ILE  28          1HD1      ILE  28  -2.257  -2.930  -7.364
  218   2HD1  ILE  28          2HD1      ILE  28  -3.531  -1.721  -7.226
  219   3HD1  ILE  28          3HD1      ILE  28  -2.128  -1.652  -6.137
  220    H    ASN  29           H        ASN  29  -1.357  -4.680  -2.075
  221    HA   ASN  29           HA       ASN  29  -0.544  -7.421  -2.155
  222   1HB   ASN  29          1HB       ASN  29   0.529  -5.040  -1.197
  223   2HB   ASN  29          2HB       ASN  29   0.106  -5.849   0.299
  224   1HD2  ASN  29          1HD2      ASN  29   2.268  -6.257   0.971
  225   2HD2  ASN  29          2HD2      ASN  29   3.308  -7.305   0.033
  226    H    MET  30           H        MET  30  -2.898  -5.748  -0.118
  227    HA   MET  30           HA       MET  30  -3.304  -8.109   1.605
  228   1HB   MET  30          1HB       MET  30  -4.895  -6.629   2.783
  229   2HB   MET  30          2HB       MET  30  -3.256  -5.971   2.696
  230   1HG   MET  30          1HG       MET  30  -3.984  -4.141   1.735
  231   2HG   MET  30          2HG       MET  30  -4.875  -5.050   0.524
  232   1HE   MET  30          1HE       MET  30  -6.993  -6.118   0.840
  233   2HE   MET  30          2HE       MET  30  -7.682  -6.281   2.472
  234    H    LEU  31           H        LEU  31  -4.921  -6.521  -1.159
  235    HA   LEU  31           HA       LEU  31  -7.482  -7.633  -0.971
  236   1HB   LEU  31          1HB       LEU  31  -7.416  -6.119  -2.669
  237   2HB   LEU  31          2HB       LEU  31  -5.739  -6.478  -3.059
  238    HG   LEU  31           HG       LEU  31  -6.222  -8.251  -4.431
  239   1HD1  LEU  31          1HD1      LEU  31  -8.800  -8.434  -3.130
  240   2HD1  LEU  31          2HD1      LEU  31  -9.050  -8.239  -4.867
  241   3HD1  LEU  31          3HD1      LEU  31  -8.032  -9.553  -4.266
  242   1HD2  LEU  31          1HD2      LEU  31  -7.288  -7.159  -6.263
  243   2HD2  LEU  31          2HD2      LEU  31  -8.096  -6.005  -5.167
  244   3HD2  LEU  31          3HD2      LEU  31  -6.324  -5.979  -5.361
  245    H    THR  32           H        THR  32  -4.677  -8.856  -2.695
  246    HA   THR  32           HA       THR  32  -5.946 -11.401  -3.366
  247    HB   THR  32           HB       THR  32  -3.715 -12.068  -4.167
  248    HG1  THR  32           1HG      THR  32  -2.109 -10.290  -3.996
  249   1HG2  THR  32          1HG2      THR  32  -4.099  -9.156  -4.962
  250   2HG2  THR  32          2HG2      THR  32  -3.523 -10.512  -5.952
  251   3HG2  THR  32          3HG2      THR  32  -5.228 -10.426  -5.484
  252    H    ARG  33           H        ARG  33  -4.459 -10.186  -0.644
  253    HA   ARG  33           HA       ARG  33  -3.896 -10.822   1.407
  254   1HB   ARG  33          1HB       ARG  33  -6.056 -11.887   1.486
  255   2HB   ARG  33          2HB       ARG  33  -5.463 -13.307   0.627
  256   1HG   ARG  33          1HG       ARG  33  -3.878 -13.677   2.618
  257   2HG   ARG  33          2HG       ARG  33  -4.874 -12.484   3.472
  258   1HD   ARG  33          1HD       ARG  33  -6.823 -13.944   3.240
  259   2HD   ARG  33          2HD       ARG  33  -5.955 -14.988   2.111
  260    HE   ARG  33           HE       ARG  33  -4.919 -16.065   3.837
  261   1HH1  ARG  33          2HH2      ARG  33  -6.162 -13.101   5.163
  262   2HH1  ARG  33          1HH2      ARG  33  -5.627 -13.444   6.790
  263   1HH2  ARG  33          2HH1      ARG  33  -4.240 -16.511   5.928
  264   2HH2  ARG  33          1HH1      ARG  33  -4.618 -15.396   7.205
  265    HA   PRO  34           HA       PRO  34  -0.144 -13.276   0.804
  266   1HB   PRO  34          1HB       PRO  34   0.898 -13.278   3.332
  267   2HB   PRO  34          2HB       PRO  34   0.938 -11.876   2.239
  268   1HG   PRO  34          1HG       PRO  34  -0.881 -12.354   4.578
  269   2HG   PRO  34          2HG       PRO  34  -0.176 -10.826   3.987
  270   1HD   PRO  34          1HD       PRO  34  -2.769 -11.787   3.478
  271   2HD   PRO  34          2HD       PRO  34  -1.966 -10.468   2.583
  272    H    ARG  35           H        ARG  35  -2.252 -14.740   0.498
  273    HA   ARG  35           HA       ARG  35  -2.530 -16.977   2.370
  274   1HB   ARG  35          1HB       ARG  35  -4.341 -16.326   0.832
  275   2HB   ARG  35          2HB       ARG  35  -3.334 -16.665  -0.573
  276   1HG   ARG  35          1HG       ARG  35  -3.773 -18.873   1.435
  277   2HG   ARG  35          2HG       ARG  35  -5.136 -18.409   0.427
  278   1HD   ARG  35          1HD       ARG  35  -3.976 -18.903  -1.604
  279   2HD   ARG  35          2HD       ARG  35  -2.439 -19.145  -0.793
  280    HE   ARG  35           HE       ARG  35  -4.574 -21.055  -1.101
  281   1HH1  ARG  35          2HH2      ARG  35  -1.898 -20.288   1.098
  282   2HH1  ARG  35          1HH2      ARG  35  -1.839 -21.907   1.723
  283   1HH2  ARG  35          2HH1      ARG  35  -4.439 -23.122  -0.215
  284   2HH2  ARG  35          1HH1      ARG  35  -3.217 -23.450   0.985
  285    H    TYR  36           H        TYR  36  -0.229 -16.074   0.017
  286    HA   TYR  36           HA       TYR  36   0.836 -18.771  -0.496
  287   1HB   TYR  36          1HB       TYR  36   1.347 -15.960  -1.468
  288   2HB   TYR  36          2HB       TYR  36   2.656 -17.117  -1.571
  289    HD1  TYR  36           1HD      TYR  36  -0.955 -16.675  -2.565
  290    HD2  TYR  36           2HD      TYR  36   2.810 -18.646  -3.332
  291    HE1  TYR  36           1HE      TYR  36  -1.895 -17.665  -4.639
  292    HE2  TYR  36           2HE      TYR  36   1.860 -19.635  -5.411
  293    HH   TYR  36           HH       TYR  36  -1.445 -18.937  -6.522
  294   1HN   NH2  37          1HN       NH2  37   3.110 -19.370   0.036
  295   2HN   NH2  37          2HN       NH2  37   3.785 -18.646   1.490
  Start of MODEL   19
    1   1H    ALA   1          1H        ALA   1 -23.199   1.675  -2.463
    2   2H    ALA   1          2H        ALA   1 -23.356   2.362  -0.972
    3   3H    ALA   1          3H        ALA   1 -24.612   1.535  -1.640
    4    HA   ALA   1           HA       ALA   1 -23.790   3.534  -3.388
    5   1HB   ALA   1          1HB       ALA   1 -25.904   2.894  -3.854
    6   2HB   ALA   1          2HB       ALA   1 -26.359   2.631  -2.161
    7   3HB   ALA   1          3HB       ALA   1 -26.295   4.281  -2.815
    8    HA   PRO   2           HA       PRO   2 -24.199   6.911  -0.148
    9   1HB   PRO   2          1HB       PRO   2 -24.798   6.427   2.491
   10   2HB   PRO   2          2HB       PRO   2 -26.024   6.682   1.222
   11   1HG   PRO   2          1HG       PRO   2 -25.154   4.116   2.509
   12   2HG   PRO   2          2HG       PRO   2 -26.757   4.581   1.870
   13   1HD   PRO   2          1HD       PRO   2 -24.814   2.986   0.577
   14   2HD   PRO   2          2HD       PRO   2 -26.258   3.731  -0.185
   15    H    LEU   3           H        LEU   3 -22.423   4.114   0.285
   16    HA   LEU   3           HA       LEU   3 -20.456   5.070   2.209
   17   1HB   LEU   3          1HB       LEU   3 -21.207   2.549   1.327
   18   2HB   LEU   3          2HB       LEU   3 -19.836   2.871   0.269
   19    HG   LEU   3           HG       LEU   3 -18.488   3.417   2.337
   20   1HD1  LEU   3          1HD1      LEU   3 -21.061   3.277   3.626
   21   2HD1  LEU   3          2HD1      LEU   3 -20.084   1.959   4.279
   22   3HD1  LEU   3          3HD1      LEU   3 -19.477   3.617   4.351
   23   1HD2  LEU   3          1HD2      LEU   3 -18.739   1.070   1.127
   24   2HD2  LEU   3          2HD2      LEU   3 -17.839   1.237   2.638
   25   3HD2  LEU   3          3HD2      LEU   3 -19.485   0.582   2.654
   26    H    GLU   4           H        GLU   4 -18.358   5.707   1.652
   27    HA   GLU   4           HA       GLU   4 -16.711   6.795   0.559
   28   1HB   GLU   4          1HB       GLU   4 -17.144   4.916  -1.211
   29   2HB   GLU   4          2HB       GLU   4 -17.801   6.232  -2.183
   30   1HG   GLU   4          1HG       GLU   4 -15.485   7.408  -1.396
   31   2HG   GLU   4          2HG       GLU   4 -15.001   5.729  -1.210
   32    HA   PRO   5           HA       PRO   5 -19.508  10.433   0.172
   33   1HB   PRO   5          1HB       PRO   5 -18.218  12.072   1.979
   34   2HB   PRO   5          2HB       PRO   5 -19.508  10.910   2.387
   35   1HG   PRO   5          1HG       PRO   5 -16.555  10.664   2.825
   36   2HG   PRO   5          2HG       PRO   5 -17.904   9.968   3.768
   37   1HD   PRO   5          1HD       PRO   5 -16.313   8.635   1.842
   38   2HD   PRO   5          2HD       PRO   5 -17.865   8.046   2.514
   39    H    VAL   6           H        VAL   6 -19.069  11.193  -1.775
   40    HA   VAL   6           HA       VAL   6 -16.422  12.028  -2.639
   41    HB   VAL   6           HB       VAL   6 -17.338  12.380  -4.784
   42   1HG1  VAL   6          1HG1      VAL   6 -18.420  10.223  -5.279
   43   2HG1  VAL   6          2HG1      VAL   6 -17.050  10.029  -4.169
   44   3HG1  VAL   6          3HG1      VAL   6 -18.713   9.949  -3.557
   45   1HG2  VAL   6          1HG2      VAL   6 -19.861  12.054  -5.215
   46   2HG2  VAL   6          2HG2      VAL   6 -20.076  12.409  -3.488
   47   3HG2  VAL   6          3HG2      VAL   6 -19.329  13.607  -4.568
   48    H    TYR   7           H        TYR   7 -15.554  13.998  -2.413
   49    HA   TYR   7           HA       TYR   7 -17.317  16.250  -1.582
   50   1HB   TYR   7          1HB       TYR   7 -15.010  15.098  -0.350
   51   2HB   TYR   7          2HB       TYR   7 -14.499  16.646  -0.989
   52    HD1  TYR   7           1HD      TYR   7 -17.419  15.141   0.874
   53    HD2  TYR   7           2HD      TYR   7 -14.747  18.503   0.437
   54    HE1  TYR   7           1HE      TYR   7 -18.483  16.247   2.837
   55    HE2  TYR   7           2HE      TYR   7 -15.830  19.617   2.375
   56    HH   TYR   7           HH       TYR   7 -17.186  19.152   4.278
   57    HA   PRO   8           HA       PRO   8 -15.789  18.450  -5.196
   58   1HB   PRO   8          1HB       PRO   8 -16.298  21.056  -4.532
   59   2HB   PRO   8          2HB       PRO   8 -17.574  19.870  -4.904
   60   1HG   PRO   8          1HG       PRO   8 -16.668  20.860  -2.207
   61   2HG   PRO   8          2HG       PRO   8 -18.319  20.461  -2.772
   62   1HD   PRO   8          1HD       PRO   8 -16.628  18.799  -1.269
   63   2HD   PRO   8          2HD       PRO   8 -18.063  18.255  -2.181
   64    H    GLY   9           H        GLY   9 -13.812  17.444  -4.138
   65   1HA   GLY   9          1HA       GLY   9 -11.578  19.225  -4.453
   66   2HA   GLY   9          2HA       GLY   9 -11.714  18.651  -2.773
   67    H    ASP  10           H        ASP  10 -11.116  16.601  -2.318
   68    HA   ASP  10           HA       ASP  10  -9.904  14.710  -2.430
   69   1HB   ASP  10          1HB       ASP  10 -11.813  13.822  -3.772
   70   2HB   ASP  10          2HB       ASP  10 -10.957  14.281  -5.245
   71    H    ASN  11           H        ASN  11  -7.920  13.739  -3.489
   72    HA   ASN  11           HA       ASN  11  -5.710  14.119  -3.996
   73   1HB   ASN  11          1HB       ASN  11  -6.758  13.487  -6.103
   74   2HB   ASN  11          2HB       ASN  11  -7.121  15.188  -6.451
   75   1HD2  ASN  11          1HD2      ASN  11  -5.882  14.632  -8.489
   76   2HD2  ASN  11          2HD2      ASN  11  -4.120  14.817  -8.354
   77    H    ALA  12           H        ALA  12  -5.009  15.605  -2.427
   78    HA   ALA  12           HA       ALA  12  -4.063  18.118  -3.553
   79   1HB   ALA  12          1HB       ALA  12  -4.951  19.488  -1.736
   80   2HB   ALA  12          2HB       ALA  12  -6.325  18.623  -2.462
   81   3HB   ALA  12          3HB       ALA  12  -5.628  18.059  -0.925
   82    H    THR  13           H        THR  13  -2.319  18.916  -2.250
   83    HA   THR  13           HA       THR  13  -0.342  18.777  -1.283
   84    HB   THR  13           HB       THR  13  -1.679  19.172   0.663
   85    HG1  THR  13           1HG      THR  13   0.190  19.204   1.464
   86   1HG2  THR  13          1HG2      THR  13  -1.625  16.178   1.033
   87   2HG2  THR  13          2HG2      THR  13  -1.870  17.270   2.391
   88   3HG2  THR  13          3HG2      THR  13  -3.049  17.236   1.071
   89    HA   PRO  14           HA       PRO  14   1.611  14.990  -2.372
   90   1HB   PRO  14          1HB       PRO  14   4.155  15.329  -1.322
   91   2HB   PRO  14          2HB       PRO  14   3.560  15.995  -2.870
   92   1HG   PRO  14          1HG       PRO  14   4.020  17.410  -0.296
   93   2HG   PRO  14          2HG       PRO  14   4.024  18.056  -1.961
   94   1HD   PRO  14          1HD       PRO  14   1.990  18.210  -0.024
   95   2HD   PRO  14          2HD       PRO  14   1.801  18.690  -1.719
   96    H    GLU  15           H        GLU  15   1.269  16.016   0.947
   97    HA   GLU  15           HA       GLU  15   2.170  13.490   2.106
   98   1HB   GLU  15          1HB       GLU  15   2.377  15.729   3.260
   99   2HB   GLU  15          2HB       GLU  15   0.616  15.787   3.412
  100   1HG   GLU  15          1HG       GLU  15   0.565  14.133   5.046
  101   2HG   GLU  15          2HG       GLU  15   2.023  13.338   4.471
  102    H    GLN  16           H        GLN  16  -0.696  14.456   0.601
  103    HA   GLN  16           HA       GLN  16  -2.194  12.173   1.835
  104   1HB   GLN  16          1HB       GLN  16  -3.151  14.703   1.422
  105   2HB   GLN  16          2HB       GLN  16  -3.530  13.970  -0.131
  106   1HG   GLN  16          1HG       GLN  16  -5.438  13.469   0.961
  107   2HG   GLN  16          2HG       GLN  16  -4.516  12.029   1.418
  108   1HE2  GLN  16          1HE2      GLN  16  -6.708  12.725   2.963
  109   2HE2  GLN  16          2HE2      GLN  16  -6.112  13.449   4.463
  110    H    MET  17           H        MET  17  -0.917  13.512  -1.239
  111    HA   MET  17           HA       MET  17  -2.024  11.442  -2.932
  112   1HB   MET  17          1HB       MET  17  -0.245  13.814  -3.161
  113   2HB   MET  17          2HB       MET  17   0.213  12.505  -4.221
  114   1HG   MET  17          1HG       MET  17  -2.707  13.236  -4.069
  115   2HG   MET  17          2HG       MET  17  -1.629  14.349  -4.884
  116   1HE   MET  17          1HE       MET  17  -0.689  14.240  -6.971
  117   2HE   MET  17          2HE       MET  17   0.392  12.842  -6.804
  118    H    ALA  18           H        ALA  18   1.209  11.854  -1.287
  119    HA   ALA  18           HA       ALA  18   2.237   9.397  -2.385
  120   1HB   ALA  18          1HB       ALA  18   3.685  11.161  -1.497
  121   2HB   ALA  18          2HB       ALA  18   2.961  10.988   0.118
  122   3HB   ALA  18          3HB       ALA  18   3.928   9.665  -0.569
  123    H    ARG  19           H        ARG  19   0.037  10.117   0.182
  124    HA   ARG  19           HA       ARG  19   0.388   7.517   1.500
  125   1HB   ARG  19          1HB       ARG  19  -0.527   9.971   2.383
  126   2HB   ARG  19          2HB       ARG  19  -2.047   9.119   2.195
  127   1HG   ARG  19          1HG       ARG  19  -1.642   7.800   4.019
  128   2HG   ARG  19          2HG       ARG  19  -0.005   7.422   3.521
  129   1HD   ARG  19          1HD       ARG  19   0.373   8.571   5.497
  130   2HD   ARG  19          2HD       ARG  19   0.660   9.798   4.273
  131    HE   ARG  19           HE       ARG  19  -1.173  10.983   5.019
  132   1HH1  ARG  19          2HH2      ARG  19  -1.378   7.770   6.367
  133   2HH1  ARG  19          1HH2      ARG  19  -2.750   8.127   7.388
  134   1HH2  ARG  19          2HH1      ARG  19  -2.898  11.462   6.428
  135   2HH2  ARG  19          1HH1      ARG  19  -3.578  10.198   7.414
  136    H    TYR  20           H        TYR  20  -2.135   9.021  -0.532
  137    HA   TYR  20           HA       TYR  20  -3.971   6.894  -0.706
  138   1HB   TYR  20          1HB       TYR  20  -3.164   9.298  -2.328
  139   2HB   TYR  20          2HB       TYR  20  -4.064   8.070  -3.146
  140    HD1  TYR  20           1HD      TYR  20  -4.372   9.538   0.342
  141    HD2  TYR  20           2HD      TYR  20  -6.256   8.746  -3.458
  142    HE1  TYR  20           1HE      TYR  20  -6.474  10.592   1.151
  143    HE2  TYR  20           2HE      TYR  20  -8.347   9.832  -2.647
  144    HH   TYR  20           HH       TYR  20  -9.205  11.204  -1.046
  145    H    TYR  21           H        TYR  21  -1.123   7.624  -2.803
  146    HA   TYR  21           HA       TYR  21  -1.377   5.335  -4.464
  147   1HB   TYR  21          1HB       TYR  21   0.063   7.504  -4.645
  148   2HB   TYR  21          2HB       TYR  21   1.270   6.622  -3.742
  149    HD1  TYR  21           1HD      TYR  21   1.688   4.075  -4.781
  150    HD2  TYR  21           2HD      TYR  21   0.223   7.506  -6.940
  151    HE1  TYR  21           1HE      TYR  21   2.422   3.055  -6.915
  152    HE2  TYR  21           2HE      TYR  21   1.007   6.494  -9.072
  153    HH   TYR  21           HH       TYR  21   2.737   4.790  -9.783
  154    H    SER  22           H        SER  22   0.520   5.788  -1.456
  155    HA   SER  22           HA       SER  22   1.693   3.163  -1.377
  156   1HB   SER  22          1HB       SER  22   2.457   5.073  -0.008
  157   2HB   SER  22          2HB       SER  22   0.942   5.035   0.911
  158    HG   SER  22           HG       SER  22   2.752   3.907   1.880
  159    H    ALA  23           H        ALA  23  -1.412   4.428  -0.104
  160    HA   ALA  23           HA       ALA  23  -2.328   1.998   1.044
  161   1HB   ALA  23          1HB       ALA  23  -3.319   4.457   1.163
  162   2HB   ALA  23          2HB       ALA  23  -4.230   3.933  -0.268
  163   3HB   ALA  23          3HB       ALA  23  -4.397   3.053   1.249
  164    H    LEU  24           H        LEU  24  -2.533   3.189  -2.354
  165    HA   LEU  24           HA       LEU  24  -4.097   1.013  -3.329
  166   1HB   LEU  24          1HB       LEU  24  -2.459   3.155  -4.503
  167   2HB   LEU  24          2HB       LEU  24  -2.279   1.660  -5.408
  168    HG   LEU  24           HG       LEU  24  -4.922   3.000  -4.756
  169   1HD1  LEU  24          1HD1      LEU  24  -4.939   3.662  -7.097
  170   2HD1  LEU  24          2HD1      LEU  24  -3.433   4.239  -6.369
  171   3HD1  LEU  24          3HD1      LEU  24  -3.420   2.798  -7.406
  172   1HD2  LEU  24          1HD2      LEU  24  -5.265   0.581  -5.070
  173   2HD2  LEU  24          2HD2      LEU  24  -5.835   1.447  -6.502
  174   3HD2  LEU  24          3HD2      LEU  24  -4.266   0.618  -6.533
  175    H    ARG  25           H        ARG  25  -0.515   1.322  -3.168
  176    HA   ARG  25           HA       ARG  25   0.018  -1.301  -4.164
  177   1HB   ARG  25          1HB       ARG  25   1.640   0.775  -3.419
  178   2HB   ARG  25          2HB       ARG  25   1.816  -0.229  -1.987
  179   1HG   ARG  25          1HG       ARG  25   3.586  -0.725  -3.564
  180   2HG   ARG  25          2HG       ARG  25   2.539  -2.153  -3.451
  181   1HD   ARG  25          1HD       ARG  25   1.637  -1.826  -5.589
  182   2HD   ARG  25          2HD       ARG  25   1.921  -0.083  -5.542
  183    HE   ARG  25           HE       ARG  25   4.378  -1.648  -5.621
  184   1HH1  ARG  25          2HH2      ARG  25   1.943  -0.089  -7.579
  185   2HH1  ARG  25          1HH2      ARG  25   3.002   0.119  -8.952
  186   1HH2  ARG  25          2HH1      ARG  25   5.717  -1.402  -7.447
  187   2HH2  ARG  25          1HH1      ARG  25   5.087  -0.658  -8.873
  188    H    ARG  26           H        ARG  26  -0.500  -0.230  -0.823
  189    HA   ARG  26           HA       ARG  26  -0.214  -2.849   0.317
  190   1HB   ARG  26          1HB       ARG  26  -0.236  -0.478   1.424
  191   2HB   ARG  26          2HB       ARG  26  -1.984  -0.725   1.566
  192   1HG   ARG  26          1HG       ARG  26  -1.678  -2.727   2.901
  193   2HG   ARG  26          2HG       ARG  26   0.043  -2.807   2.517
  194   1HD   ARG  26          1HD       ARG  26  -1.274  -0.592   4.123
  195   2HD   ARG  26          2HD       ARG  26  -0.375  -1.943   4.818
  196    HE   ARG  26           HE       ARG  26   0.701   0.436   3.491
  197   1HH1  ARG  26          2HH2      ARG  26   1.521  -2.848   4.326
  198   2HH1  ARG  26          1HH2      ARG  26   3.231  -2.604   4.080
  199   1HH2  ARG  26          2HH1      ARG  26   2.895   0.726   3.196
  200   2HH2  ARG  26          1HH1      ARG  26   3.988  -0.574   3.504
  201    H    TYR  27           H        TYR  27  -3.180  -1.082  -0.647
  202    HA   TYR  27           HA       TYR  27  -5.071  -3.049   0.018
  203   1HB   TYR  27          1HB       TYR  27  -5.522  -0.680  -0.652
  204   2HB   TYR  27          2HB       TYR  27  -5.025  -1.044  -2.296
  205    HD1  TYR  27           1HD      TYR  27  -6.873  -1.030  -3.763
  206    HD2  TYR  27           2HD      TYR  27  -7.368  -2.550   0.240
  207    HE1  TYR  27           1HE      TYR  27  -9.291  -1.397  -4.200
  208    HE2  TYR  27           2HE      TYR  27  -9.769  -2.967  -0.212
  209    HH   TYR  27           HH       TYR  27 -11.360  -2.136  -3.289
  210    H    ILE  28           H        ILE  28  -3.190  -2.695  -3.035
  211    HA   ILE  28           HA       ILE  28  -4.404  -5.044  -4.218
  212    HB   ILE  28           HB       ILE  28  -1.810  -3.570  -4.816
  213   2HG1  ILE  28          2HG1      ILE  28  -4.152  -2.370  -5.061
  214   1HG2  ILE  28          1HG2      ILE  28  -3.110  -5.963  -6.097
  215   2HG2  ILE  28          2HG2      ILE  28  -2.437  -4.755  -7.187
  216   3HG2  ILE  28          3HG2      ILE  28  -1.390  -5.519  -5.976
  217   1HD1  ILE  28          1HD1      ILE  28  -2.193  -2.541  -7.382
  218   2HD1  ILE  28          2HD1      ILE  28  -3.522  -1.372  -7.250
  219   3HD1  ILE  28          3HD1      ILE  28  -2.206  -1.362  -6.057
  220    H    ASN  29           H        ASN  29  -1.595  -4.615  -2.088
  221    HA   ASN  29           HA       ASN  29  -0.661  -7.333  -2.249
  222   1HB   ASN  29          1HB       ASN  29   0.559  -5.185  -1.419
  223   2HB   ASN  29          2HB       ASN  29  -0.237  -5.486   0.128
  224   1HD2  ASN  29          1HD2      ASN  29   2.263  -5.506   0.611
  225   2HD2  ASN  29          2HD2      ASN  29   2.976  -7.125   0.473
  226    H    MET  30           H        MET  30  -2.674  -5.658   0.253
  227    HA   MET  30           HA       MET  30  -3.188  -7.998   1.812
  228   1HB   MET  30          1HB       MET  30  -4.952  -6.560   2.852
  229   2HB   MET  30          2HB       MET  30  -3.353  -5.809   2.805
  230   1HG   MET  30          1HG       MET  30  -4.230  -4.068   1.766
  231   2HG   MET  30          2HG       MET  30  -4.768  -5.111   0.472
  232   1HE   MET  30          1HE       MET  30  -5.401  -3.185   3.490
  233   2HE   MET  30          2HE       MET  30  -7.163  -3.139   3.732
  234    H    LEU  31           H        LEU  31  -5.008  -6.570  -0.995
  235    HA   LEU  31           HA       LEU  31  -7.207  -8.370  -0.814
  236   1HB   LEU  31          1HB       LEU  31  -5.835  -6.808  -3.033
  237   2HB   LEU  31          2HB       LEU  31  -7.144  -7.882  -3.407
  238    HG   LEU  31           HG       LEU  31  -7.428  -5.643  -1.366
  239   1HD1  LEU  31          1HD1      LEU  31  -8.176  -5.723  -4.325
  240   2HD1  LEU  31          2HD1      LEU  31  -8.639  -4.452  -3.177
  241   3HD1  LEU  31          3HD1      LEU  31  -6.935  -4.690  -3.579
  242   1HD2  LEU  31          1HD2      LEU  31  -9.808  -6.684  -2.811
  243   2HD2  LEU  31          2HD2      LEU  31  -9.088  -7.814  -1.655
  244   3HD2  LEU  31          3HD2      LEU  31  -9.593  -6.208  -1.116
  245    H    THR  32           H        THR  32  -3.919  -8.900  -1.710
  246    HA   THR  32           HA       THR  32  -4.541 -11.587  -2.838
  247    HB   THR  32           HB       THR  32  -1.886 -10.199  -3.205
  248    HG1  THR  32           1HG      THR  32  -3.256  -8.672  -4.056
  249   1HG2  THR  32          1HG2      THR  32  -1.773 -11.571  -5.205
  250   2HG2  THR  32          2HG2      THR  32  -2.276 -12.639  -3.891
  251   3HG2  THR  32          3HG2      THR  32  -3.476 -12.051  -5.044
  252    H    ARG  33           H        ARG  33  -4.324 -10.625   0.048
  253    HA   ARG  33           HA       ARG  33  -1.984 -11.490   1.285
  254   1HB   ARG  33          1HB       ARG  33  -3.343 -11.806   3.321
  255   2HB   ARG  33          2HB       ARG  33  -3.748 -10.317   2.502
  256   1HG   ARG  33          1HG       ARG  33  -5.849 -11.208   1.713
  257   2HG   ARG  33          2HG       ARG  33  -5.374 -12.858   2.067
  258   1HD   ARG  33          1HD       ARG  33  -5.606 -12.618   4.370
  259   2HD   ARG  33          2HD       ARG  33  -5.458 -10.856   4.313
  260    HE   ARG  33           HE       ARG  33  -7.792 -11.640   2.864
  261   1HH1  ARG  33          2HH2      ARG  33  -6.662 -11.325   6.163
  262   2HH1  ARG  33          1HH2      ARG  33  -8.252 -11.040   6.813
  263   1HH2  ARG  33          2HH1      ARG  33  -9.836 -11.300   3.715
  264   2HH2  ARG  33          1HH1      ARG  33 -10.042 -11.157   5.437
  265    HA   PRO  34           HA       PRO  34  -2.125 -15.965   1.063
  266   1HB   PRO  34          1HB       PRO  34  -0.615 -16.721   3.216
  267   2HB   PRO  34          2HB       PRO  34   0.044 -15.957   1.751
  268   1HG   PRO  34          1HG       PRO  34  -0.469 -14.707   4.433
  269   2HG   PRO  34          2HG       PRO  34   0.840 -14.381   3.256
  270   1HD   PRO  34          1HD       PRO  34  -1.524 -12.887   3.600
  271   2HD   PRO  34          2HD       PRO  34  -0.425 -12.776   2.199
  272    H    ARG  35           H        ARG  35  -4.509 -15.266   1.595
  273    HA   ARG  35           HA       ARG  35  -5.567 -16.477   4.099
  274   1HB   ARG  35          1HB       ARG  35  -6.628 -14.490   2.740
  275   2HB   ARG  35          2HB       ARG  35  -7.152 -15.717   1.617
  276   1HG   ARG  35          1HG       ARG  35  -9.026 -15.631   2.889
  277   2HG   ARG  35          2HG       ARG  35  -8.191 -16.818   3.869
  278   1HD   ARG  35          1HD       ARG  35  -7.585 -14.002   4.606
  279   2HD   ARG  35          2HD       ARG  35  -9.288 -14.415   4.720
  280    HE   ARG  35           HE       ARG  35  -8.865 -15.891   6.449
  281   1HH1  ARG  35          2HH2      ARG  35  -5.772 -14.771   5.265
  282   2HH1  ARG  35          1HH2      ARG  35  -4.897 -15.309   6.672
  283   1HH2  ARG  35          2HH1      ARG  35  -7.724 -16.538   8.255
  284   2HH2  ARG  35          1HH1      ARG  35  -6.029 -16.167   8.398
  285    H    TYR  36           H        TYR  36  -4.769 -17.509   0.926
  286    HA   TYR  36           HA       TYR  36  -6.338 -20.021   1.153
  287   1HB   TYR  36          1HB       TYR  36  -5.281 -18.340  -1.065
  288   2HB   TYR  36          2HB       TYR  36  -5.065 -20.046  -1.305
  289    HD1  TYR  36           1HD      TYR  36  -6.815 -21.376  -2.147
  290    HD2  TYR  36           2HD      TYR  36  -7.729 -17.550  -0.359
  291    HE1  TYR  36           1HE      TYR  36  -9.141 -21.554  -2.970
  292    HE2  TYR  36           2HE      TYR  36 -10.074 -17.739  -1.171
  293    HH   TYR  36           HH       TYR  36 -11.145 -20.425  -3.252
  294   1HN   NH2  37          1HN       NH2  37  -5.128 -22.090   0.360
  295   2HN   NH2  37          2HN       NH2  37  -3.489 -22.217   1.012
  Start of MODEL   20
    1   1H    ALA   1          1H        ALA   1  -9.060   6.215 -20.465
    2   2H    ALA   1          2H        ALA   1 -10.046   6.981 -19.394
    3   3H    ALA   1          3H        ALA   1 -10.422   5.463 -19.919
    4    HA   ALA   1           HA       ALA   1 -10.393   6.617 -22.233
    5   1HB   ALA   1          1HB       ALA   1 -12.411   5.583 -20.651
    6   2HB   ALA   1          2HB       ALA   1 -12.935   7.270 -20.828
    7   3HB   ALA   1          3HB       ALA   1 -12.635   6.279 -22.264
    8    HA   PRO   2           HA       PRO   2 -10.030  11.035 -21.726
    9   1HB   PRO   2          1HB       PRO   2 -11.106  12.001 -24.045
   10   2HB   PRO   2          2HB       PRO   2  -9.524  11.180 -23.955
   11   1HG   PRO   2          1HG       PRO   2 -12.151  10.101 -24.935
   12   2HG   PRO   2          2HG       PRO   2 -10.488   9.714 -25.481
   13   1HD   PRO   2          1HD       PRO   2 -12.092   8.202 -23.700
   14   2HD   PRO   2          2HD       PRO   2 -10.335   7.992 -23.965
   15    H    LEU   3           H        LEU   3 -11.245  11.664 -20.067
   16    HA   LEU   3           HA       LEU   3 -13.923  12.749 -20.620
   17   1HB   LEU   3          1HB       LEU   3 -13.631  10.311 -19.255
   18   2HB   LEU   3          2HB       LEU   3 -13.620  11.448 -17.933
   19    HG   LEU   3           HG       LEU   3 -15.837  10.620 -18.296
   20   1HD1  LEU   3          1HD1      LEU   3 -15.689  13.517 -19.221
   21   2HD1  LEU   3          2HD1      LEU   3 -17.120  12.693 -18.575
   22   3HD1  LEU   3          3HD1      LEU   3 -15.691  12.939 -17.539
   23   1HD2  LEU   3          1HD2      LEU   3 -15.741  11.742 -21.124
   24   2HD2  LEU   3          2HD2      LEU   3 -15.574  10.030 -20.686
   25   3HD2  LEU   3          3HD2      LEU   3 -17.090  10.892 -20.347
   26    H    GLU   4           H        GLU   4 -13.329  14.862 -20.461
   27    HA   GLU   4           HA       GLU   4 -11.276  16.068 -19.154
   28   1HB   GLU   4          1HB       GLU   4 -14.050  17.072 -19.769
   29   2HB   GLU   4          2HB       GLU   4 -12.901  18.063 -18.876
   30   1HG   GLU   4          1HG       GLU   4 -12.683  18.730 -21.120
   31   2HG   GLU   4          2HG       GLU   4 -11.241  17.821 -20.700
   32    HA   PRO   5           HA       PRO   5 -12.579  15.067 -14.922
   33   1HB   PRO   5          1HB       PRO   5 -10.093  15.150 -13.715
   34   2HB   PRO   5          2HB       PRO   5 -10.747  13.752 -14.610
   35   1HG   PRO   5          1HG       PRO   5  -8.656  15.704 -15.464
   36   2HG   PRO   5          2HG       PRO   5  -8.913  14.007 -15.968
   37   1HD   PRO   5          1HD       PRO   5  -9.693  16.382 -17.365
   38   2HD   PRO   5          2HD       PRO   5 -10.079  14.702 -17.795
   39    H    VAL   6           H        VAL   6 -11.819  17.811 -16.316
   40    HA   VAL   6           HA       VAL   6 -11.521  20.011 -15.885
   41    HB   VAL   6           HB       VAL   6 -13.311  20.992 -14.547
   42   1HG1  VAL   6          1HG1      VAL   6 -14.115  18.701 -16.378
   43   2HG1  VAL   6          2HG1      VAL   6 -15.234  19.927 -15.790
   44   3HG1  VAL   6          3HG1      VAL   6 -13.856  20.402 -16.799
   45   1HG2  VAL   6          1HG2      VAL   6 -14.214  18.182 -13.808
   46   2HG2  VAL   6          2HG2      VAL   6 -13.418  19.287 -12.678
   47   3HG2  VAL   6          3HG2      VAL   6 -14.982  19.721 -13.375
   48    H    TYR   7           H        TYR   7 -12.018  21.203 -13.113
   49    HA   TYR   7           HA       TYR   7 -10.826  21.815 -11.281
   50   1HB   TYR   7          1HB       TYR   7 -11.802  19.504 -10.900
   51   2HB   TYR   7          2HB       TYR   7 -10.182  18.867 -11.104
   52    HD1  TYR   7           1HD      TYR   7 -12.304  21.190  -9.119
   53    HD2  TYR   7           2HD      TYR   7  -8.585  19.032  -9.292
   54    HE1  TYR   7           1HE      TYR   7 -11.857  21.783  -6.732
   55    HE2  TYR   7           2HE      TYR   7  -8.141  19.580  -6.905
   56    HH   TYR   7           HH       TYR   7  -9.038  20.506  -4.990
   57    HA   PRO   8           HA       PRO   8  -6.693  21.904 -13.336
   58   1HB   PRO   8          1HB       PRO   8  -6.238  24.630 -13.124
   59   2HB   PRO   8          2HB       PRO   8  -7.121  23.847 -14.461
   60   1HG   PRO   8          1HG       PRO   8  -8.208  25.347 -12.099
   61   2HG   PRO   8          2HG       PRO   8  -8.843  25.255 -13.772
   62   1HD   PRO   8          1HD       PRO   8  -9.784  23.804 -11.560
   63   2HD   PRO   8          2HD       PRO   8 -10.088  23.377 -13.268
   64    H    GLY   9           H        GLY   9  -4.580  22.336 -12.503
   65   1HA   GLY   9          1HA       GLY   9  -2.974  22.750 -10.814
   66   2HA   GLY   9          2HA       GLY   9  -4.261  23.005  -9.635
   67    H    ASP  10           H        ASP  10  -2.864  20.346 -11.732
   68    HA   ASP  10           HA       ASP  10  -3.778  18.253  -9.966
   69   1HB   ASP  10          1HB       ASP  10  -2.390  16.794 -11.328
   70   2HB   ASP  10          2HB       ASP  10  -3.415  17.802 -12.343
   71    H    ASN  11           H        ASN  11  -2.798  17.489  -8.299
   72    HA   ASN  11           HA       ASN  11  -0.366  16.908  -7.450
   73   1HB   ASN  11          1HB       ASN  11  -0.611  19.908  -7.189
   74   2HB   ASN  11          2HB       ASN  11   0.132  19.037  -5.862
   75   1HD2  ASN  11          1HD2      ASN  11   1.361  20.937  -7.795
   76   2HD2  ASN  11          2HD2      ASN  11   2.757  19.996  -8.355
   77    H    ALA  12           H        ALA  12  -3.375  18.362  -6.570
   78    HA   ALA  12           HA       ALA  12  -4.703  18.309  -4.730
   79   1HB   ALA  12          1HB       ALA  12  -3.470  15.553  -4.464
   80   2HB   ALA  12          2HB       ALA  12  -4.937  16.078  -3.617
   81   3HB   ALA  12          3HB       ALA  12  -4.917  15.981  -5.383
   82    H    THR  13           H        THR  13  -4.397  17.257  -2.148
   83    HA   THR  13           HA       THR  13  -2.653  19.209  -0.906
   84    HB   THR  13           HB       THR  13  -4.665  18.820   0.172
   85    HG1  THR  13           1HG      THR  13  -3.322  19.072   1.762
   86   1HG2  THR  13          1HG2      THR  13  -5.810  16.907   0.230
   87   2HG2  THR  13          2HG2      THR  13  -4.474  16.048  -0.560
   88   3HG2  THR  13          3HG2      THR  13  -4.560  16.154   1.203
   89    HA   PRO  14           HA       PRO  14   0.963  16.608  -0.750
   90   1HB   PRO  14          1HB       PRO  14   2.389  17.883   1.255
   91   2HB   PRO  14          2HB       PRO  14   2.277  18.455  -0.426
   92   1HG   PRO  14          1HG       PRO  14   0.877  19.468   2.018
   93   2HG   PRO  14          2HG       PRO  14   1.380  20.357   0.549
   94   1HD   PRO  14          1HD       PRO  14  -1.207  19.424   1.155
   95   2HD   PRO  14          2HD       PRO  14  -0.661  19.961  -0.451
   96    H    GLU  15           H        GLU  15   2.096  15.156   0.742
   97    HA   GLU  15           HA       GLU  15   2.085  13.353   2.085
   98   1HB   GLU  15          1HB       GLU  15   2.566  14.778   3.857
   99   2HB   GLU  15          2HB       GLU  15   0.950  15.454   3.922
  100   1HG   GLU  15          1HG       GLU  15   0.041  13.462   4.935
  101   2HG   GLU  15          2HG       GLU  15   1.546  12.570   4.673
  102    H    GLN  16           H        GLN  16  -0.867  14.467   0.953
  103    HA   GLN  16           HA       GLN  16  -2.321  12.026   1.753
  104   1HB   GLN  16          1HB       GLN  16  -3.264  14.359   1.777
  105   2HB   GLN  16          2HB       GLN  16  -3.123  14.373   0.020
  106   1HG   GLN  16          1HG       GLN  16  -5.176  13.527  -0.099
  107   2HG   GLN  16          2HG       GLN  16  -4.577  12.013   0.561
  108   1HE2  GLN  16          1HE2      GLN  16  -4.975  11.532   2.856
  109   2HE2  GLN  16          2HE2      GLN  16  -6.117  12.582   3.715
  110    H    MET  17           H        MET  17  -0.902  13.479  -1.230
  111    HA   MET  17           HA       MET  17  -2.018  11.509  -3.029
  112   1HB   MET  17          1HB       MET  17  -0.146  13.836  -3.119
  113   2HB   MET  17          2HB       MET  17   0.231  12.562  -4.262
  114   1HG   MET  17          1HG       MET  17  -2.532  13.742  -3.905
  115   2HG   MET  17          2HG       MET  17  -1.369  14.336  -5.093
  116   1HE   MET  17          1HE       MET  17  -0.843  13.394  -7.304
  117   2HE   MET  17          2HE       MET  17  -0.037  12.007  -6.548
  118    H    ALA  18           H        ALA  18   1.125  11.842  -1.344
  119    HA   ALA  18           HA       ALA  18   2.216   9.419  -2.469
  120   1HB   ALA  18          1HB       ALA  18   3.512   9.885  -0.014
  121   2HB   ALA  18          2HB       ALA  18   4.014  10.485  -1.602
  122   3HB   ALA  18          3HB       ALA  18   3.024  11.508  -0.542
  123    H    ARG  19           H        ARG  19  -0.007  10.076   0.089
  124    HA   ARG  19           HA       ARG  19   0.279   7.447   1.370
  125   1HB   ARG  19          1HB       ARG  19  -0.515   9.731   2.430
  126   2HB   ARG  19          2HB       ARG  19  -2.100   9.263   1.818
  127   1HG   ARG  19          1HG       ARG  19  -2.163   8.333   3.924
  128   2HG   ARG  19          2HG       ARG  19  -1.500   6.948   3.045
  129   1HD   ARG  19          1HD       ARG  19   0.782   7.548   3.721
  130   2HD   ARG  19          2HD       ARG  19   0.223   9.053   4.448
  131    HE   ARG  19           HE       ARG  19   0.120   6.392   5.618
  132   1HH1  ARG  19          2HH2      ARG  19  -1.333   9.572   5.778
  133   2HH1  ARG  19          1HH2      ARG  19  -1.977   9.344   7.376
  134   1HH2  ARG  19          2HH1      ARG  19  -0.731   6.098   7.659
  135   2HH2  ARG  19          1HH1      ARG  19  -1.660   7.360   8.410
  136    H    TYR  20           H        TYR  20  -2.205   9.039  -0.709
  137    HA   TYR  20           HA       TYR  20  -4.042   6.971  -0.956
  138   1HB   TYR  20          1HB       TYR  20  -3.109   9.327  -2.566
  139   2HB   TYR  20          2HB       TYR  20  -3.962   8.112  -3.456
  140    HD1  TYR  20           1HD      TYR  20  -6.152   7.145  -2.058
  141    HD2  TYR  20           2HD      TYR  20  -4.513  11.135  -1.940
  142    HE1  TYR  20           1HE      TYR  20  -8.388   8.053  -1.449
  143    HE2  TYR  20           2HE      TYR  20  -6.754  12.036  -1.360
  144    HH   TYR  20           HH       TYR  20  -9.080  11.496  -1.383
  145    H    TYR  21           H        TYR  21  -1.118   7.537  -2.947
  146    HA   TYR  21           HA       TYR  21  -1.415   5.184  -4.541
  147   1HB   TYR  21          1HB       TYR  21   0.072   7.404  -4.708
  148   2HB   TYR  21          2HB       TYR  21   1.284   6.396  -3.961
  149    HD1  TYR  21           1HD      TYR  21  -0.357   7.351  -6.989
  150    HD2  TYR  21           2HD      TYR  21   1.759   4.065  -5.152
  151    HE1  TYR  21           1HE      TYR  21   0.167   6.447  -9.233
  152    HE2  TYR  21           2HE      TYR  21   2.283   3.158  -7.432
  153    HH   TYR  21           HH       TYR  21   1.307   4.879 -10.398
  154    H    SER  22           H        SER  22   0.452   5.777  -1.535
  155    HA   SER  22           HA       SER  22   1.740   3.215  -1.409
  156   1HB   SER  22          1HB       SER  22   2.394   5.299  -0.140
  157   2HB   SER  22          2HB       SER  22   0.991   5.038   0.911
  158    HG   SER  22           HG       SER  22   3.263   3.366   0.546
  159    H    ALA  23           H        ALA  23  -1.328   4.448  -0.037
  160    HA   ALA  23           HA       ALA  23  -2.189   2.068   1.250
  161   1HB   ALA  23          1HB       ALA  23  -4.450   3.093   1.045
  162   2HB   ALA  23          2HB       ALA  23  -3.248   4.257   1.646
  163   3HB   ALA  23          3HB       ALA  23  -3.794   4.327  -0.045
  164    H    LEU  24           H        LEU  24  -2.693   3.217  -2.167
  165    HA   LEU  24           HA       LEU  24  -4.165   0.957  -2.995
  166   1HB   LEU  24          1HB       LEU  24  -2.771   3.152  -4.301
  167   2HB   LEU  24          2HB       LEU  24  -2.410   1.660  -5.159
  168    HG   LEU  24           HG       LEU  24  -5.199   2.677  -4.500
  169   1HD1  LEU  24          1HD1      LEU  24  -4.130   4.104  -6.155
  170   2HD1  LEU  24          2HD1      LEU  24  -3.568   2.704  -7.081
  171   3HD1  LEU  24          3HD1      LEU  24  -5.294   3.061  -6.992
  172   1HD2  LEU  24          1HD2      LEU  24  -6.104   0.944  -5.820
  173   2HD2  LEU  24          2HD2      LEU  24  -4.534   0.511  -6.512
  174   3HD2  LEU  24          3HD2      LEU  24  -4.912   0.103  -4.830
  175    H    ARG  25           H        ARG  25  -0.593   1.341  -2.902
  176    HA   ARG  25           HA       ARG  25  -0.002  -1.257  -3.909
  177   1HB   ARG  25          1HB       ARG  25   1.562   0.851  -3.204
  178   2HB   ARG  25          2HB       ARG  25   1.766  -0.103  -1.741
  179   1HG   ARG  25          1HG       ARG  25   3.551  -0.617  -3.281
  180   2HG   ARG  25          2HG       ARG  25   2.523  -2.056  -3.158
  181   1HD   ARG  25          1HD       ARG  25   1.548  -1.682  -5.304
  182   2HD   ARG  25          2HD       ARG  25   2.027   0.023  -5.305
  183    HE   ARG  25           HE       ARG  25   4.248  -1.899  -5.339
  184   1HH1  ARG  25          2HH2      ARG  25   2.063  -0.022  -7.356
  185   2HH1  ARG  25          1HH2      ARG  25   3.177   0.053  -8.696
  186   1HH2  ARG  25          2HH1      ARG  25   5.599  -1.907  -7.207
  187   2HH2  ARG  25          1HH1      ARG  25   5.059  -1.009  -8.609
  188    H    ARG  26           H        ARG  26  -0.342  -0.264  -0.510
  189    HA   ARG  26           HA       ARG  26   0.000  -2.902   0.548
  190   1HB   ARG  26          1HB       ARG  26   0.013  -0.480   1.652
  191   2HB   ARG  26          2HB       ARG  26  -1.671  -0.831   1.990
  192   1HG   ARG  26          1HG       ARG  26   0.477  -2.874   2.697
  193   2HG   ARG  26          2HG       ARG  26   0.335  -1.421   3.655
  194   1HD   ARG  26          1HD       ARG  26  -2.332  -2.520   3.390
  195   2HD   ARG  26          2HD       ARG  26  -1.240  -3.833   3.794
  196    HE   ARG  26           HE       ARG  26  -0.987  -2.973   5.913
  197   1HH1  ARG  26          2HH2      ARG  26  -2.243  -0.391   3.940
  198   2HH1  ARG  26          1HH2      ARG  26  -2.303   0.762   5.249
  199   1HH2  ARG  26          2HH1      ARG  26  -1.006  -1.448   7.587
  200   2HH2  ARG  26          1HH1      ARG  26  -1.584   0.160   7.271
  201    H    TYR  27           H        TYR  27  -2.932  -1.141  -0.384
  202    HA   TYR  27           HA       TYR  27  -4.873  -3.041   0.411
  203   1HB   TYR  27          1HB       TYR  27  -5.310  -0.671  -0.199
  204   2HB   TYR  27          2HB       TYR  27  -4.888  -1.018  -1.870
  205    HD1  TYR  27           1HD      TYR  27  -7.117  -2.546   0.761
  206    HD2  TYR  27           2HD      TYR  27  -6.756  -1.098  -3.290
  207    HE1  TYR  27           1HE      TYR  27  -9.526  -3.031   0.368
  208    HE2  TYR  27           2HE      TYR  27  -9.160  -1.539  -3.658
  209    HH   TYR  27           HH       TYR  27 -11.185  -1.901  -2.504
  210    H    ILE  28           H        ILE  28  -3.370  -2.565  -2.847
  211    HA   ILE  28           HA       ILE  28  -4.550  -4.832  -4.100
  212    HB   ILE  28           HB       ILE  28  -1.880  -3.468  -4.553
  213   2HG1  ILE  28          2HG1      ILE  28  -4.111  -2.184  -4.954
  214   1HG2  ILE  28          1HG2      ILE  28  -1.296  -5.061  -6.025
  215   2HG2  ILE  28          2HG2      ILE  28  -2.753  -6.002  -5.679
  216   3HG2  ILE  28          3HG2      ILE  28  -2.778  -4.805  -6.953
  217   1HD1  ILE  28          1HD1      ILE  28  -1.966  -1.453  -5.955
  218   2HD1  ILE  28          2HD1      ILE  28  -2.216  -2.566  -7.317
  219   3HD1  ILE  28          3HD1      ILE  28  -3.326  -1.217  -7.076
  220    H    ASN  29           H        ASN  29  -1.364  -4.593  -2.351
  221    HA   ASN  29           HA       ASN  29  -0.728  -7.324  -2.527
  222   1HB   ASN  29          1HB       ASN  29   0.766  -5.509  -1.699
  223   2HB   ASN  29          2HB       ASN  29  -0.150  -5.468  -0.187
  224   1HD2  ASN  29          1HD2      ASN  29   1.741  -6.095   1.083
  225   2HD2  ASN  29          2HD2      ASN  29   2.323  -7.763   0.913
  226    H    MET  30           H        MET  30  -2.662  -5.699   0.045
  227    HA   MET  30           HA       MET  30  -3.243  -8.017   1.555
  228   1HB   MET  30          1HB       MET  30  -3.632  -5.410   2.011
  229   2HB   MET  30          2HB       MET  30  -5.231  -5.758   1.364
  230   1HG   MET  30          1HG       MET  30  -5.201  -7.742   3.089
  231   2HG   MET  30          2HG       MET  30  -3.809  -6.908   3.775
  232   1HE   MET  30          1HE       MET  30  -7.396  -5.862   2.352
  233   2HE   MET  30          2HE       MET  30  -7.526  -7.257   3.445
  234    H    LEU  31           H        LEU  31  -5.073  -6.587  -1.210
  235    HA   LEU  31           HA       LEU  31  -7.239  -8.442  -1.195
  236   1HB   LEU  31          1HB       LEU  31  -5.958  -6.540  -3.196
  237   2HB   LEU  31          2HB       LEU  31  -7.240  -7.605  -3.693
  238    HG   LEU  31           HG       LEU  31  -7.563  -5.645  -1.388
  239   1HD1  LEU  31          1HD1      LEU  31  -7.133  -4.256  -3.247
  240   2HD1  LEU  31          2HD1      LEU  31  -7.978  -5.329  -4.390
  241   3HD1  LEU  31          3HD1      LEU  31  -8.906  -4.384  -3.229
  242   1HD2  LEU  31          1HD2      LEU  31  -9.666  -6.965  -3.155
  243   2HD2  LEU  31          2HD2      LEU  31  -9.200  -7.591  -1.559
  244   3HD2  LEU  31          3HD2      LEU  31  -9.929  -5.981  -1.695
  245    H    THR  32           H        THR  32  -4.052  -8.497  -2.681
  246    HA   THR  32           HA       THR  32  -4.552 -11.013  -4.085
  247    HB   THR  32           HB       THR  32  -2.179 -11.040  -4.605
  248    HG1  THR  32           1HG      THR  32  -1.927  -9.320  -2.485
  249   1HG2  THR  32          1HG2      THR  32  -3.228  -9.790  -6.210
  250   2HG2  THR  32          2HG2      THR  32  -3.767  -8.523  -5.101
  251   3HG2  THR  32          3HG2      THR  32  -2.072  -8.592  -5.599
  252    H    ARG  33           H        ARG  33  -3.485 -10.184  -0.956
  253    HA   ARG  33           HA       ARG  33  -2.924 -11.225   0.941
  254   1HB   ARG  33          1HB       ARG  33  -4.919 -12.603   0.529
  255   2HB   ARG  33          2HB       ARG  33  -3.984 -13.713  -0.454
  256   1HG   ARG  33          1HG       ARG  33  -4.158 -14.893   1.498
  257   2HG   ARG  33          2HG       ARG  33  -2.570 -14.178   1.679
  258   1HD   ARG  33          1HD       ARG  33  -3.633 -13.881   3.773
  259   2HD   ARG  33          2HD       ARG  33  -3.752 -12.286   3.002
  260    HE   ARG  33           HE       ARG  33  -6.049 -13.983   2.480
  261   1HH1  ARG  33          2HH2      ARG  33  -4.759 -11.796   4.861
  262   2HH1  ARG  33          1HH2      ARG  33  -6.326 -11.395   5.525
  263   1HH2  ARG  33          2HH1      ARG  33  -8.087 -13.244   3.207
  264   2HH2  ARG  33          1HH1      ARG  33  -8.150 -12.482   4.757
  265    HA   PRO  34           HA       PRO  34   1.200 -12.900  -0.009
  266   1HB   PRO  34          1HB       PRO  34   2.217 -13.250   2.511
  267   2HB   PRO  34          2HB       PRO  34   2.040 -11.668   1.712
  268   1HG   PRO  34          1HG       PRO  34   0.292 -12.893   3.828
  269   2HG   PRO  34          2HG       PRO  34   0.773 -11.184   3.605
  270   1HD   PRO  34          1HD       PRO  34  -1.641 -12.347   2.800
  271   2HD   PRO  34          2HD       PRO  34  -1.008 -10.794   2.194
  272    H    ARG  35           H        ARG  35  -0.707 -14.591  -0.617
  273    HA   ARG  35           HA       ARG  35  -0.666 -17.136   0.831
  274   1HB   ARG  35          1HB       ARG  35  -2.538 -16.439  -0.638
  275   2HB   ARG  35          2HB       ARG  35  -1.474 -16.447  -2.038
  276   1HG   ARG  35          1HG       ARG  35  -1.471 -19.016  -0.530
  277   2HG   ARG  35          2HG       ARG  35  -3.058 -18.576  -1.126
  278   1HD   ARG  35          1HD       ARG  35  -2.414 -18.585  -3.375
  279   2HD   ARG  35          2HD       ARG  35  -0.689 -18.431  -3.001
  280    HE   ARG  35           HE       ARG  35  -1.402 -20.832  -1.850
  281   1HH1  ARG  35          2HH2      ARG  35  -1.577 -19.616  -5.132
  282   2HH1  ARG  35          1HH2      ARG  35  -1.485 -21.203  -5.845
  283   1HH2  ARG  35          2HH1      ARG  35  -1.239 -22.850  -2.796
  284   2HH2  ARG  35          1HH1      ARG  35  -1.268 -22.986  -4.527
  285    H    TYR  36           H        TYR  36   1.501 -15.584  -1.375
  286    HA   TYR  36           HA       TYR  36   3.349 -17.842  -1.295
  287   1HB   TYR  36          1HB       TYR  36   1.589 -17.478  -3.536
  288   2HB   TYR  36          2HB       TYR  36   3.144 -16.881  -4.056
  289    HD1  TYR  36           1HD      TYR  36   4.988 -18.408  -4.481
  290    HD2  TYR  36           2HD      TYR  36   1.343 -19.825  -2.664
  291    HE1  TYR  36           1HE      TYR  36   5.708 -20.764  -4.850
  292    HE2  TYR  36           2HE      TYR  36   2.045 -22.178  -3.076
  293    HH   TYR  36           HH       TYR  36   3.584 -23.458  -4.531
  294   1HN   NH2  37          1HN       NH2  37   5.552 -17.143  -2.306
  295   2HN   NH2  37          2HN       NH2  37   5.862 -15.403  -2.289