*HEADER    TOXIN                                   17-JAN-12   2LO7              
*TITLE     TS16 NMR SOLUTION STRUCTURE                                           
*COMPND    MOL_ID: 1;                                                            
*COMPND   2 MOLECULE: TOXIN TS16;                                                
*COMPND   3 CHAIN: A;                                                            
*COMPND   4 SYNONYM: TITYUSTOXIN-16;                                             
*COMPND   5 ENGINEERED: YES                                                      
*SOURCE    MOL_ID: 1;                                                            
*SOURCE   2 ORGANISM_SCIENTIFIC: TITYUS SERRULATUS;                              
*SOURCE   3 ORGANISM_COMMON: BRAZILIAN SCORPION;                                 
*SOURCE   4 ORGANISM_TAXID: 6887;                                                
*SOURCE   5 STRAIN: TS16;                                                        
*SOURCE   6 EXPRESSION_SYSTEM: ESCHERICHIA COLI;                                 
*SOURCE   7 EXPRESSION_SYSTEM_TAXID: 562;                                        
*SOURCE   8 EXPRESSION_SYSTEM_VECTOR: PET32B                                     
*KEYWDS    CS ALFA ALFA, TOXIN                                                   
*EXPDTA    SOLUTION NMR                                                          
*NUMMDL    20                                                                    
*AUTHOR    F.DEL RIO-PORTILLA, A.L.SAUCEDO, D.FLORES-SOLIS                       
*REVDAT   1   14-MAR-12 2LO7    0                                                


#
# 26 CYX   HA    27   LYS   HN    3.50 
 &rst
  ixpk= 0, nxpk= 0, iat= 368, 376, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00, 
      rk2=20.0, rk3=20.0, ir6=1, ialtd=0,
 &end
#
# 26 CYX   HN    27   LYS   HN    3.55 
 &rst
  ixpk= 0, nxpk= 0, iat= 366, 376, r1= 1.30, r2= 1.80, r3= 3.55, r4= 4.05,  &end
#
# 27 LYS   HN    27   LYS   QD    4.32 
 &rst
  ixpk= 0, nxpk= 0, iat= 376,  -1, r1= 1.30, r2= 1.80, r3= 4.85, r4= 5.35,
 igr2= 386, 387,
 &end
#
# 27 LYS   HN    27   LYS   QG    3.96 
 &rst
  ixpk= 0, nxpk= 0, iat= 376,  -1, r1= 1.30, r2= 1.80, r3= 4.44, r4= 4.94,
 igr2= 383, 384,
 &end
#
# 24 LYS   HB3   25   HIS   HA    5.50 
 &rst
  ixpk= 0, nxpk= 0, iat= 332, 351, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
# 27 LYS   HA    27   LYS   QD    5.50 
 &rst
  ixpk= 0, nxpk= 0, iat= 378,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2= 386, 387,
 &end
#
#  4 CYX   HB2   27   LYS   HN    5.50 
 &rst
  ixpk= 0, nxpk= 0, iat=  33, 376, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
# 27 LYS   HN    27   LYS   QE    5.50 
 &rst
  ixpk= 0, nxpk= 0, iat= 376,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2= 389, 390,
 &end
#
# 27 LYS   HA    28   CYX   HN    2.95 
 &rst
  ixpk= 0, nxpk= 0, iat= 378, 398, r1= 1.30, r2= 1.80, r3= 2.95, r4= 3.45,  &end
#
# 27 LYS   HN    28   CYX   HN    4.50 
 &rst
  ixpk= 0, nxpk= 0, iat= 376, 398, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
# 27 LYS   HB3   28   CYX   HN    3.74 
 &rst
  ixpk= 0, nxpk= 0, iat= 381, 398, r1= 1.30, r2= 1.80, r3= 3.74, r4= 4.24,  &end
#
# 27 LYS   HB2   28   CYX   HN    3.74 
 &rst
  ixpk= 0, nxpk= 0, iat= 380, 398, r1= 1.30, r2= 1.80, r3= 3.74, r4= 4.24,  &end
#
# 27 LYS   QD    28   CYX   HN    5.10 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 398, r1= 1.30, r2= 1.80, r3= 5.72, r4= 6.22,
 igr1= 386, 387,
 &end
#
# 28 CYX   HN    28   CYX   HB3   3.69 
 &rst
  ixpk= 0, nxpk= 0, iat= 398, 403, r1= 1.30, r2= 1.80, r3= 3.69, r4= 4.19,  &end
#
# 28 CYX   HN    28   CYX   HB2   3.28 
 &rst
  ixpk= 0, nxpk= 0, iat= 398, 402, r1= 1.30, r2= 1.80, r3= 3.28, r4= 3.78,  &end
#
# 28 CYX   HN    29   ILE   HN    4.80 
 &rst
  ixpk= 0, nxpk= 0, iat= 398, 408, r1= 1.30, r2= 1.80, r3= 4.80, r4= 5.30,  &end
#
# 28 CYX   HB2   29   ILE   HN    4.38 
 &rst
  ixpk= 0, nxpk= 0, iat= 402, 408, r1= 1.30, r2= 1.80, r3= 4.38, r4= 4.88,  &end
#
# 28 CYX   HB3   29   ILE   HN    3.34 
 &rst
  ixpk= 0, nxpk= 0, iat= 403, 408, r1= 1.30, r2= 1.80, r3= 3.34, r4= 3.84,  &end
#
# 28 CYX   HA    29   ILE   HN    3.21 
 &rst
  ixpk= 0, nxpk= 0, iat= 400, 408, r1= 1.30, r2= 1.80, r3= 3.21, r4= 3.71,  &end
#
# 21 TYR   HB2   29   ILE   HN    5.00 
 &rst
  ixpk= 0, nxpk= 0, iat= 281, 408, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50,  &end
#
# 29 ILE   HN    29   ILE   HB    3.51 
 &rst
  ixpk= 0, nxpk= 0, iat= 408, 412, r1= 1.30, r2= 1.80, r3= 3.51, r4= 4.01,  &end
#
# 29 ILE   HN    29   ILE   QG1   4.26 
 &rst
  ixpk= 0, nxpk= 0, iat= 408,  -1, r1= 1.30, r2= 1.80, r3= 4.78, r4= 5.28,
 igr2= 418, 419,
 &end
#
# 29 ILE   HN    29   ILE   QG2   3.60 
 &rst
  ixpk= 0, nxpk= 0, iat= 408,  -1, r1= 1.30, r2= 1.80, r3= 4.32, r4= 4.82,
 igr2= 414, 415, 416,
 &end
#
# 29 ILE   HA    29   ILE   QG1   3.89 
 &rst
  ixpk= 0, nxpk= 0, iat= 410,  -1, r1= 1.30, r2= 1.80, r3= 4.37, r4= 4.87,
 igr2= 418, 419,
 &end
#
# 29 ILE   HA    29   ILE   QG2   3.71 
 &rst
  ixpk= 0, nxpk= 0, iat= 410,  -1, r1= 1.30, r2= 1.80, r3= 4.46, r4= 4.96,
 igr2= 414, 415, 416,
 &end
#
# 29 ILE   QG2   29   ILE   QD1   2.43 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,
 igr1= 414, 415, 416,
 igr2= 421, 422, 423,
 &end
#
# 29 ILE   QG2   29   ILE   QG1   2.87 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 3.87, r4= 4.37,
 igr1= 414, 415, 416,
 igr2= 418, 419,
 &end
#
# 29 ILE   HA    29   ILE   QD1   4.16 
 &rst
  ixpk= 0, nxpk= 0, iat= 410,  -1, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50,
 igr2= 421, 422, 423,
 &end
#
# 29 ILE   HN    29   ILE   QD1   4.50 
 &rst
  ixpk= 0, nxpk= 0, iat= 408,  -1, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr2= 421, 422, 423,
 &end
#
# 29 ILE   HB    29   ILE   QD1   3.41 
 &rst
  ixpk= 0, nxpk= 0, iat= 412,  -1, r1= 1.30, r2= 1.80, r3= 4.10, r4= 4.60,
 igr2= 421, 422, 423,
 &end
#
# 25 HIS   HN    25   HIS   HB3   3.82 
 &rst
  ixpk= 0, nxpk= 0, iat= 349, 354, r1= 1.30, r2= 1.80, r3= 3.82, r4= 4.32,  &end
#
# 25 HIS   HN    25   HIS   HB2   3.82 
 &rst
  ixpk= 0, nxpk= 0, iat= 349, 353, r1= 1.30, r2= 1.80, r3= 3.82, r4= 4.32,  &end
#
# 25 HIS   HN    26   CYX   HN    3.18 
 &rst
  ixpk= 0, nxpk= 0, iat= 349, 366, r1= 1.30, r2= 1.80, r3= 3.18, r4= 3.68,  &end
#
# 25 HIS   HB3   26   CYX   HN    4.62 
 &rst
  ixpk= 0, nxpk= 0, iat= 354, 366, r1= 1.30, r2= 1.80, r3= 4.62, r4= 5.12,  &end
#
# 25 HIS   HB2   26   CYX   HN    4.62 
 &rst
  ixpk= 0, nxpk= 0, iat= 353, 366, r1= 1.30, r2= 1.80, r3= 4.62, r4= 5.12,  &end
#
# 25 HIS   HA    25   HIS   HD2   5.14 
 &rst
  ixpk= 0, nxpk= 0, iat= 351, 362, r1= 1.30, r2= 1.80, r3= 5.14, r4= 5.64,  &end
#
# 25 HIS   HN    25   HIS   HD2   4.12 
 &rst
  ixpk= 0, nxpk= 0, iat= 349, 362, r1= 1.30, r2= 1.80, r3= 4.12, r4= 4.62,  &end
#
# 24 LYS   HN    24   LYS   QE    5.50 
 &rst
  ixpk= 0, nxpk= 0, iat= 327,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2= 340, 341,
 &end
#
# 24 LYS   HN    24   LYS   HB3   4.12 
 &rst
  ixpk= 0, nxpk= 0, iat= 327, 332, r1= 1.30, r2= 1.80, r3= 4.12, r4= 4.62,  &end
#
# 24 LYS   HN    24   LYS   HB2   3.47 
 &rst
  ixpk= 0, nxpk= 0, iat= 327, 331, r1= 1.30, r2= 1.80, r3= 3.47, r4= 3.97,  &end
#
# 24 LYS   HN    24   LYS   HG3   4.16 
 &rst
  ixpk= 0, nxpk= 0, iat= 327, 335, r1= 1.30, r2= 1.80, r3= 4.16, r4= 4.66,  &end
#
# 24 LYS   HN    24   LYS   QD    4.71 
 &rst
  ixpk= 0, nxpk= 0, iat= 327,  -1, r1= 1.30, r2= 1.80, r3= 5.29, r4= 5.79,
 igr2= 337, 338,
 &end
#
# 24 LYS   HN    24   LYS   HG2   4.16 
 &rst
  ixpk= 0, nxpk= 0, iat= 327, 334, r1= 1.30, r2= 1.80, r3= 4.16, r4= 4.66,  &end
#
# 24 LYS   HA    24   LYS   HG3   4.06 
 &rst
  ixpk= 0, nxpk= 0, iat= 329, 335, r1= 1.30, r2= 1.80, r3= 4.06, r4= 4.56,  &end
#
# 24 LYS   HA    24   LYS   HG2   4.06 
 &rst
  ixpk= 0, nxpk= 0, iat= 329, 334, r1= 1.30, r2= 1.80, r3= 4.06, r4= 4.56,  &end
#
# 24 LYS   HA    24   LYS   QD    4.03 
 &rst
  ixpk= 0, nxpk= 0, iat= 329,  -1, r1= 1.30, r2= 1.80, r3= 4.52, r4= 5.02,
 igr2= 337, 338,
 &end
#
# 24 LYS   HB3   24   LYS   QE    4.13 
 &rst
  ixpk= 0, nxpk= 0, iat= 332,  -1, r1= 1.30, r2= 1.80, r3= 4.64, r4= 5.14,
 igr2= 340, 341,
 &end
#
# 24 LYS   HB2   24   LYS   QD    3.43 
 &rst
  ixpk= 0, nxpk= 0, iat= 331,  -1, r1= 1.30, r2= 1.80, r3= 3.85, r4= 4.35,
 igr2= 337, 338,
 &end
#
# 24 LYS   HB3   24   LYS   QD    3.42 
 &rst
  ixpk= 0, nxpk= 0, iat= 332,  -1, r1= 1.30, r2= 1.80, r3= 3.84, r4= 4.34,
 igr2= 337, 338,
 &end
#
# 23 LEU   HN    23   LEU   HB2   3.04 
 &rst
  ixpk= 0, nxpk= 0, iat= 308, 312, r1= 1.30, r2= 1.80, r3= 3.04, r4= 3.54,  &end
#
# 23 LEU   HN    23   LEU   HB3   3.58 
 &rst
  ixpk= 0, nxpk= 0, iat= 308, 313, r1= 1.30, r2= 1.80, r3= 3.58, r4= 4.08,  &end
#
# 23 LEU   HN    23   LEU   QD2   4.20 
 &rst
  ixpk= 0, nxpk= 0, iat= 308,  -1, r1= 1.30, r2= 1.80, r3= 5.04, r4= 5.54,
 igr2= 321, 322, 323,
 &end
#
# 23 LEU   HN    23   LEU   QD1   4.13 
 &rst
  ixpk= 0, nxpk= 0, iat= 308,  -1, r1= 1.30, r2= 1.80, r3= 4.96, r4= 5.46,
 igr2= 317, 318, 319,
 &end
#
# 23 LEU   HN    23   LEU   HG    4.65 
 &rst
  ixpk= 0, nxpk= 0, iat= 308, 315, r1= 1.30, r2= 1.80, r3= 4.65, r4= 5.15,  &end
#
#  3 GLY   HA3   23   LEU   HG    4.47 
 &rst
  ixpk= 0, nxpk= 0, iat=  25, 315, r1= 1.30, r2= 1.80, r3= 4.47, r4= 4.97,  &end
#
# 23 LEU   HB3   23   LEU   QD2   3.26 
 &rst
  ixpk= 0, nxpk= 0, iat= 313,  -1, r1= 1.30, r2= 1.80, r3= 3.92, r4= 4.42,
 igr2= 321, 322, 323,
 &end
#
# 23 LEU   HB2   23   LEU   QD2   3.19 
 &rst
  ixpk= 0, nxpk= 0, iat= 312,  -1, r1= 1.30, r2= 1.80, r3= 3.83, r4= 4.33,
 igr2= 321, 322, 323,
 &end
#
#  3 GLY   HA3   23   LEU   QD2   4.84 
 &rst
  ixpk= 0, nxpk= 0, iat=  25,  -1, r1= 1.30, r2= 1.80, r3= 5.81, r4= 6.31,
 igr2= 321, 322, 323,
 &end
#
# 23 LEU   HA    23   LEU   QD2   5.17 
 &rst
  ixpk= 0, nxpk= 0, iat= 310,  -1, r1= 1.30, r2= 1.80, r3= 6.21, r4= 6.71,
 igr2= 321, 322, 323,
 &end
#
# 23 LEU   HA    23   LEU   QD1   3.19 
 &rst
  ixpk= 0, nxpk= 0, iat= 310,  -1, r1= 1.30, r2= 1.80, r3= 3.83, r4= 4.33,
 igr2= 317, 318, 319,
 &end
#
# 23 LEU   HB2   23   LEU   QD1   3.48 
 &rst
  ixpk= 0, nxpk= 0, iat= 312,  -1, r1= 1.30, r2= 1.80, r3= 4.18, r4= 4.68,
 igr2= 317, 318, 319,
 &end
#
# 23 LEU   HB3   24   LYS   HN    3.90 
 &rst
  ixpk= 0, nxpk= 0, iat= 313, 327, r1= 1.30, r2= 1.80, r3= 3.90, r4= 4.40,  &end
#
# 23 LEU   HN    24   LYS   HN    3.08 
 &rst
  ixpk= 0, nxpk= 0, iat= 308, 327, r1= 1.30, r2= 1.80, r3= 3.08, r4= 3.58,  &end
#
# 22 CYX   HN    22   CYX   HB3   3.70 
 &rst
  ixpk= 0, nxpk= 0, iat= 298, 303, r1= 1.30, r2= 1.80, r3= 3.70, r4= 4.20,  &end
#
# 22 CYX   HN    23   LEU   HN    3.46 
 &rst
  ixpk= 0, nxpk= 0, iat= 298, 308, r1= 1.30, r2= 1.80, r3= 3.46, r4= 3.96,  &end
#
# 22 CYX   HN    23   LEU   HB2   4.26 
 &rst
  ixpk= 0, nxpk= 0, iat= 298, 312, r1= 1.30, r2= 1.80, r3= 4.26, r4= 4.76,  &end
#
# 22 CYX   HN    22   CYX   HB2   3.70 
 &rst
  ixpk= 0, nxpk= 0, iat= 298, 302, r1= 1.30, r2= 1.80, r3= 3.70, r4= 4.20,  &end
#
# 21 TYR   HN    22   CYX   HN    3.30 
 &rst
  ixpk= 0, nxpk= 0, iat= 277, 298, r1= 1.30, r2= 1.80, r3= 3.30, r4= 3.80,  &end
#
# 21 TYR   HB3   22   CYX   HN    3.98 
 &rst
  ixpk= 0, nxpk= 0, iat= 282, 298, r1= 1.30, r2= 1.80, r3= 3.98, r4= 4.48,  &end
#
# 21 TYR   HB2   22   CYX   HN    3.98 
 &rst
  ixpk= 0, nxpk= 0, iat= 281, 298, r1= 1.30, r2= 1.80, r3= 3.98, r4= 4.48,  &end
#
# 21 TYR   HN    21   TYR   HB2   3.29 
 &rst
  ixpk= 0, nxpk= 0, iat= 277, 281, r1= 1.30, r2= 1.80, r3= 3.29, r4= 3.79,  &end
#
# 21 TYR   HN    21   TYR   HB3   3.29 
 &rst
  ixpk= 0, nxpk= 0, iat= 277, 282, r1= 1.30, r2= 1.80, r3= 3.29, r4= 3.79,  &end
#
# 20 ASP   HN    20   ASP   HB3   3.70 
 &rst
  ixpk= 0, nxpk= 0, iat= 265, 270, r1= 1.30, r2= 1.80, r3= 3.70, r4= 4.20,  &end
#
# 20 ASP   HN    20   ASP   HB2   3.70 
 &rst
  ixpk= 0, nxpk= 0, iat= 265, 269, r1= 1.30, r2= 1.80, r3= 3.70, r4= 4.20,  &end
#
# 20 ASP   HN    21   TYR   HN    3.46 
 &rst
  ixpk= 0, nxpk= 0, iat= 265, 277, r1= 1.30, r2= 1.80, r3= 3.46, r4= 3.96,  &end
#
# 19 GLN   HN    19   GLN   HB2   3.23 
 &rst
  ixpk= 0, nxpk= 0, iat= 248, 252, r1= 1.30, r2= 1.80, r3= 3.23, r4= 3.73,  &end
#
# 19 GLN   HA    19   GLN   HG3   3.60 
 &rst
  ixpk= 0, nxpk= 0, iat= 250, 256, r1= 1.30, r2= 1.80, r3= 3.60, r4= 4.10,  &end
#
# 19 GLN   HA    19   GLN   HG2   3.60 
 &rst
  ixpk= 0, nxpk= 0, iat= 250, 255, r1= 1.30, r2= 1.80, r3= 3.60, r4= 4.10,  &end
#
# 19 GLN   HN    19   GLN   HG3   3.95 
 &rst
  ixpk= 0, nxpk= 0, iat= 248, 256, r1= 1.30, r2= 1.80, r3= 3.95, r4= 4.45,  &end
#
# 19 GLN   HN    19   GLN   HG2   3.95 
 &rst
  ixpk= 0, nxpk= 0, iat= 248, 255, r1= 1.30, r2= 1.80, r3= 3.95, r4= 4.45,  &end
#
# 19 GLN   HN    19   GLN   HB3   3.70 
 &rst
  ixpk= 0, nxpk= 0, iat= 248, 253, r1= 1.30, r2= 1.80, r3= 3.70, r4= 4.20,  &end
#
# 19 GLN   HG3   20   ASP   HN    5.48 
 &rst
  ixpk= 0, nxpk= 0, iat= 256, 265, r1= 1.30, r2= 1.80, r3= 5.48, r4= 5.98,  &end
#
# 19 GLN   HG2   20   ASP   HN    5.48 
 &rst
  ixpk= 0, nxpk= 0, iat= 255, 265, r1= 1.30, r2= 1.80, r3= 5.48, r4= 5.98,  &end
#
# 19 GLN   HB2   20   ASP   HN    3.59 
 &rst
  ixpk= 0, nxpk= 0, iat= 252, 265, r1= 1.30, r2= 1.80, r3= 3.59, r4= 4.09,  &end
#
# 19 GLN   HB3   20   ASP   HN    3.85 
 &rst
  ixpk= 0, nxpk= 0, iat= 253, 265, r1= 1.30, r2= 1.80, r3= 3.85, r4= 4.35,  &end
#
# 19 GLN   HN    20   ASP   HN    3.42 
 &rst
  ixpk= 0, nxpk= 0, iat= 248, 265, r1= 1.30, r2= 1.80, r3= 3.42, r4= 3.92,  &end
#
# 18 SER   HN    18   SER   HB3   3.30 
 &rst
  ixpk= 0, nxpk= 0, iat= 237, 242, r1= 1.30, r2= 1.80, r3= 3.30, r4= 3.80,  &end
#
# 18 SER   HN    18   SER   HB2   3.30 
 &rst
  ixpk= 0, nxpk= 0, iat= 237, 241, r1= 1.30, r2= 1.80, r3= 3.30, r4= 3.80,  &end
#
# 18 SER   HB2   19   GLN   HN    3.86 
 &rst
  ixpk= 0, nxpk= 0, iat= 241, 248, r1= 1.30, r2= 1.80, r3= 3.86, r4= 4.36,  &end
#
# 18 SER   HB3   19   GLN   HN    3.86 
 &rst
  ixpk= 0, nxpk= 0, iat= 242, 248, r1= 1.30, r2= 1.80, r3= 3.86, r4= 4.36,  &end
#
# 18 SER   HN    19   GLN   HN    3.04 
 &rst
  ixpk= 0, nxpk= 0, iat= 237, 248, r1= 1.30, r2= 1.80, r3= 3.04, r4= 3.54,  &end
#
# 17 VAL   HB    18   SER   HN    4.19 
 &rst
  ixpk= 0, nxpk= 0, iat= 225, 237, r1= 1.30, r2= 1.80, r3= 4.19, r4= 4.69,  &end
#
# 17 VAL   HN    18   SER   HN    3.32 
 &rst
  ixpk= 0, nxpk= 0, iat= 221, 237, r1= 1.30, r2= 1.80, r3= 3.32, r4= 3.82,  &end
#
# 17 VAL   HN    17   VAL   HB    3.12 
 &rst
  ixpk= 0, nxpk= 0, iat= 221, 225, r1= 1.30, r2= 1.80, r3= 3.12, r4= 3.62,  &end
#
# 17 VAL   HN    17   VAL   QG1   4.16 
 &rst
  ixpk= 0, nxpk= 0, iat= 221,  -1, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50,
 igr2= 227, 228, 229,
 &end
#
# 17 VAL   HA    17   VAL   QG2   3.44 
 &rst
  ixpk= 0, nxpk= 0, iat= 223,  -1, r1= 1.30, r2= 1.80, r3= 4.13, r4= 4.63,
 igr2= 231, 232, 233,
 &end
#
# 17 VAL   HA    17   VAL   QG1   3.44 
 &rst
  ixpk= 0, nxpk= 0, iat= 223,  -1, r1= 1.30, r2= 1.80, r3= 4.13, r4= 4.63,
 igr2= 227, 228, 229,
 &end
#
# 17 VAL   HN    17   VAL   QG2   4.16 
 &rst
  ixpk= 0, nxpk= 0, iat= 221,  -1, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50,
 igr2= 231, 232, 233,
 &end
#
# 16 LYS   HN    17   VAL   HB    5.16 
 &rst
  ixpk= 0, nxpk= 0, iat= 199, 225, r1= 1.30, r2= 1.80, r3= 5.16, r4= 5.66,  &end
#
# 16 LYS   HN    16   LYS   HB3   3.56 
 &rst
  ixpk= 0, nxpk= 0, iat= 199, 204, r1= 1.30, r2= 1.80, r3= 3.56, r4= 4.06,  &end
#
# 16 LYS   HN    16   LYS   HG3   5.38 
 &rst
  ixpk= 0, nxpk= 0, iat= 199, 207, r1= 1.30, r2= 1.80, r3= 5.38, r4= 5.88,  &end
#
# 16 LYS   HN    16   LYS   HB2   3.56 
 &rst
  ixpk= 0, nxpk= 0, iat= 199, 203, r1= 1.30, r2= 1.80, r3= 3.56, r4= 4.06,  &end
#
# 16 LYS   HN    16   LYS   QD    5.50 
 &rst
  ixpk= 0, nxpk= 0, iat= 199,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2= 209, 210,
 &end
#
# 16 LYS   HN    16   LYS   HG2   5.38 
 &rst
  ixpk= 0, nxpk= 0, iat= 199, 206, r1= 1.30, r2= 1.80, r3= 5.38, r4= 5.88,  &end
#
# 15 GLY   HA2   16   LYS   HN    3.30 
 &rst
  ixpk= 0, nxpk= 0, iat= 194, 199, r1= 1.30, r2= 1.80, r3= 3.30, r4= 3.80,  &end
#
# 15 GLY   HA3   16   LYS   HN    3.30 
 &rst
  ixpk= 0, nxpk= 0, iat= 195, 199, r1= 1.30, r2= 1.80, r3= 3.30, r4= 3.80,  &end
#
# 15 GLY   HN    16   LYS   HN    4.29 
 &rst
  ixpk= 0, nxpk= 0, iat= 192, 199, r1= 1.30, r2= 1.80, r3= 4.29, r4= 4.79,  &end
#
# 14 ARG   QB    15   GLY   HN    3.58 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 192, r1= 1.30, r2= 1.80, r3= 4.02, r4= 4.52,
 igr1= 172, 173,
 &end
#
# 14 ARG   HA    15   GLY   HN    2.78 
 &rst
  ixpk= 0, nxpk= 0, iat= 170, 192, r1= 1.30, r2= 1.80, r3= 2.78, r4= 3.28,  &end
#
# 14 ARG   HN    15   GLY   HN    4.71 
 &rst
  ixpk= 0, nxpk= 0, iat= 168, 192, r1= 1.30, r2= 1.80, r3= 4.71, r4= 5.21,  &end
#
# 14 ARG   HN    14   ARG   QB    3.20 
 &rst
  ixpk= 0, nxpk= 0, iat= 168,  -1, r1= 1.30, r2= 1.80, r3= 3.59, r4= 4.09,
 igr2= 172, 173,
 &end
#
# 14 ARG   HN    14   ARG   QD    5.50 
 &rst
  ixpk= 0, nxpk= 0, iat= 168,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2= 178, 179,
 &end
#
# 14 ARG   HA    14   ARG   HG3   4.25 
 &rst
  ixpk= 0, nxpk= 0, iat= 170, 176, r1= 1.30, r2= 1.80, r3= 4.25, r4= 4.75,  &end
#
# 14 ARG   HA    14   ARG   HG2   4.25 
 &rst
  ixpk= 0, nxpk= 0, iat= 170, 175, r1= 1.30, r2= 1.80, r3= 4.25, r4= 4.75,  &end
#
# 14 ARG   QB    14   ARG   QD    3.34 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.21, r4= 4.71,
 igr1= 172, 173,
 igr2= 178, 179,
 &end
#
# 14 ARG   HN    14   ARG   HG3   4.53 
 &rst
  ixpk= 0, nxpk= 0, iat= 168, 176, r1= 1.30, r2= 1.80, r3= 4.53, r4= 5.03,  &end
#
# 14 ARG   HN    14   ARG   HG2   4.53 
 &rst
  ixpk= 0, nxpk= 0, iat= 168, 175, r1= 1.30, r2= 1.80, r3= 4.53, r4= 5.03,  &end
#
# 13 CYX   HB3   14   ARG   HN    3.68 
 &rst
  ixpk= 0, nxpk= 0, iat= 163, 168, r1= 1.30, r2= 1.80, r3= 3.68, r4= 4.18,  &end
#
# 13 CYX   HN    14   ARG   HN    4.97 
 &rst
  ixpk= 0, nxpk= 0, iat= 158, 168, r1= 1.30, r2= 1.80, r3= 4.97, r4= 5.47,  &end
#
# 13 CYX   HB2   14   ARG   HN    4.40 
 &rst
  ixpk= 0, nxpk= 0, iat= 162, 168, r1= 1.30, r2= 1.80, r3= 4.40, r4= 4.90,  &end
#
# 13 CYX   HA    14   ARG   HN    2.98 
 &rst
  ixpk= 0, nxpk= 0, iat= 160, 168, r1= 1.30, r2= 1.80, r3= 2.98, r4= 3.48,  &end
#
# 13 CYX   HN    13   CYX   HB3   4.02 
 &rst
  ixpk= 0, nxpk= 0, iat= 158, 163, r1= 1.30, r2= 1.80, r3= 4.02, r4= 4.52,  &end
#
# 13 CYX   HN    13   CYX   HB2   3.50 
 &rst
  ixpk= 0, nxpk= 0, iat= 158, 162, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#  9 CYX   HA    12   GLN   HN    3.75 
 &rst
  ixpk= 0, nxpk= 0, iat= 116, 141, r1= 1.30, r2= 1.80, r3= 3.75, r4= 4.25,  &end
#
# 12 GLN   HN    13   CYX   HN    3.17 
 &rst
  ixpk= 0, nxpk= 0, iat= 141, 158, r1= 1.30, r2= 1.80, r3= 3.17, r4= 3.67,  &end
#
# 12 GLN   HN    12   GLN   HG3   4.11 
 &rst
  ixpk= 0, nxpk= 0, iat= 141, 149, r1= 1.30, r2= 1.80, r3= 4.11, r4= 4.61,  &end
#
# 12 GLN   HN    12   GLN   HG2   4.11 
 &rst
  ixpk= 0, nxpk= 0, iat= 141, 148, r1= 1.30, r2= 1.80, r3= 4.11, r4= 4.61,  &end
#
# 11 GLY   HN    12   GLN   HN    3.17 
 &rst
  ixpk= 0, nxpk= 0, iat= 134, 141, r1= 1.30, r2= 1.80, r3= 3.17, r4= 3.67,  &end
#
#  6 LYS   HA    10   ALA   HN    4.89 
 &rst
  ixpk= 0, nxpk= 0, iat=  58, 124, r1= 1.30, r2= 1.80, r3= 4.89, r4= 5.39,  &end
#
#  7 GLU   HA    10   ALA   HN    3.66 
 &rst
  ixpk= 0, nxpk= 0, iat=  80, 124, r1= 1.30, r2= 1.80, r3= 3.66, r4= 4.16,  &end
#
# 10 ALA   HN    11   GLY   HN    3.29 
 &rst
  ixpk= 0, nxpk= 0, iat= 124, 134, r1= 1.30, r2= 1.80, r3= 3.29, r4= 3.79,  &end
#
# 10 ALA   QB    11   GLY   HN    3.56 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 134, r1= 1.30, r2= 1.80, r3= 4.28, r4= 4.78,
 igr1= 128, 129, 130,
 &end
#
#  6 LYS   HA    10   ALA   QB    5.50 
 &rst
  ixpk= 0, nxpk= 0, iat=  58,  -1, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr2= 128, 129, 130,
 &end
#
# 10 ALA   HN    10   ALA   QB    3.10 
 &rst
  ixpk= 0, nxpk= 0, iat= 124,  -1, r1= 1.30, r2= 1.80, r3= 3.72, r4= 4.22,
 igr2= 128, 129, 130,
 &end
#
#  9 CYX   HB2   10   ALA   HN    4.23 
 &rst
  ixpk= 0, nxpk= 0, iat= 118, 124, r1= 1.30, r2= 1.80, r3= 4.23, r4= 4.73,  &end
#
#  9 CYX   HB3   10   ALA   HN    4.23 
 &rst
  ixpk= 0, nxpk= 0, iat= 119, 124, r1= 1.30, r2= 1.80, r3= 4.23, r4= 4.73,  &end
#
#  9 CYX   HN    10   ALA   HN    3.53 
 &rst
  ixpk= 0, nxpk= 0, iat= 114, 124, r1= 1.30, r2= 1.80, r3= 3.53, r4= 4.03,  &end
#
#  9 CYX   HN    9    CYX   HB3   3.65 
 &rst
  ixpk= 0, nxpk= 0, iat= 114, 119, r1= 1.30, r2= 1.80, r3= 3.65, r4= 4.15,  &end
#
#  9 CYX   HN    9    CYX   HB2   3.65 
 &rst
  ixpk= 0, nxpk= 0, iat= 114, 118, r1= 1.30, r2= 1.80, r3= 3.65, r4= 4.15,  &end
#
#  8 TYR   HB2   9    CYX   HN    3.80 
 &rst
  ixpk= 0, nxpk= 0, iat=  97, 114, r1= 1.30, r2= 1.80, r3= 3.80, r4= 4.30,  &end
#
#  8 TYR   HB3   9    CYX   HN    3.28 
 &rst
  ixpk= 0, nxpk= 0, iat=  98, 114, r1= 1.30, r2= 1.80, r3= 3.28, r4= 3.78,  &end
#
#  8 TYR   HN    8    TYR   HB3   3.08 
 &rst
  ixpk= 0, nxpk= 0, iat=  93,  98, r1= 1.30, r2= 1.80, r3= 3.08, r4= 3.58,  &end
#
#  8 TYR   HN    8    TYR   HB2   3.49 
 &rst
  ixpk= 0, nxpk= 0, iat=  93,  97, r1= 1.30, r2= 1.80, r3= 3.49, r4= 3.99,  &end
#
#  8 TYR   HN    9    CYX   HN    3.37 
 &rst
  ixpk= 0, nxpk= 0, iat=  93, 114, r1= 1.30, r2= 1.80, r3= 3.37, r4= 3.87,  &end
#
#  7 GLU   HN    8    TYR   HN    3.76 
 &rst
  ixpk= 0, nxpk= 0, iat=  78,  93, r1= 1.30, r2= 1.80, r3= 3.76, r4= 4.26,  &end
#
#  7 GLU   HA    8    TYR   HA    5.01 
 &rst
  ixpk= 0, nxpk= 0, iat=  80,  95, r1= 1.30, r2= 1.80, r3= 5.01, r4= 5.51,  &end
#
#  7 GLU   QG    8    TYR   HN    4.54 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  93, r1= 1.30, r2= 1.80, r3= 5.10, r4= 5.60,
 igr1=  85,  86,
 &end
#
#  7 GLU   HN    8    TYR   HB3   5.50 
 &rst
  ixpk= 0, nxpk= 0, iat=  78,  98, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#  7 GLU   HA    7    GLU   QG    3.49 
 &rst
  ixpk= 0, nxpk= 0, iat=  80,  -1, r1= 1.30, r2= 1.80, r3= 3.92, r4= 4.42,
 igr2=  85,  86,
 &end
#
#  7 GLU   HN    7    GLU   QG    3.88 
 &rst
  ixpk= 0, nxpk= 0, iat=  78,  -1, r1= 1.30, r2= 1.80, r3= 4.36, r4= 4.86,
 igr2=  85,  86,
 &end
#
#  6 LYS   HB3   7    GLU   HN    4.07 
 &rst
  ixpk= 0, nxpk= 0, iat=  61,  78, r1= 1.30, r2= 1.80, r3= 4.07, r4= 4.57,  &end
#
#  6 LYS   HB2   7    GLU   HN    4.07 
 &rst
  ixpk= 0, nxpk= 0, iat=  60,  78, r1= 1.30, r2= 1.80, r3= 4.07, r4= 4.57,  &end
#
#  6 LYS   HN    6    LYS   HB3   3.71 
 &rst
  ixpk= 0, nxpk= 0, iat=  56,  61, r1= 1.30, r2= 1.80, r3= 3.71, r4= 4.21,  &end
#
#  6 LYS   HN    6    LYS   HB2   3.71 
 &rst
  ixpk= 0, nxpk= 0, iat=  56,  60, r1= 1.30, r2= 1.80, r3= 3.71, r4= 4.21,  &end
#
#  6 LYS   HN    6    LYS   QG    4.11 
 &rst
  ixpk= 0, nxpk= 0, iat=  56,  -1, r1= 1.30, r2= 1.80, r3= 4.61, r4= 5.11,
 igr2=  63,  64,
 &end
#
#  6 LYS   HN    6    LYS   QD    5.05 
 &rst
  ixpk= 0, nxpk= 0, iat=  56,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr2=  66,  67,
 &end
#
#  5 MET   HN    5    MET   HB3   4.01 
 &rst
  ixpk= 0, nxpk= 0, iat=  39,  44, r1= 1.30, r2= 1.80, r3= 4.01, r4= 4.51,  &end
#
#  5 MET   HN    5    MET   HG3   4.40 
 &rst
  ixpk= 0, nxpk= 0, iat=  39,  47, r1= 1.30, r2= 1.80, r3= 4.40, r4= 4.90,  &end
#
#  5 MET   HN    5    MET   HG2   4.40 
 &rst
  ixpk= 0, nxpk= 0, iat=  39,  46, r1= 1.30, r2= 1.80, r3= 4.40, r4= 4.90,  &end
#
#  5 MET   HN    5    MET   HB2   3.24 
 &rst
  ixpk= 0, nxpk= 0, iat=  39,  43, r1= 1.30, r2= 1.80, r3= 3.24, r4= 3.74,  &end
#
#  5 MET   HA    7    GLU   HN    4.50 
 &rst
  ixpk= 0, nxpk= 0, iat=  41,  78, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#  5 MET   HB3   7    GLU   HN    3.81 
 &rst
  ixpk= 0, nxpk= 0, iat=  44,  78, r1= 1.30, r2= 1.80, r3= 3.81, r4= 4.31,  &end
#
#  5 MET   HB2   6    LYS   HN    4.61 
 &rst
  ixpk= 0, nxpk= 0, iat=  43,  56, r1= 1.30, r2= 1.80, r3= 4.61, r4= 5.11,  &end
#
#  5 MET   HB3   6    LYS   HN    3.60 
 &rst
  ixpk= 0, nxpk= 0, iat=  44,  56, r1= 1.30, r2= 1.80, r3= 3.60, r4= 4.10,  &end
#
#  5 MET   HG2   6    LYS   HN    5.50 
 &rst
  ixpk= 0, nxpk= 0, iat=  46,  56, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#  5 MET   HG3   6    LYS   HN    5.50 
 &rst
  ixpk= 0, nxpk= 0, iat=  47,  56, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#  5 MET   HA    6    LYS   HN    2.97 
 &rst
  ixpk= 0, nxpk= 0, iat=  41,  56, r1= 1.30, r2= 1.80, r3= 2.97, r4= 3.47,  &end
#
#  5 MET   HN    6    LYS   HN    4.57 
 &rst
  ixpk= 0, nxpk= 0, iat=  39,  56, r1= 1.30, r2= 1.80, r3= 4.57, r4= 5.07,  &end
#
#  4 CYX   HN    4    CYX   HB3   3.70 
 &rst
  ixpk= 0, nxpk= 0, iat=  29,  34, r1= 1.30, r2= 1.80, r3= 3.70, r4= 4.20,  &end
#
#  4 CYX   HN    4    CYX   HB2   3.41 
 &rst
  ixpk= 0, nxpk= 0, iat=  29,  33, r1= 1.30, r2= 1.80, r3= 3.41, r4= 3.91,  &end
#
#  4 CYX   HB2   5    MET   HN    3.51 
 &rst
  ixpk= 0, nxpk= 0, iat=  33,  39, r1= 1.30, r2= 1.80, r3= 3.51, r4= 4.01,  &end
#
#  4 CYX   HB3   5    MET   HN    3.40 
 &rst
  ixpk= 0, nxpk= 0, iat=  34,  39, r1= 1.30, r2= 1.80, r3= 3.40, r4= 3.90,  &end
#
#  4 CYX   HN    5    MET   HN    3.10 
 &rst
  ixpk= 0, nxpk= 0, iat=  29,  39, r1= 1.30, r2= 1.80, r3= 3.10, r4= 3.60,  &end
#
#  5 MET   HN    23   LEU   HA    5.50 
 &rst
  ixpk= 0, nxpk= 0, iat=  39, 310, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
# 31 ARG   HN    31   ARG   QD    5.42 
 &rst
  ixpk= 0, nxpk= 0, iat= 441,  -1, r1= 1.30, r2= 1.80, r3= 6.08, r4= 6.58,
 igr2= 451, 452,
 &end
#
# 30 PRO   HA    31   ARG   HN    3.03 
 &rst
  ixpk= 0, nxpk= 0, iat= 437, 441, r1= 1.30, r2= 1.80, r3= 3.03, r4= 3.53,  &end
#
# 30 PRO   QB    31   ARG   HN    4.41 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 441, r1= 1.30, r2= 1.80, r3= 4.95, r4= 5.45,
 igr1= 434, 435,
 &end
#
#  4 CYX   HB2   26   CYX   HN    4.32 
 &rst
  ixpk= 0, nxpk= 0, iat=  33, 366, r1= 1.30, r2= 1.80, r3= 4.32, r4= 4.82,  &end
#
#  4 CYX   HN    26   CYX   HN    5.50 
 &rst
  ixpk= 0, nxpk= 0, iat=  29, 366, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
# 22 CYX   HA    26   CYX   HN    3.01 
 &rst
  ixpk= 0, nxpk= 0, iat= 300, 366, r1= 1.30, r2= 1.80, r3= 3.01, r4= 3.51,  &end
#
# 17 VAL   QG2   18   SER   HN    4.57 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 237, r1= 1.30, r2= 1.80, r3= 5.49, r4= 5.99,
 igr1= 231, 232, 233,
 &end
#
# 17 VAL   QG1   18   SER   HN    4.57 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 237, r1= 1.30, r2= 1.80, r3= 5.49, r4= 5.99,
 igr1= 227, 228, 229,
 &end
#
# 18 SER   HN    29   ILE   QD1   5.50 
 &rst
  ixpk= 0, nxpk= 0, iat= 237,  -1, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr2= 421, 422, 423,
 &end
#
# 18 SER   HN    29   ILE   QG2   5.09 
 &rst
  ixpk= 0, nxpk= 0, iat= 237,  -1, r1= 1.30, r2= 1.80, r3= 6.11, r4= 6.61,
 igr2= 414, 415, 416,
 &end
#
#  6 LYS   HN    23   LEU   QD1   4.31 
 &rst
  ixpk= 0, nxpk= 0, iat=  56,  -1, r1= 1.30, r2= 1.80, r3= 5.18, r4= 5.68,
 igr2= 317, 318, 319,
 &end
#
# 20 ASP   HN    23   LEU   QD2   5.50 
 &rst
  ixpk= 0, nxpk= 0, iat= 265,  -1, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr2= 321, 322, 323,
 &end
#
# 20 ASP   HN    23   LEU   HN    5.32 
 &rst
  ixpk= 0, nxpk= 0, iat= 265, 308, r1= 1.30, r2= 1.80, r3= 5.32, r4= 5.82,  &end
#
#  4 CYX   HN    23   LEU   QD1   5.50 
 &rst
  ixpk= 0, nxpk= 0, iat=  29,  -1, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr2= 317, 318, 319,
 &end
#
#  9 CYX   HN    23   LEU   QD1   5.29 
 &rst
  ixpk= 0, nxpk= 0, iat= 114,  -1, r1= 1.30, r2= 1.80, r3= 6.35, r4= 6.85,
 igr2= 317, 318, 319,
 &end
#
# 24 LYS   HN    25   HIS   HN    3.17 
 &rst
  ixpk= 0, nxpk= 0, iat= 327, 349, r1= 1.30, r2= 1.80, r3= 3.17, r4= 3.67,  &end
#
# 16 LYS   HB3   17   VAL   HN    4.01 
 &rst
  ixpk= 0, nxpk= 0, iat= 204, 221, r1= 1.30, r2= 1.80, r3= 4.01, r4= 4.51,  &end
#
# 16 LYS   HB2   17   VAL   HN    4.01 
 &rst
  ixpk= 0, nxpk= 0, iat= 203, 221, r1= 1.30, r2= 1.80, r3= 4.01, r4= 4.51,  &end
#
# 21 TYR   HN    21   TYR   QD    4.37 
 &rst
  ixpk= 0, nxpk= 0, iat= 277,  -1, r1= 1.30, r2= 1.80, r3= 4.91, r4= 5.41,
 igr2= 285, 294,
 &end
#
# 21 TYR   HA    21   TYR   QD    3.56 
 &rst
  ixpk= 0, nxpk= 0, iat= 279,  -1, r1= 1.30, r2= 1.80, r3= 4.00, r4= 4.50,
 igr2= 285, 294,
 &end
#
# 21 TYR   QE    25   HIS   HB3   4.09 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 354, r1= 1.30, r2= 1.80, r3= 4.59, r4= 5.09,
 igr1= 287, 294,
 &end
#
# 21 TYR   QD    29   ILE   QD1   3.97 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.35, r4= 5.85,
 igr1= 285, 294,
 igr2= 421, 422, 423,
 &end
#
# 21 TYR   QD    29   ILE   QG2   4.48 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.04, r4= 6.54,
 igr1= 285, 294,
 igr2= 414, 415, 416,
 &end
#
# 21 TYR   QD    29   ILE   QG1   4.25 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.35, r4= 5.85,
 igr1= 285, 294,
 igr2= 418, 419,
 &end
#
# 21 TYR   HB3   29   ILE   HN    5.00 
 &rst
  ixpk= 0, nxpk= 0, iat= 282, 408, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50,  &end
#
# 21 TYR   QD    29   ILE   HA    3.77 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 410, r1= 1.30, r2= 1.80, r3= 4.23, r4= 4.73,
 igr1= 285, 294,
 &end
#
# 21 TYR   QD    28   CYX   HA    4.33 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 400, r1= 1.30, r2= 1.80, r3= 4.86, r4= 5.36,
 igr1= 285, 294,
 &end
#
# 19 GLN   HB2   19   GLN   HE21  5.40 
 &rst
  ixpk= 0, nxpk= 0, iat= 252, 260, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,  &end
#
# 19 GLN   HN    19   GLN   HE21  5.50 
 &rst
  ixpk= 0, nxpk= 0, iat= 248, 260, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
# 10 ALA   QB    19   GLN   HE21  4.60 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 260, r1= 1.30, r2= 1.80, r3= 5.52, r4= 6.02,
 igr1= 128, 129, 130,
 &end
#
# 10 ALA   QB    19   GLN   HE22  4.83 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 261, r1= 1.30, r2= 1.80, r3= 5.80, r4= 6.30,
 igr1= 128, 129, 130,
 &end
#
#  8 TYR   HA    8    TYR   QD    3.31 
 &rst
  ixpk= 0, nxpk= 0, iat=  95,  -1, r1= 1.30, r2= 1.80, r3= 3.72, r4= 4.22,
 igr2= 101, 110,
 &end
#
#  8 TYR   HA    8    TYR   QE    4.94 
 &rst
  ixpk= 0, nxpk= 0, iat=  95,  -1, r1= 1.30, r2= 1.80, r3= 5.54, r4= 6.04,
 igr2= 103, 110,
 &end
#
#  8 TYR   QD    9    CYX   HN    4.14 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 114, r1= 1.30, r2= 1.80, r3= 4.65, r4= 5.15,
 igr1= 101, 110,
 &end
#
#  4 CYX   HB3   8    TYR   QD    3.83 
 &rst
  ixpk= 0, nxpk= 0, iat=  34,  -1, r1= 1.30, r2= 1.80, r3= 4.30, r4= 4.80,
 igr2= 101, 110,
 &end
#
#  4 CYX   HB3   8    TYR   QE    5.37 
 &rst
  ixpk= 0, nxpk= 0, iat=  34,  -1, r1= 1.30, r2= 1.80, r3= 6.03, r4= 6.53,
 igr2= 103, 110,
 &end
#
#  8 TYR   QE    12   GLN   HG2   4.77 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 148, r1= 1.30, r2= 1.80, r3= 5.35, r4= 5.85,
 igr1= 103, 110,
 &end
#
# 14 ARG   HA    19   GLN   HE21  4.20 
 &rst
  ixpk= 0, nxpk= 0, iat= 170, 260, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,  &end
#
# 14 ARG   HA    19   GLN   HE22  4.88 
 &rst
  ixpk= 0, nxpk= 0, iat= 170, 261, r1= 1.30, r2= 1.80, r3= 4.88, r4= 5.38,  &end
#
# 10 ALA   HA    19   GLN   HE21  3.94 
 &rst
  ixpk= 0, nxpk= 0, iat= 126, 260, r1= 1.30, r2= 1.80, r3= 3.94, r4= 4.44,  &end
#
# 10 ALA   HA    19   GLN   HE22  4.61 
 &rst
  ixpk= 0, nxpk= 0, iat= 126, 261, r1= 1.30, r2= 1.80, r3= 4.61, r4= 5.11,  &end
#
#  6 LYS   HA    6    LYS   QE    4.87 
 &rst
  ixpk= 0, nxpk= 0, iat=  58,  -1, r1= 1.30, r2= 1.80, r3= 5.47, r4= 5.97,
 igr2=  69,  70,
 &end
#
#  4 CYX   HB3   26   CYX   HN    5.50 
 &rst
  ixpk= 0, nxpk= 0, iat=  34, 366, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#  9 CYX   HN    10   ALA   QB    5.39 
 &rst
  ixpk= 0, nxpk= 0, iat= 114,  -1, r1= 1.30, r2= 1.80, r3= 6.47, r4= 6.97,
 igr2= 128, 129, 130,
 &end
#
# 21 TYR   QE    29   ILE   HA    4.43 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 410, r1= 1.30, r2= 1.80, r3= 4.97, r4= 5.47,
 igr1= 287, 294,
 &end
#
# 21 TYR   QE    25   HIS   HB2   4.09 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 353, r1= 1.30, r2= 1.80, r3= 4.59, r4= 5.09,
 igr1= 287, 294,
 &end
#
# 21 TYR   QE    27   LYS   QD    4.17 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.25, r4= 5.75,
 igr1= 287, 294,
 igr2= 386, 387,
 &end
#
# 21 TYR   QE    29   ILE   QG2   5.49 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.40, r4= 7.90,
 igr1= 287, 294,
 igr2= 414, 415, 416,
 &end
#
# 21 TYR   QE    29   ILE   QD1   5.42 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.31, r4= 7.81,
 igr1= 287, 294,
 igr2= 421, 422, 423,
 &end
#
# 24 LYS   HN    26   CYX   HN    4.64 
 &rst
  ixpk= 0, nxpk= 0, iat= 327, 366, r1= 1.30, r2= 1.80, r3= 4.64, r4= 5.14,  &end
#
# 15 GLY   HN    19   GLN   HE21  4.37 
 &rst
  ixpk= 0, nxpk= 0, iat= 192, 260, r1= 1.30, r2= 1.80, r3= 4.37, r4= 4.87,  &end
#
# 18 SER   HA    29   ILE   HN    3.92 
 &rst
  ixpk= 0, nxpk= 0, iat= 239, 408, r1= 1.30, r2= 1.80, r3= 3.92, r4= 4.42,  &end
#
# 18 SER   HB3   29   ILE   HN    5.09 
 &rst
  ixpk= 0, nxpk= 0, iat= 242, 408, r1= 1.30, r2= 1.80, r3= 5.09, r4= 5.59,  &end
#
# 18 SER   HB2   29   ILE   HN    5.09 
 &rst
  ixpk= 0, nxpk= 0, iat= 241, 408, r1= 1.30, r2= 1.80, r3= 5.09, r4= 5.59,  &end
#
# 20 ASP   HN    21   TYR   HB2   5.13 
 &rst
  ixpk= 0, nxpk= 0, iat= 265, 281, r1= 1.30, r2= 1.80, r3= 5.13, r4= 5.63,  &end
#
# 20 ASP   HN    21   TYR   HB3   5.13 
 &rst
  ixpk= 0, nxpk= 0, iat= 265, 282, r1= 1.30, r2= 1.80, r3= 5.13, r4= 5.63,  &end
#
# 17 VAL   HA    20   ASP   HN    4.27 
 &rst
  ixpk= 0, nxpk= 0, iat= 223, 265, r1= 1.30, r2= 1.80, r3= 4.27, r4= 4.77,  &end
#
# 16 LYS   HA    20   ASP   HN    4.71 
 &rst
  ixpk= 0, nxpk= 0, iat= 201, 265, r1= 1.30, r2= 1.80, r3= 4.71, r4= 5.21,  &end
#
# 18 SER   HA    20   ASP   HN    5.50 
 &rst
  ixpk= 0, nxpk= 0, iat= 239, 265, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#  5 MET   HN    8    TYR   HB2   5.16 
 &rst
  ixpk= 0, nxpk= 0, iat=  39,  97, r1= 1.30, r2= 1.80, r3= 5.16, r4= 5.66,  &end
#
# 19 GLN   HA    21   TYR   HN    4.86 
 &rst
  ixpk= 0, nxpk= 0, iat= 250, 277, r1= 1.30, r2= 1.80, r3= 4.86, r4= 5.36,  &end
#
# 17 VAL   HA    21   TYR   HN    5.50 
 &rst
  ixpk= 0, nxpk= 0, iat= 223, 277, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
# 18 SER   HA    21   TYR   HN    4.01 
 &rst
  ixpk= 0, nxpk= 0, iat= 239, 277, r1= 1.30, r2= 1.80, r3= 4.01, r4= 4.51,  &end
#
# 20 ASP   HA    23   LEU   HN    3.62 
 &rst
  ixpk= 0, nxpk= 0, iat= 267, 308, r1= 1.30, r2= 1.80, r3= 3.62, r4= 4.12,  &end
#
# 15 GLY   HN    19   GLN   HE22  4.71 
 &rst
  ixpk= 0, nxpk= 0, iat= 192, 261, r1= 1.30, r2= 1.80, r3= 4.71, r4= 5.21,  &end
#
# 11 GLY   HN    13   CYX   HN    4.55 
 &rst
  ixpk= 0, nxpk= 0, iat= 134, 158, r1= 1.30, r2= 1.80, r3= 4.55, r4= 5.05,  &end
#
# 16 LYS   HA    19   GLN   HB2   3.75 
 &rst
  ixpk= 0, nxpk= 0, iat= 201, 252, r1= 1.30, r2= 1.80, r3= 3.75, r4= 4.25,  &end
#
# 24 LYS   HB2   25   HIS   HD2   3.83 
 &rst
  ixpk= 0, nxpk= 0, iat= 331, 362, r1= 1.30, r2= 1.80, r3= 3.83, r4= 4.33,  &end
#
# 21 TYR   HA    25   HIS   HD2   3.95 
 &rst
  ixpk= 0, nxpk= 0, iat= 279, 362, r1= 1.30, r2= 1.80, r3= 3.95, r4= 4.45,  &end
#
#  8 TYR   QE    26   CYX   HA    5.38 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 368, r1= 1.30, r2= 1.80, r3= 6.04, r4= 6.54,
 igr1= 103, 110,
 &end
#
# 22 CYX   HA    27   LYS   HN    2.96 
 &rst
  ixpk= 0, nxpk= 0, iat= 300, 376, r1= 1.30, r2= 1.80, r3= 2.96, r4= 3.46,  &end
#
# 20 ASP   HB3   23   LEU   HN    5.50 
 &rst
  ixpk= 0, nxpk= 0, iat= 270, 308, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
# 20 ASP   HB2   23   LEU   HN    5.50 
 &rst
  ixpk= 0, nxpk= 0, iat= 269, 308, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#  6 LYS   HA    9    CYX   HN    4.48 
 &rst
  ixpk= 0, nxpk= 0, iat=  58, 114, r1= 1.30, r2= 1.80, r3= 4.48, r4= 4.98,  &end
#
# 18 SER   HA    21   TYR   QD    5.02 
 &rst
  ixpk= 0, nxpk= 0, iat= 239,  -1, r1= 1.30, r2= 1.80, r3= 5.63, r4= 6.13,
 igr2= 285, 294,
 &end
#
# 21 TYR   QE    30   PRO   QD    4.41 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.56, r4= 6.06,
 igr1= 287, 294,
 igr2= 428, 429,
 &end
#
#  8 TYR   HN    10   ALA   HN    5.45 
 &rst
  ixpk= 0, nxpk= 0, iat=  93, 124, r1= 1.30, r2= 1.80, r3= 5.45, r4= 5.95,  &end
#
# 25 HIS   HN    27   LYS   HN    4.39 
 &rst
  ixpk= 0, nxpk= 0, iat= 349, 376, r1= 1.30, r2= 1.80, r3= 4.39, r4= 4.89,  &end
#
#  3 GLY   HN    23   LEU   HG    5.50 
 &rst
  ixpk= 0, nxpk= 0, iat=  22, 315, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#  4 CYX   HN    23   LEU   HG    5.50 
 &rst
  ixpk= 0, nxpk= 0, iat=  29, 315, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
# 14 ARG   QB    19   GLN   HN    5.50 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 248, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 172, 173,
 &end
#
# 16 LYS   HN    19   GLN   HB2   5.21 
 &rst
  ixpk= 0, nxpk= 0, iat= 199, 252, r1= 1.30, r2= 1.80, r3= 5.21, r4= 5.71,  &end
#
# 24 LYS   HB2   25   HIS   HN    3.70 
 &rst
  ixpk= 0, nxpk= 0, iat= 331, 349, r1= 1.30, r2= 1.80, r3= 3.70, r4= 4.20,  &end
#
# 23 LEU   HN    24   LYS   HB2   5.10 
 &rst
  ixpk= 0, nxpk= 0, iat= 308, 331, r1= 1.30, r2= 1.80, r3= 5.10, r4= 5.60,  &end
#
# 22 CYX   HN    28   CYX   HA    5.07 
 &rst
  ixpk= 0, nxpk= 0, iat= 298, 400, r1= 1.30, r2= 1.80, r3= 5.07, r4= 5.57,  &end
#
# 13 CYX   HB3   18   SER   HB2   4.25 
 &rst
  ixpk= 0, nxpk= 0, iat= 163, 241, r1= 1.30, r2= 1.80, r3= 4.25, r4= 4.75,  &end
#
#  5 MET   HN    8    TYR   QD    4.83 
 &rst
  ixpk= 0, nxpk= 0, iat=  39,  -1, r1= 1.30, r2= 1.80, r3= 5.42, r4= 5.92,
 igr2= 101, 110,
 &end
#
#  5 MET   HN    8    TYR   HN    5.40 
 &rst
  ixpk= 0, nxpk= 0, iat=  39,  93, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,  &end
#
# 22 CYX   HN    24   LYS   HN    5.50 
 &rst
  ixpk= 0, nxpk= 0, iat= 298, 327, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#  6 LYS   HN    8    TYR   HN    5.50 
 &rst
  ixpk= 0, nxpk= 0, iat=  56,  93, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#  6 LYS   HN    9    CYX   HN    5.48 
 &rst
  ixpk= 0, nxpk= 0, iat=  56, 114, r1= 1.30, r2= 1.80, r3= 5.48, r4= 5.98,  &end
#
#  7 GLU   HN    9    CYX   HN    5.26 
 &rst
  ixpk= 0, nxpk= 0, iat=  78, 114, r1= 1.30, r2= 1.80, r3= 5.26, r4= 5.76,  &end
#
#  6 LYS   QG    7    GLU   HN    4.78 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  78, r1= 1.30, r2= 1.80, r3= 5.37, r4= 5.87,
 igr1=  63,  64,
 &end
#
# 16 LYS   HN    17   VAL   HN    3.48 
 &rst
  ixpk= 0, nxpk= 0, iat= 199, 221, r1= 1.30, r2= 1.80, r3= 3.48, r4= 3.98,  &end
#
# 10 ALA   HN    12   GLN   HN    4.97 
 &rst
  ixpk= 0, nxpk= 0, iat= 124, 141, r1= 1.30, r2= 1.80, r3= 4.97, r4= 5.47,  &end
#
#  8 TYR   QD    26   CYX   HA    5.10 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 368, r1= 1.30, r2= 1.80, r3= 5.72, r4= 6.22,
 igr1= 101, 110,
 &end
#
#  8 TYR   QE    12   GLN   HG3   4.77 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 149, r1= 1.30, r2= 1.80, r3= 5.35, r4= 5.85,
 igr1= 103, 110,
 &end
#
# 21 TYR   QD    22   CYX   HA    4.07 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 300, r1= 1.30, r2= 1.80, r3= 4.57, r4= 5.07,
 igr1= 285, 294,
 &end
#
# 13 CYX   HB3   19   GLN   HN    5.20 
 &rst
  ixpk= 0, nxpk= 0, iat= 163, 248, r1= 1.30, r2= 1.80, r3= 5.20, r4= 5.70,  &end
#
# 19 GLN   HN    22   CYX   HN    5.07 
 &rst
  ixpk= 0, nxpk= 0, iat= 248, 298, r1= 1.30, r2= 1.80, r3= 5.07, r4= 5.57,  &end
#
# 22 CYX   HA    25   HIS   HN    3.67 
 &rst
  ixpk= 0, nxpk= 0, iat= 300, 349, r1= 1.30, r2= 1.80, r3= 3.67, r4= 4.17,  &end
#
#  5 MET   HB2   9    CYX   HN    4.91 
 &rst
  ixpk= 0, nxpk= 0, iat=  43, 114, r1= 1.30, r2= 1.80, r3= 4.91, r4= 5.41,  &end
#
# 23 LEU   HB2   25   HIS   HN    5.44 
 &rst
  ixpk= 0, nxpk= 0, iat= 312, 349, r1= 1.30, r2= 1.80, r3= 5.44, r4= 5.94,  &end
#
# 23 LEU   HB3   25   HIS   HN    5.50 
 &rst
  ixpk= 0, nxpk= 0, iat= 313, 349, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
# 23 LEU   HA    25   HIS   HN    4.73 
 &rst
  ixpk= 0, nxpk= 0, iat= 310, 349, r1= 1.30, r2= 1.80, r3= 4.73, r4= 5.23,  &end
#
#  5 MET   HN    7    GLU   HN    5.50 
 &rst
  ixpk= 0, nxpk= 0, iat=  39,  78, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
# 18 SER   HN    20   ASP   HN    4.45 
 &rst
  ixpk= 0, nxpk= 0, iat= 237, 265, r1= 1.30, r2= 1.80, r3= 4.45, r4= 4.95,  &end
#
# 17 VAL   HN    19   GLN   HN    4.19 
 &rst
  ixpk= 0, nxpk= 0, iat= 221, 248, r1= 1.30, r2= 1.80, r3= 4.19, r4= 4.69,  &end
#
#  9 CYX   HN    11   GLY   HN    5.50 
 &rst
  ixpk= 0, nxpk= 0, iat= 114, 134, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
# 14 ARG   HA    19   GLN   HN    4.39 
 &rst
  ixpk= 0, nxpk= 0, iat= 170, 248, r1= 1.30, r2= 1.80, r3= 4.39, r4= 4.89,  &end
#
#  8 TYR   QD    9    CYX   HA    4.72 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 116, r1= 1.30, r2= 1.80, r3= 5.30, r4= 5.80,
 igr1= 101, 110,
 &end
#
#  8 TYR   QE    9    CYX   HA    5.50 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 116, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 103, 110,
 &end
#
# 24 LYS   HB3   25   HIS   HD2   5.43 
 &rst
  ixpk= 0, nxpk= 0, iat= 332, 362, r1= 1.30, r2= 1.80, r3= 5.43, r4= 5.93,  &end
#
# 21 TYR   QD    25   HIS   HD2   4.04 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 362, r1= 1.30, r2= 1.80, r3= 4.53, r4= 5.03,
 igr1= 285, 294,
 &end
#
# 21 TYR   QE    27   LYS   QG    4.96 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.25, r4= 6.75,
 igr1= 287, 294,
 igr2= 383, 384,
 &end
#
# 21 TYR   QD    27   LYS   QD    5.39 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.79, r4= 7.29,
 igr1= 285, 294,
 igr2= 386, 387,
 &end
#
# 21 TYR   QD    29   ILE   HB    4.04 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 412, r1= 1.30, r2= 1.80, r3= 4.53, r4= 5.03,
 igr1= 285, 294,
 &end
#
# 13 CYX   HB3   18   SER   HB3   4.25 
 &rst
  ixpk= 0, nxpk= 0, iat= 163, 242, r1= 1.30, r2= 1.80, r3= 4.25, r4= 4.75,  &end
#
# 29 ILE   QG1   30   PRO   QD    5.10 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.43, r4= 6.93,
 igr1= 418, 419,
 igr2= 428, 429,
 &end
#
# 29 ILE   QG2   30   PRO   QD    4.51 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.08, r4= 6.58,
 igr1= 414, 415, 416,
 igr2= 428, 429,
 &end
#
# 31 ARG   HA    31   ARG   QD    4.44 
 &rst
  ixpk= 0, nxpk= 0, iat= 443,  -1, r1= 1.30, r2= 1.80, r3= 4.98, r4= 5.48,
 igr2= 451, 452,
 &end
#
# 18 SER   HA    22   CYX   HN    4.68 
 &rst
  ixpk= 0, nxpk= 0, iat= 239, 298, r1= 1.30, r2= 1.80, r3= 4.68, r4= 5.18,  &end
#
# 20 ASP   HA    23   LEU   HB3   4.38 
 &rst
  ixpk= 0, nxpk= 0, iat= 267, 313, r1= 1.30, r2= 1.80, r3= 4.38, r4= 4.88,  &end
#
#  6 LYS   HA    8    TYR   HB3   5.50 
 &rst
  ixpk= 0, nxpk= 0, iat=  58,  98, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
# 29 ILE   QD1   30   PRO   QD    4.91 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.62, r4= 7.12,
 igr1= 421, 422, 423,
 igr2= 428, 429,
 &end
#
# 21 TYR   HB2   29   ILE   QD1   4.36 
 &rst
  ixpk= 0, nxpk= 0, iat= 281,  -1, r1= 1.30, r2= 1.80, r3= 5.24, r4= 5.74,
 igr2= 421, 422, 423,
 &end
#
# 18 SER   HA    29   ILE   QG2   3.77 
 &rst
  ixpk= 0, nxpk= 0, iat= 239,  -1, r1= 1.30, r2= 1.80, r3= 4.53, r4= 5.03,
 igr2= 414, 415, 416,
 &end
#
# 18 SER   HA    29   ILE   QD1   4.00 
 &rst
  ixpk= 0, nxpk= 0, iat= 239,  -1, r1= 1.30, r2= 1.80, r3= 4.80, r4= 5.30,
 igr2= 421, 422, 423,
 &end
#
# 21 TYR   HN    29   ILE   QD1   5.50 
 &rst
  ixpk= 0, nxpk= 0, iat= 277,  -1, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr2= 421, 422, 423,
 &end
#
#  5 MET   HA    23   LEU   QD1   4.96 
 &rst
  ixpk= 0, nxpk= 0, iat=  41,  -1, r1= 1.30, r2= 1.80, r3= 5.96, r4= 6.46,
 igr2= 317, 318, 319,
 &end
#
# 22 CYX   HA    23   LEU   QD1   5.34 
 &rst
  ixpk= 0, nxpk= 0, iat= 300,  -1, r1= 1.30, r2= 1.80, r3= 6.41, r4= 6.91,
 igr2= 317, 318, 319,
 &end
#
#  6 LYS   HA    23   LEU   QD1   3.35 
 &rst
  ixpk= 0, nxpk= 0, iat=  58,  -1, r1= 1.30, r2= 1.80, r3= 4.02, r4= 4.52,
 igr2= 317, 318, 319,
 &end
#
# 21 TYR   HB3   29   ILE   QD1   4.36 
 &rst
  ixpk= 0, nxpk= 0, iat= 282,  -1, r1= 1.30, r2= 1.80, r3= 5.24, r4= 5.74,
 igr2= 421, 422, 423,
 &end
#
# 20 ASP   HA    23   LEU   QD2   3.47 
 &rst
  ixpk= 0, nxpk= 0, iat= 267,  -1, r1= 1.30, r2= 1.80, r3= 4.17, r4= 4.67,
 igr2= 321, 322, 323,
 &end
#
# 18 SER   HA    29   ILE   QG1   4.13 
 &rst
  ixpk= 0, nxpk= 0, iat= 239,  -1, r1= 1.30, r2= 1.80, r3= 4.64, r4= 5.14,
 igr2= 418, 419,
 &end
#
# 24 LYS   HA    26   CYX   HN    5.50 
 &rst
  ixpk= 0, nxpk= 0, iat= 329, 366, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
# 23 LEU   HA    26   CYX   HN    5.33 
 &rst
  ixpk= 0, nxpk= 0, iat= 310, 366, r1= 1.30, r2= 1.80, r3= 5.33, r4= 5.83,  &end
#
#  3 GLY   HA2   26   CYX   HN    5.50 
 &rst
  ixpk= 0, nxpk= 0, iat=  24, 366, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
# 24 LYS   HB2   26   CYX   HN    5.50 
 &rst
  ixpk= 0, nxpk= 0, iat= 331, 366, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
# 20 ASP   HN    23   LEU   QD1   5.50 
 &rst
  ixpk= 0, nxpk= 0, iat= 265,  -1, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr2= 317, 318, 319,
 &end
#
#  5 MET   HN    23   LEU   QD1   5.50 
 &rst
  ixpk= 0, nxpk= 0, iat=  39,  -1, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr2= 317, 318, 319,
 &end
#
# 22 CYX   HN    29   ILE   QD1   5.50 
 &rst
  ixpk= 0, nxpk= 0, iat= 298,  -1, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr2= 421, 422, 423,
 &end
#
# 22 CYX   HN    29   ILE   QG2   5.50 
 &rst
  ixpk= 0, nxpk= 0, iat= 298,  -1, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr2= 414, 415, 416,
 &end
#
#  6 LYS   HN    23   LEU   QD2   5.50 
 &rst
  ixpk= 0, nxpk= 0, iat=  56,  -1, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr2= 321, 322, 323,
 &end
#
# 17 VAL   QG1   19   GLN   HN    5.50 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 248, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr1= 227, 228, 229,
 &end
#
# 17 VAL   QG2   19   GLN   HN    5.50 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 248, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr1= 231, 232, 233,
 &end
#
# 22 CYX   HN    23   LEU   QD2   5.50 
 &rst
  ixpk= 0, nxpk= 0, iat= 298,  -1, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr2= 321, 322, 323,
 &end
#
# 23 LEU   QD2   24   LYS   HN    5.29 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 327, r1= 1.30, r2= 1.80, r3= 6.35, r4= 6.85,
 igr1= 321, 322, 323,
 &end
#
# 23 LEU   QD1   24   LYS   HN    5.50 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 327, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr1= 317, 318, 319,
 &end
#
# 21 TYR   QE    29   ILE   QG1   5.27 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.64, r4= 7.14,
 igr1= 287, 294,
 igr2= 418, 419,
 &end
#
# 21 TYR   HN    29   ILE   QG2   5.50 
 &rst
  ixpk= 0, nxpk= 0, iat= 277,  -1, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr2= 414, 415, 416,
 &end
#
#  9 CYX   HN    12   GLN   HN    5.50 
 &rst
  ixpk= 0, nxpk= 0, iat= 114, 141, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#  9 CYX   HB2   23   LEU   QD1   4.40 
 &rst
  ixpk= 0, nxpk= 0, iat= 118,  -1, r1= 1.30, r2= 1.80, r3= 5.28, r4= 5.78,
 igr2= 317, 318, 319,
 &end
#
#  9 CYX   HB3   23   LEU   QD1   4.40 
 &rst
  ixpk= 0, nxpk= 0, iat= 119,  -1, r1= 1.30, r2= 1.80, r3= 5.28, r4= 5.78,
 igr2= 317, 318, 319,
 &end
#
# 29 ILE   HB    30   PRO   QD    4.93 
 &rst
  ixpk= 0, nxpk= 0, iat= 412,  -1, r1= 1.30, r2= 1.80, r3= 5.53, r4= 6.03,
 igr2= 428, 429,
 &end
#
# 13 CYX   HA    14   ARG   QB    5.15 
 &rst
  ixpk= 0, nxpk= 0, iat= 160,  -1, r1= 1.30, r2= 1.80, r3= 5.78, r4= 6.28,
 igr2= 172, 173,
 &end
#
# 18 SER   HA    29   ILE   HB    5.26 
 &rst
  ixpk= 0, nxpk= 0, iat= 239, 412, r1= 1.30, r2= 1.80, r3= 5.26, r4= 5.76,  &end
#
#  4 CYX   HN    26   CYX   QB    5.34 
 &rst
  ixpk= 0, nxpk= 0, iat=  29,  -1, r1= 1.30, r2= 1.80, r3= 5.99, r4= 6.49,
 igr2= 370, 371,
 &end
#
#  4 CYX   HB2   26   CYX   QB    3.51 
 &rst
  ixpk= 0, nxpk= 0, iat=  33,  -1, r1= 1.30, r2= 1.80, r3= 3.94, r4= 4.44,
 igr2= 370, 371,
 &end
#
#  5 MET   HA    5    MET   QG    3.74 
 &rst
  ixpk= 0, nxpk= 0, iat=  41,  -1, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
 igr2=  46,  47,
 &end
#
#  5 MET   QG    6    LYS   HN    4.72 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  56, r1= 1.30, r2= 1.80, r3= 5.30, r4= 5.80,
 igr1=  46,  47,
 &end
#
#  6 LYS   HN    6    LYS   QB    3.15 
 &rst
  ixpk= 0, nxpk= 0, iat=  56,  -1, r1= 1.30, r2= 1.80, r3= 3.54, r4= 4.04,
 igr2=  60,  61,
 &end
#
#  6 LYS   HA    9    CYX   QB    5.00 
 &rst
  ixpk= 0, nxpk= 0, iat=  58,  -1, r1= 1.30, r2= 1.80, r3= 5.61, r4= 6.11,
 igr2= 118, 119,
 &end
#
#  7 GLU   HN    7    GLU   QB    3.14 
 &rst
  ixpk= 0, nxpk= 0, iat=  78,  -1, r1= 1.30, r2= 1.80, r3= 3.52, r4= 4.02,
 igr2=  82,  83,
 &end
#
#  7 GLU   QB    8    TYR   HN    3.46 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  93, r1= 1.30, r2= 1.80, r3= 3.88, r4= 4.38,
 igr1=  82,  83,
 &end
#
#  7 GLU   QB    8    TYR   QD    5.34 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.73, r4= 7.23,
 igr1=  82,  83,
 igr2= 101, 110,
 &end
#
#  8 TYR   HN    9    CYX   QB    5.34 
 &rst
  ixpk= 0, nxpk= 0, iat=  93,  -1, r1= 1.30, r2= 1.80, r3= 5.99, r4= 6.49,
 igr2= 118, 119,
 &end
#
#  8 TYR   QD    9    CYX   QB    5.18 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.53, r4= 7.03,
 igr1= 101, 110,
 igr2= 118, 119,
 &end
#
#  8 TYR   QD    12   GLN   QB    5.26 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.63, r4= 7.13,
 igr1= 101, 110,
 igr2= 145, 146,
 &end
#
#  8 TYR   QD    12   GLN   QG    4.58 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.77, r4= 6.27,
 igr1= 101, 110,
 igr2= 148, 149,
 &end
#
#  8 TYR   QE    12   GLN   QB    5.34 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.73, r4= 7.23,
 igr1= 103, 110,
 igr2= 145, 146,
 &end
#
#  8 TYR   QE    26   CYX   QB    5.34 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.73, r4= 7.23,
 igr1= 103, 110,
 igr2= 370, 371,
 &end
#
#  9 CYX   HN    9    CYX   QB    3.10 
 &rst
  ixpk= 0, nxpk= 0, iat= 114,  -1, r1= 1.30, r2= 1.80, r3= 3.48, r4= 3.98,
 igr2= 118, 119,
 &end
#
#  9 CYX   QB    10   ALA   HN    3.40 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 124, r1= 1.30, r2= 1.80, r3= 3.82, r4= 4.32,
 igr1= 118, 119,
 &end
#
#  9 CYX   QB    22   CYX   QB    2.82 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 3.55, r4= 4.05,
 igr1= 118, 119,
 igr2= 302, 303,
 &end
#
#  9 CYX   QB    23   LEU   QD1   3.84 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.18, r4= 5.68,
 igr1= 118, 119,
 igr2= 317, 318, 319,
 &end
#
# 10 ALA   HA    19   GLN   QG    4.48 
 &rst
  ixpk= 0, nxpk= 0, iat= 126,  -1, r1= 1.30, r2= 1.80, r3= 5.03, r4= 5.53,
 igr2= 255, 256,
 &end
#
# 10 ALA   QB    11   GLY   QA    5.34 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.20, r4= 7.70,
 igr1= 128, 129, 130,
 igr2= 136, 137,
 &end
#
# 12 GLN   HN    12   GLN   QB    3.32 
 &rst
  ixpk= 0, nxpk= 0, iat= 141,  -1, r1= 1.30, r2= 1.80, r3= 3.73, r4= 4.23,
 igr2= 145, 146,
 &end
#
# 12 GLN   HN    12   GLN   QG    3.43 
 &rst
  ixpk= 0, nxpk= 0, iat= 141,  -1, r1= 1.30, r2= 1.80, r3= 3.85, r4= 4.35,
 igr2= 148, 149,
 &end
#
# 12 GLN   HA    12   GLN   QG    3.11 
 &rst
  ixpk= 0, nxpk= 0, iat= 143,  -1, r1= 1.30, r2= 1.80, r3= 3.49, r4= 3.99,
 igr2= 148, 149,
 &end
#
# 12 GLN   QB    13   CYX   HN    3.92 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 158, r1= 1.30, r2= 1.80, r3= 4.40, r4= 4.90,
 igr1= 145, 146,
 &end
#
# 12 GLN   QG    13   CYX   HN    4.23 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 158, r1= 1.30, r2= 1.80, r3= 4.75, r4= 5.25,
 igr1= 148, 149,
 &end
#
# 13 CYX   HN    14   ARG   QG    5.27 
 &rst
  ixpk= 0, nxpk= 0, iat= 158,  -1, r1= 1.30, r2= 1.80, r3= 5.92, r4= 6.42,
 igr2= 175, 176,
 &end
#
# 13 CYX   HN    19   GLN   QG    5.34 
 &rst
  ixpk= 0, nxpk= 0, iat= 158,  -1, r1= 1.30, r2= 1.80, r3= 5.99, r4= 6.49,
 igr2= 255, 256,
 &end
#
# 13 CYX   HB3   19   GLN   QG    4.91 
 &rst
  ixpk= 0, nxpk= 0, iat= 163,  -1, r1= 1.30, r2= 1.80, r3= 5.51, r4= 6.01,
 igr2= 255, 256,
 &end
#
# 14 ARG   HN    14   ARG   QG    3.96 
 &rst
  ixpk= 0, nxpk= 0, iat= 168,  -1, r1= 1.30, r2= 1.80, r3= 4.44, r4= 4.94,
 igr2= 175, 176,
 &end
#
# 14 ARG   HN    18   SER   QB    4.19 
 &rst
  ixpk= 0, nxpk= 0, iat= 168,  -1, r1= 1.30, r2= 1.80, r3= 4.70, r4= 5.20,
 igr2= 241, 242,
 &end
#
# 14 ARG   HA    14   ARG   QG    3.66 
 &rst
  ixpk= 0, nxpk= 0, iat= 170,  -1, r1= 1.30, r2= 1.80, r3= 4.11, r4= 4.61,
 igr2= 175, 176,
 &end
#
# 14 ARG   QB    14   ARG   QG    2.39 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 3.01, r4= 3.51,
 igr1= 172, 173,
 igr2= 175, 176,
 &end
#
# 15 GLY   HN    19   GLN   QG    5.13 
 &rst
  ixpk= 0, nxpk= 0, iat= 192,  -1, r1= 1.30, r2= 1.80, r3= 5.76, r4= 6.26,
 igr2= 255, 256,
 &end
#
# 15 GLY   QA    16   LYS   HN    2.83 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 199, r1= 1.30, r2= 1.80, r3= 3.18, r4= 3.68,
 igr1= 194, 195,
 &end
#
# 15 GLY   QA    17   VAL   HN    4.10 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 221, r1= 1.30, r2= 1.80, r3= 4.60, r4= 5.10,
 igr1= 194, 195,
 &end
#
# 15 GLY   QA    18   SER   QB    4.24 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.34, r4= 5.84,
 igr1= 194, 195,
 igr2= 241, 242,
 &end
#
# 16 LYS   HN    16   LYS   QB    3.01 
 &rst
  ixpk= 0, nxpk= 0, iat= 199,  -1, r1= 1.30, r2= 1.80, r3= 3.38, r4= 3.88,
 igr2= 203, 204,
 &end
#
# 16 LYS   HN    16   LYS   QG    4.57 
 &rst
  ixpk= 0, nxpk= 0, iat= 199,  -1, r1= 1.30, r2= 1.80, r3= 5.13, r4= 5.63,
 igr2= 206, 207,
 &end
#
# 16 LYS   HN    17   VAL   QQG   5.39 
 &rst
  ixpk= 0, nxpk= 0, iat= 199, 224, r1= 1.30, r2= 1.80, r3= 5.39, r4= 5.89,  &end
#
# 16 LYS   HA    19   GLN   QG    5.34 
 &rst
  ixpk= 0, nxpk= 0, iat= 201,  -1, r1= 1.30, r2= 1.80, r3= 5.99, r4= 6.49,
 igr2= 255, 256,
 &end
#
# 16 LYS   QB    17   VAL   HN    3.44 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 221, r1= 1.30, r2= 1.80, r3= 3.86, r4= 4.36,
 igr1= 203, 204,
 &end
#
# 16 LYS   QB    18   SER   HN    5.34 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 237, r1= 1.30, r2= 1.80, r3= 5.99, r4= 6.49,
 igr1= 203, 204,
 &end
#
# 17 VAL   HN    17   VAL   QQG   3.20 
 &rst
  ixpk= 0, nxpk= 0, iat= 221, 224, r1= 1.30, r2= 1.80, r3= 3.20, r4= 3.70,  &end
#
# 17 VAL   HN    18   SER   QB    4.92 
 &rst
  ixpk= 0, nxpk= 0, iat= 221,  -1, r1= 1.30, r2= 1.80, r3= 5.52, r4= 6.02,
 igr2= 241, 242,
 &end
#
# 17 VAL   HA    17   VAL   QQG   2.99 
 &rst
  ixpk= 0, nxpk= 0, iat= 223, 224, r1= 1.30, r2= 1.80, r3= 2.99, r4= 3.49,  &end
#
# 17 VAL   HA    20   ASP   QB    4.50 
 &rst
  ixpk= 0, nxpk= 0, iat= 223,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2= 269, 270,
 &end
#
# 17 VAL   QQG   18   SER   HN    3.95 
 &rst
  ixpk= 0, nxpk= 0, iat= 224, 237, r1= 1.30, r2= 1.80, r3= 3.95, r4= 4.45,  &end
#
# 17 VAL   QQG   20   ASP   HN    5.44 
 &rst
  ixpk= 0, nxpk= 0, iat= 224, 265, r1= 1.30, r2= 1.80, r3= 5.44, r4= 5.94,  &end
#
# 17 VAL   QQG   21   TYR   HN    4.94 
 &rst
  ixpk= 0, nxpk= 0, iat= 224, 277, r1= 1.30, r2= 1.80, r3= 4.94, r4= 5.44,  &end
#
# 18 SER   HA    21   TYR   QB    4.00 
 &rst
  ixpk= 0, nxpk= 0, iat= 239,  -1, r1= 1.30, r2= 1.80, r3= 4.49, r4= 4.99,
 igr2= 281, 282,
 &end
#
# 18 SER   QB    19   GLN   HN    3.11 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 248, r1= 1.30, r2= 1.80, r3= 3.49, r4= 3.99,
 igr1= 241, 242,
 &end
#
# 18 SER   QB    29   ILE   HN    4.43 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 408, r1= 1.30, r2= 1.80, r3= 4.97, r4= 5.47,
 igr1= 241, 242,
 &end
#
# 18 SER   QB    29   ILE   HB    5.34 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 412, r1= 1.30, r2= 1.80, r3= 5.99, r4= 6.49,
 igr1= 241, 242,
 &end
#
# 18 SER   QB    29   ILE   QG2   3.97 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.35, r4= 5.85,
 igr1= 241, 242,
 igr2= 414, 415, 416,
 &end
#
# 18 SER   QB    29   ILE   QD1   5.02 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.77, r4= 7.27,
 igr1= 241, 242,
 igr2= 421, 422, 423,
 &end
#
# 19 GLN   HN    19   GLN   QG    3.40 
 &rst
  ixpk= 0, nxpk= 0, iat= 248,  -1, r1= 1.30, r2= 1.80, r3= 3.82, r4= 4.32,
 igr2= 255, 256,
 &end
#
# 19 GLN   QG    20   ASP   HN    4.67 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 265, r1= 1.30, r2= 1.80, r3= 5.24, r4= 5.74,
 igr1= 255, 256,
 &end
#
# 20 ASP   HN    20   ASP   QB    3.05 
 &rst
  ixpk= 0, nxpk= 0, iat= 265,  -1, r1= 1.30, r2= 1.80, r3= 3.42, r4= 3.92,
 igr2= 269, 270,
 &end
#
# 20 ASP   QB    21   TYR   HN    3.33 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 277, r1= 1.30, r2= 1.80, r3= 3.74, r4= 4.24,
 igr1= 269, 270,
 &end
#
# 20 ASP   QB    23   LEU   QD2   4.57 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.16, r4= 6.66,
 igr1= 269, 270,
 igr2= 321, 322, 323,
 &end
#
# 21 TYR   HN    21   TYR   QB    2.83 
 &rst
  ixpk= 0, nxpk= 0, iat= 277,  -1, r1= 1.30, r2= 1.80, r3= 3.18, r4= 3.68,
 igr2= 281, 282,
 &end
#
# 21 TYR   QB    22   CYX   HN    3.25 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 298, r1= 1.30, r2= 1.80, r3= 3.65, r4= 4.15,
 igr1= 281, 282,
 &end
#
# 21 TYR   QB    25   HIS   HD2   5.34 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 362, r1= 1.30, r2= 1.80, r3= 5.99, r4= 6.49,
 igr1= 281, 282,
 &end
#
# 21 TYR   QB    29   ILE   HA    3.97 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 410, r1= 1.30, r2= 1.80, r3= 4.46, r4= 4.96,
 igr1= 281, 282,
 &end
#
# 21 TYR   QB    29   ILE   HB    3.65 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 412, r1= 1.30, r2= 1.80, r3= 4.10, r4= 4.60,
 igr1= 281, 282,
 &end
#
# 21 TYR   QB    29   ILE   QG2   3.83 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.16, r4= 5.66,
 igr1= 281, 282,
 igr2= 414, 415, 416,
 &end
#
# 21 TYR   QB    29   ILE   QG1   3.99 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.03, r4= 5.53,
 igr1= 281, 282,
 igr2= 418, 419,
 &end
#
# 21 TYR   QB    29   ILE   QD1   3.54 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.77, r4= 5.27,
 igr1= 281, 282,
 igr2= 421, 422, 423,
 &end
#
# 21 TYR   QD    25   HIS   QB    3.81 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.80, r4= 5.30,
 igr1= 285, 294,
 igr2= 353, 354,
 &end
#
# 21 TYR   QD    27   LYS   QB    4.98 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.27, r4= 6.77,
 igr1= 285, 294,
 igr2= 380, 381,
 &end
#
# 21 TYR   QE    25   HIS   QB    3.56 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.49, r4= 4.99,
 igr1= 287, 294,
 igr2= 353, 354,
 &end
#
# 21 TYR   QE    27   LYS   QB    4.52 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.69, r4= 6.19,
 igr1= 287, 294,
 igr2= 380, 381,
 &end
#
# 22 CYX   HN    22   CYX   QB    2.89 
 &rst
  ixpk= 0, nxpk= 0, iat= 298,  -1, r1= 1.30, r2= 1.80, r3= 3.24, r4= 3.74,
 igr2= 302, 303,
 &end
#
# 22 CYX   HA    25   HIS   QB    4.68 
 &rst
  ixpk= 0, nxpk= 0, iat= 300,  -1, r1= 1.30, r2= 1.80, r3= 5.25, r4= 5.75,
 igr2= 353, 354,
 &end
#
# 22 CYX   QB    23   LEU   HN    3.60 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 308, r1= 1.30, r2= 1.80, r3= 4.04, r4= 4.54,
 igr1= 302, 303,
 &end
#
# 22 CYX   QB    27   LYS   HN    4.09 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 376, r1= 1.30, r2= 1.80, r3= 4.59, r4= 5.09,
 igr1= 302, 303,
 &end
#
# 24 LYS   HN    24   LYS   QG    3.51 
 &rst
  ixpk= 0, nxpk= 0, iat= 327,  -1, r1= 1.30, r2= 1.80, r3= 3.94, r4= 4.44,
 igr2= 334, 335,
 &end
#
# 24 LYS   HA    24   LYS   QG    3.44 
 &rst
  ixpk= 0, nxpk= 0, iat= 329,  -1, r1= 1.30, r2= 1.80, r3= 3.86, r4= 4.36,
 igr2= 334, 335,
 &end
#
# 24 LYS   QG    25   HIS   HN    4.28 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 349, r1= 1.30, r2= 1.80, r3= 4.80, r4= 5.30,
 igr1= 334, 335,
 &end
#
# 24 LYS   QG    25   HIS   HD2   4.26 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 362, r1= 1.30, r2= 1.80, r3= 4.78, r4= 5.28,
 igr1= 334, 335,
 &end
#
# 25 HIS   HN    25   HIS   QB    3.20 
 &rst
  ixpk= 0, nxpk= 0, iat= 349,  -1, r1= 1.30, r2= 1.80, r3= 3.59, r4= 4.09,
 igr2= 353, 354,
 &end
#
# 25 HIS   QB    25   HIS   HD2   3.48 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 362, r1= 1.30, r2= 1.80, r3= 3.91, r4= 4.41,
 igr1= 353, 354,
 &end
#
# 25 HIS   QB    26   CYX   HN    4.00 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 366, r1= 1.30, r2= 1.80, r3= 4.49, r4= 4.99,
 igr1= 353, 354,
 &end
#
# 25 HIS   QB    27   LYS   HN    3.73 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 376, r1= 1.30, r2= 1.80, r3= 4.19, r4= 4.69,
 igr1= 353, 354,
 &end
#
# 27 LYS   HN    27   LYS   QB    3.61 
 &rst
  ixpk= 0, nxpk= 0, iat= 376,  -1, r1= 1.30, r2= 1.80, r3= 4.05, r4= 4.55,
 igr2= 380, 381,
 &end
#
# 27 LYS   QB    27   LYS   QD    3.28 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.13, r4= 4.63,
 igr1= 380, 381,
 igr2= 386, 387,
 &end
#
# 27 LYS   QB    27   LYS   QE    4.66 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.87, r4= 6.37,
 igr1= 380, 381,
 igr2= 389, 390,
 &end
#
# 31 ARG   HN    31   ARG   QB    3.46 
 &rst
  ixpk= 0, nxpk= 0, iat= 441,  -1, r1= 1.30, r2= 1.80, r3= 3.88, r4= 4.38,
 igr2= 445, 446,
 &end
#
# 31 ARG   HN    31   ARG   QG    3.68 
 &rst
  ixpk= 0, nxpk= 0, iat= 441,  -1, r1= 1.30, r2= 1.80, r3= 4.13, r4= 4.63,
 igr2= 448, 449,
 &end
# 464 atoms read from pdb file ts16.amb.pdb.
# 2 SER PHI:  (1 GLY C)-(2 SER N)-(2 SER CA)-(2 SER C) -175.0  75.0
 &rst     iat =     8,    10,    12,    19,
   r1 = -176.0, r2 = -175.0, r3 =  75.0, r4 =  76.0,
   rk2 =   2.0, rk3 =   2.0,    &end

# 2 SER PSI:  (2 SER N)-(2 SER CA)-(2 SER C)-(3 GLY N) -75.0 185.0
 &rst     iat =    10,    12,    19,    21,
   r1 = -76.0, r2 = -75.0, r3 = 185.0, r4 = 186.0,
 &end

# 2 SER PHI:  (1 GLY C)-(2 SER N)-(2 SER CA)-(2 SER C) -255.0 -25.0
 &rst     iat =     8,    10,    12,    19,
   r1 = -256.0, r2 = -255.0, r3 = -25.0, r4 = -24.0,
 &end

# 2 SER PSI:  (2 SER N)-(2 SER CA)-(2 SER C)-(3 GLY N)  25.0  55.0
 &rst     iat =    10,    12,    19,    21,
   r1 =  24.0, r2 =  25.0, r3 =  55.0, r4 =  56.0,
 &end

# 2 SER PHI:  (1 GLY C)-(2 SER N)-(2 SER CA)-(2 SER C) -135.0  75.0
 &rst     iat =     8,    10,    12,    19,
   r1 = -136.0, r2 = -135.0, r3 =  75.0, r4 =  76.0,
 &end

# 2 SER PSI:  (2 SER N)-(2 SER CA)-(2 SER C)-(3 GLY N) 105.0 185.0
 &rst     iat =    10,    12,    19,    21,
   r1 = 104.0, r2 = 105.0, r3 = 185.0, r4 = 186.0,
 &end

# 4 CYS PHI:  (3 GLY C)-(4 CYX N)-(4 CYX CA)-(4 CYX C) -175.0  75.0
 &rst     iat =    26,    28,    30,    36,
   r1 = -176.0, r2 = -175.0, r3 =  75.0, r4 =  76.0,
 &end

# 4 CYS PSI:  (4 CYX N)-(4 CYX CA)-(4 CYX C)-(5 MET N) -75.0 185.0
 &rst     iat =    28,    30,    36,    38,
   r1 = -76.0, r2 = -75.0, r3 = 185.0, r4 = 186.0,
 &end

# 4 CYS PHI:  (3 GLY C)-(4 CYX N)-(4 CYX CA)-(4 CYX C) -255.0 -25.0
 &rst     iat =    26,    28,    30,    36,
   r1 = -256.0, r2 = -255.0, r3 = -25.0, r4 = -24.0,
 &end

# 4 CYS PSI:  (4 CYX N)-(4 CYX CA)-(4 CYX C)-(5 MET N)  25.0  55.0
 &rst     iat =    28,    30,    36,    38,
   r1 =  24.0, r2 =  25.0, r3 =  55.0, r4 =  56.0,
 &end

# 4 CYS PHI:  (3 GLY C)-(4 CYX N)-(4 CYX CA)-(4 CYX C) -135.0  75.0
 &rst     iat =    26,    28,    30,    36,
   r1 = -136.0, r2 = -135.0, r3 =  75.0, r4 =  76.0,
 &end

# 4 CYS PSI:  (4 CYX N)-(4 CYX CA)-(4 CYX C)-(5 MET N) 105.0 185.0
 &rst     iat =    28,    30,    36,    38,
   r1 = 104.0, r2 = 105.0, r3 = 185.0, r4 = 186.0,
 &end

# 5 MET PHI:  (4 CYX C)-(5 MET N)-(5 MET CA)-(5 MET C) -175.0  75.0
 &rst     iat =    36,    38,    40,    53,
   r1 = -176.0, r2 = -175.0, r3 =  75.0, r4 =  76.0,
 &end

# 5 MET PSI:  (5 MET N)-(5 MET CA)-(5 MET C)-(6 LYS N) -75.0 185.0
 &rst     iat =    38,    40,    53,    55,
   r1 = -76.0, r2 = -75.0, r3 = 185.0, r4 = 186.0,
 &end

# 5 MET PHI:  (4 CYX C)-(5 MET N)-(5 MET CA)-(5 MET C) -255.0 -25.0
 &rst     iat =    36,    38,    40,    53,
   r1 = -256.0, r2 = -255.0, r3 = -25.0, r4 = -24.0,
 &end

# 5 MET PSI:  (5 MET N)-(5 MET CA)-(5 MET C)-(6 LYS N)  25.0  55.0
 &rst     iat =    38,    40,    53,    55,
   r1 =  24.0, r2 =  25.0, r3 =  55.0, r4 =  56.0,
 &end

# 5 MET PHI:  (4 CYX C)-(5 MET N)-(5 MET CA)-(5 MET C) -135.0  75.0
 &rst     iat =    36,    38,    40,    53,
   r1 = -136.0, r2 = -135.0, r3 =  75.0, r4 =  76.0,
 &end

# 5 MET PSI:  (5 MET N)-(5 MET CA)-(5 MET C)-(6 LYS N) 105.0 185.0
 &rst     iat =    38,    40,    53,    55,
   r1 = 104.0, r2 = 105.0, r3 = 185.0, r4 = 186.0,
 &end

# 6 LYS PHI:  (5 MET C)-(6 LYS N)-(6 LYS CA)-(6 LYS C) -175.0  75.0
 &rst     iat =    53,    55,    57,    75,
   r1 = -176.0, r2 = -175.0, r3 =  75.0, r4 =  76.0,
 &end

# 6 LYS PSI:  (6 LYS N)-(6 LYS CA)-(6 LYS C)-(7 GLU N) -75.0 185.0
 &rst     iat =    55,    57,    75,    77,
   r1 = -76.0, r2 = -75.0, r3 = 185.0, r4 = 186.0,
 &end

# 6 LYS PHI:  (5 MET C)-(6 LYS N)-(6 LYS CA)-(6 LYS C) -255.0 -25.0
 &rst     iat =    53,    55,    57,    75,
   r1 = -256.0, r2 = -255.0, r3 = -25.0, r4 = -24.0,
 &end

# 6 LYS PSI:  (6 LYS N)-(6 LYS CA)-(6 LYS C)-(7 GLU N)  25.0  55.0
 &rst     iat =    55,    57,    75,    77,
   r1 =  24.0, r2 =  25.0, r3 =  55.0, r4 =  56.0,
 &end

# 6 LYS PHI:  (5 MET C)-(6 LYS N)-(6 LYS CA)-(6 LYS C) -135.0  75.0
 &rst     iat =    53,    55,    57,    75,
   r1 = -136.0, r2 = -135.0, r3 =  75.0, r4 =  76.0,
 &end

# 6 LYS PSI:  (6 LYS N)-(6 LYS CA)-(6 LYS C)-(7 GLU N) 105.0 185.0
 &rst     iat =    55,    57,    75,    77,
   r1 = 104.0, r2 = 105.0, r3 = 185.0, r4 = 186.0,
 &end

# 7 GLU PHI:  (6 LYS C)-(7 GLU N)-(7 GLU CA)-(7 GLU C) -175.0  75.0
 &rst     iat =    75,    77,    79,    90,
   r1 = -176.0, r2 = -175.0, r3 =  75.0, r4 =  76.0,
 &end

# 7 GLU PSI:  (7 GLU N)-(7 GLU CA)-(7 GLU C)-(8 TYR N) -75.0 185.0
 &rst     iat =    77,    79,    90,    92,
   r1 = -76.0, r2 = -75.0, r3 = 185.0, r4 = 186.0,
 &end

# 7 GLU PHI:  (6 LYS C)-(7 GLU N)-(7 GLU CA)-(7 GLU C) -255.0 -25.0
 &rst     iat =    75,    77,    79,    90,
   r1 = -256.0, r2 = -255.0, r3 = -25.0, r4 = -24.0,
 &end

# 7 GLU PSI:  (7 GLU N)-(7 GLU CA)-(7 GLU C)-(8 TYR N)  25.0  55.0
 &rst     iat =    77,    79,    90,    92,
   r1 =  24.0, r2 =  25.0, r3 =  55.0, r4 =  56.0,
 &end

# 7 GLU PHI:  (6 LYS C)-(7 GLU N)-(7 GLU CA)-(7 GLU C) -135.0  75.0
 &rst     iat =    75,    77,    79,    90,
   r1 = -136.0, r2 = -135.0, r3 =  75.0, r4 =  76.0,
 &end

# 7 GLU PSI:  (7 GLU N)-(7 GLU CA)-(7 GLU C)-(8 TYR N) 105.0 185.0
 &rst     iat =    77,    79,    90,    92,
   r1 = 104.0, r2 = 105.0, r3 = 185.0, r4 = 186.0,
 &end

# 8 TYR PHI:  (7 GLU C)-(8 TYR N)-(8 TYR CA)-(8 TYR C) -175.0  75.0
 &rst     iat =    90,    92,    94,   111,
   r1 = -176.0, r2 = -175.0, r3 =  75.0, r4 =  76.0,
 &end

# 8 TYR PSI:  (8 TYR N)-(8 TYR CA)-(8 TYR C)-(9 CYX N) -75.0 185.0
 &rst     iat =    92,    94,   111,   113,
   r1 = -76.0, r2 = -75.0, r3 = 185.0, r4 = 186.0,
 &end

# 8 TYR PHI:  (7 GLU C)-(8 TYR N)-(8 TYR CA)-(8 TYR C) -255.0 -25.0
 &rst     iat =    90,    92,    94,   111,
   r1 = -256.0, r2 = -255.0, r3 = -25.0, r4 = -24.0,
 &end

# 8 TYR PSI:  (8 TYR N)-(8 TYR CA)-(8 TYR C)-(9 CYX N)  25.0  55.0
 &rst     iat =    92,    94,   111,   113,
   r1 =  24.0, r2 =  25.0, r3 =  55.0, r4 =  56.0,
 &end

# 8 TYR PHI:  (7 GLU C)-(8 TYR N)-(8 TYR CA)-(8 TYR C) -135.0  75.0
 &rst     iat =    90,    92,    94,   111,
   r1 = -136.0, r2 = -135.0, r3 =  75.0, r4 =  76.0,
 &end

# 8 TYR PSI:  (8 TYR N)-(8 TYR CA)-(8 TYR C)-(9 CYX N) 105.0 185.0
 &rst     iat =    92,    94,   111,   113,
   r1 = 104.0, r2 = 105.0, r3 = 185.0, r4 = 186.0,
 &end

# 9 CYS PHI:  (8 TYR C)-(9 CYX N)-(9 CYX CA)-(9 CYX C) -175.0  75.0
 &rst     iat =   111,   113,   115,   121,
   r1 = -176.0, r2 = -175.0, r3 =  75.0, r4 =  76.0,
 &end

# 9 CYS PSI:  (9 CYX N)-(9 CYX CA)-(9 CYX C)-(10 ALA N) -75.0 185.0
 &rst     iat =   113,   115,   121,   123,
   r1 = -76.0, r2 = -75.0, r3 = 185.0, r4 = 186.0,
 &end

# 9 CYS PHI:  (8 TYR C)-(9 CYX N)-(9 CYX CA)-(9 CYX C) -255.0 -25.0
 &rst     iat =   111,   113,   115,   121,
   r1 = -256.0, r2 = -255.0, r3 = -25.0, r4 = -24.0,
 &end

# 9 CYS PSI:  (9 CYX N)-(9 CYX CA)-(9 CYX C)-(10 ALA N)  25.0  55.0
 &rst     iat =   113,   115,   121,   123,
   r1 =  24.0, r2 =  25.0, r3 =  55.0, r4 =  56.0,
 &end

# 9 CYS PHI:  (8 TYR C)-(9 CYX N)-(9 CYX CA)-(9 CYX C) -135.0  75.0
 &rst     iat =   111,   113,   115,   121,
   r1 = -136.0, r2 = -135.0, r3 =  75.0, r4 =  76.0,
 &end

# 9 CYS PSI:  (9 CYX N)-(9 CYX CA)-(9 CYX C)-(10 ALA N) 105.0 185.0
 &rst     iat =   113,   115,   121,   123,
   r1 = 104.0, r2 = 105.0, r3 = 185.0, r4 = 186.0,
 &end

# 10 ALA PHI:  (9 CYX C)-(10 ALA N)-(10 ALA CA)-(10 ALA C) -175.0  75.0
 &rst     iat =   121,   123,   125,   131,
   r1 = -176.0, r2 = -175.0, r3 =  75.0, r4 =  76.0,
 &end

# 10 ALA PSI:  (10 ALA N)-(10 ALA CA)-(10 ALA C)-(11 GLY N) -75.0 185.0
 &rst     iat =   123,   125,   131,   133,
   r1 = -76.0, r2 = -75.0, r3 = 185.0, r4 = 186.0,
 &end

# 10 ALA PHI:  (9 CYX C)-(10 ALA N)-(10 ALA CA)-(10 ALA C) -255.0 -25.0
 &rst     iat =   121,   123,   125,   131,
   r1 = -256.0, r2 = -255.0, r3 = -25.0, r4 = -24.0,
 &end

# 10 ALA PSI:  (10 ALA N)-(10 ALA CA)-(10 ALA C)-(11 GLY N)  25.0  55.0
 &rst     iat =   123,   125,   131,   133,
   r1 =  24.0, r2 =  25.0, r3 =  55.0, r4 =  56.0,
 &end

# 10 ALA PHI:  (9 CYX C)-(10 ALA N)-(10 ALA CA)-(10 ALA C) -135.0  75.0
 &rst     iat =   121,   123,   125,   131,
   r1 = -136.0, r2 = -135.0, r3 =  75.0, r4 =  76.0,
 &end

# 10 ALA PSI:  (10 ALA N)-(10 ALA CA)-(10 ALA C)-(11 GLY N) 105.0 185.0
 &rst     iat =   123,   125,   131,   133,
   r1 = 104.0, r2 = 105.0, r3 = 185.0, r4 = 186.0,
 &end

# 12 GLN PHI:  (11 GLY C)-(12 GLN N)-(12 GLN CA)-(12 GLN C) -175.0  75.0
 &rst     iat =   138,   140,   142,   155,
   r1 = -176.0, r2 = -175.0, r3 =  75.0, r4 =  76.0,
 &end

# 12 GLN PSI:  (12 GLN N)-(12 GLN CA)-(12 GLN C)-(13 CYX N) -75.0 185.0
 &rst     iat =   140,   142,   155,   157,
   r1 = -76.0, r2 = -75.0, r3 = 185.0, r4 = 186.0,
 &end

# 12 GLN PHI:  (11 GLY C)-(12 GLN N)-(12 GLN CA)-(12 GLN C) -255.0 -25.0
 &rst     iat =   138,   140,   142,   155,
   r1 = -256.0, r2 = -255.0, r3 = -25.0, r4 = -24.0,
 &end

# 12 GLN PSI:  (12 GLN N)-(12 GLN CA)-(12 GLN C)-(13 CYX N)  25.0  55.0
 &rst     iat =   140,   142,   155,   157,
   r1 =  24.0, r2 =  25.0, r3 =  55.0, r4 =  56.0,
 &end

# 12 GLN PHI:  (11 GLY C)-(12 GLN N)-(12 GLN CA)-(12 GLN C) -135.0  75.0
 &rst     iat =   138,   140,   142,   155,
   r1 = -136.0, r2 = -135.0, r3 =  75.0, r4 =  76.0,
 &end

# 12 GLN PSI:  (12 GLN N)-(12 GLN CA)-(12 GLN C)-(13 CYX N) 105.0 185.0
 &rst     iat =   140,   142,   155,   157,
   r1 = 104.0, r2 = 105.0, r3 = 185.0, r4 = 186.0,
 &end

# 13 CYS PHI:  (12 GLN C)-(13 CYX N)-(13 CYX CA)-(13 CYX C) -175.0  75.0
 &rst     iat =   155,   157,   159,   165,
   r1 = -176.0, r2 = -175.0, r3 =  75.0, r4 =  76.0,
 &end

# 13 CYS PSI:  (13 CYX N)-(13 CYX CA)-(13 CYX C)-(14 ARG N) -75.0 185.0
 &rst     iat =   157,   159,   165,   167,
   r1 = -76.0, r2 = -75.0, r3 = 185.0, r4 = 186.0,
 &end

# 13 CYS PHI:  (12 GLN C)-(13 CYX N)-(13 CYX CA)-(13 CYX C) -255.0 -25.0
 &rst     iat =   155,   157,   159,   165,
   r1 = -256.0, r2 = -255.0, r3 = -25.0, r4 = -24.0,
 &end

# 13 CYS PSI:  (13 CYX N)-(13 CYX CA)-(13 CYX C)-(14 ARG N)  25.0  55.0
 &rst     iat =   157,   159,   165,   167,
   r1 =  24.0, r2 =  25.0, r3 =  55.0, r4 =  56.0,
 &end

# 13 CYS PHI:  (12 GLN C)-(13 CYX N)-(13 CYX CA)-(13 CYX C) -135.0  75.0
 &rst     iat =   155,   157,   159,   165,
   r1 = -136.0, r2 = -135.0, r3 =  75.0, r4 =  76.0,
 &end

# 13 CYS PSI:  (13 CYX N)-(13 CYX CA)-(13 CYX C)-(14 ARG N) 105.0 185.0
 &rst     iat =   157,   159,   165,   167,
   r1 = 104.0, r2 = 105.0, r3 = 185.0, r4 = 186.0,
 &end

# 14 ARG PHI:  (13 CYX C)-(14 ARG N)-(14 ARG CA)-(14 ARG C) -175.0  75.0
 &rst     iat =   165,   167,   169,   189,
   r1 = -176.0, r2 = -175.0, r3 =  75.0, r4 =  76.0,
 &end

# 14 ARG PSI:  (14 ARG N)-(14 ARG CA)-(14 ARG C)-(15 GLY N) -75.0 185.0
 &rst     iat =   167,   169,   189,   191,
   r1 = -76.0, r2 = -75.0, r3 = 185.0, r4 = 186.0,
 &end

# 14 ARG PHI:  (13 CYX C)-(14 ARG N)-(14 ARG CA)-(14 ARG C) -255.0 -25.0
 &rst     iat =   165,   167,   169,   189,
   r1 = -256.0, r2 = -255.0, r3 = -25.0, r4 = -24.0,
 &end

# 14 ARG PSI:  (14 ARG N)-(14 ARG CA)-(14 ARG C)-(15 GLY N)  25.0  55.0
 &rst     iat =   167,   169,   189,   191,
   r1 =  24.0, r2 =  25.0, r3 =  55.0, r4 =  56.0,
 &end

# 14 ARG PHI:  (13 CYX C)-(14 ARG N)-(14 ARG CA)-(14 ARG C) -135.0  75.0
 &rst     iat =   165,   167,   169,   189,
   r1 = -136.0, r2 = -135.0, r3 =  75.0, r4 =  76.0,
 &end

# 14 ARG PSI:  (14 ARG N)-(14 ARG CA)-(14 ARG C)-(15 GLY N) 105.0 185.0
 &rst     iat =   167,   169,   189,   191,
   r1 = 104.0, r2 = 105.0, r3 = 185.0, r4 = 186.0,
 &end

# 16 LYS PHI:  (15 GLY C)-(16 LYS N)-(16 LYS CA)-(16 LYS C) -175.0  75.0
 &rst     iat =   196,   198,   200,   218,
   r1 = -176.0, r2 = -175.0, r3 =  75.0, r4 =  76.0,
 &end

# 16 LYS PSI:  (16 LYS N)-(16 LYS CA)-(16 LYS C)-(17 VAL N) -75.0 185.0
 &rst     iat =   198,   200,   218,   220,
   r1 = -76.0, r2 = -75.0, r3 = 185.0, r4 = 186.0,
 &end

# 16 LYS PHI:  (15 GLY C)-(16 LYS N)-(16 LYS CA)-(16 LYS C) -255.0 -25.0
 &rst     iat =   196,   198,   200,   218,
   r1 = -256.0, r2 = -255.0, r3 = -25.0, r4 = -24.0,
 &end

# 16 LYS PSI:  (16 LYS N)-(16 LYS CA)-(16 LYS C)-(17 VAL N)  25.0  55.0
 &rst     iat =   198,   200,   218,   220,
   r1 =  24.0, r2 =  25.0, r3 =  55.0, r4 =  56.0,
 &end

# 16 LYS PHI:  (15 GLY C)-(16 LYS N)-(16 LYS CA)-(16 LYS C) -135.0  75.0
 &rst     iat =   196,   198,   200,   218,
   r1 = -136.0, r2 = -135.0, r3 =  75.0, r4 =  76.0,
 &end

# 16 LYS PSI:  (16 LYS N)-(16 LYS CA)-(16 LYS C)-(17 VAL N) 105.0 185.0
 &rst     iat =   198,   200,   218,   220,
   r1 = 104.0, r2 = 105.0, r3 = 185.0, r4 = 186.0,
 &end

# 17 VAL PHI:  (16 LYS C)-(17 VAL N)-(17 VAL CA)-(17 VAL C) -175.0  75.0
 &rst     iat =   218,   220,   222,   234,
   r1 = -176.0, r2 = -175.0, r3 =  75.0, r4 =  76.0,
 &end

# 17 VAL PSI:  (17 VAL N)-(17 VAL CA)-(17 VAL C)-(18 SER N) -75.0 185.0
 &rst     iat =   220,   222,   234,   236,
   r1 = -76.0, r2 = -75.0, r3 = 185.0, r4 = 186.0,
 &end

# 17 VAL PHI:  (16 LYS C)-(17 VAL N)-(17 VAL CA)-(17 VAL C) -255.0 -25.0
 &rst     iat =   218,   220,   222,   234,
   r1 = -256.0, r2 = -255.0, r3 = -25.0, r4 = -24.0,
 &end

# 17 VAL PSI:  (17 VAL N)-(17 VAL CA)-(17 VAL C)-(18 SER N)  25.0  55.0
 &rst     iat =   220,   222,   234,   236,
   r1 =  24.0, r2 =  25.0, r3 =  55.0, r4 =  56.0,
 &end

# 17 VAL PHI:  (16 LYS C)-(17 VAL N)-(17 VAL CA)-(17 VAL C) -135.0  75.0
 &rst     iat =   218,   220,   222,   234,
   r1 = -136.0, r2 = -135.0, r3 =  75.0, r4 =  76.0,
 &end

# 17 VAL PSI:  (17 VAL N)-(17 VAL CA)-(17 VAL C)-(18 SER N) 105.0 185.0
 &rst     iat =   220,   222,   234,   236,
   r1 = 104.0, r2 = 105.0, r3 = 185.0, r4 = 186.0,
 &end

# 18 SER PHI:  (17 VAL C)-(18 SER N)-(18 SER CA)-(18 SER C) -175.0  75.0
 &rst     iat =   234,   236,   238,   245,
   r1 = -176.0, r2 = -175.0, r3 =  75.0, r4 =  76.0,
 &end

# 18 SER PSI:  (18 SER N)-(18 SER CA)-(18 SER C)-(19 GLN N) -75.0 185.0
 &rst     iat =   236,   238,   245,   247,
   r1 = -76.0, r2 = -75.0, r3 = 185.0, r4 = 186.0,
 &end

# 18 SER PHI:  (17 VAL C)-(18 SER N)-(18 SER CA)-(18 SER C) -255.0 -25.0
 &rst     iat =   234,   236,   238,   245,
   r1 = -256.0, r2 = -255.0, r3 = -25.0, r4 = -24.0,
 &end

# 18 SER PSI:  (18 SER N)-(18 SER CA)-(18 SER C)-(19 GLN N)  25.0  55.0
 &rst     iat =   236,   238,   245,   247,
   r1 =  24.0, r2 =  25.0, r3 =  55.0, r4 =  56.0,
 &end

# 18 SER PHI:  (17 VAL C)-(18 SER N)-(18 SER CA)-(18 SER C) -135.0  75.0
 &rst     iat =   234,   236,   238,   245,
   r1 = -136.0, r2 = -135.0, r3 =  75.0, r4 =  76.0,
 &end

# 18 SER PSI:  (18 SER N)-(18 SER CA)-(18 SER C)-(19 GLN N) 105.0 185.0
 &rst     iat =   236,   238,   245,   247,
   r1 = 104.0, r2 = 105.0, r3 = 185.0, r4 = 186.0,
 &end

# 19 GLN PHI:  (18 SER C)-(19 GLN N)-(19 GLN CA)-(19 GLN C) -175.0  75.0
 &rst     iat =   245,   247,   249,   262,
   r1 = -176.0, r2 = -175.0, r3 =  75.0, r4 =  76.0,
 &end

# 19 GLN PSI:  (19 GLN N)-(19 GLN CA)-(19 GLN C)-(20 ASP N) -75.0 185.0
 &rst     iat =   247,   249,   262,   264,
   r1 = -76.0, r2 = -75.0, r3 = 185.0, r4 = 186.0,
 &end

# 19 GLN PHI:  (18 SER C)-(19 GLN N)-(19 GLN CA)-(19 GLN C) -255.0 -25.0
 &rst     iat =   245,   247,   249,   262,
   r1 = -256.0, r2 = -255.0, r3 = -25.0, r4 = -24.0,
 &end

# 19 GLN PSI:  (19 GLN N)-(19 GLN CA)-(19 GLN C)-(20 ASP N)  25.0  55.0
 &rst     iat =   247,   249,   262,   264,
   r1 =  24.0, r2 =  25.0, r3 =  55.0, r4 =  56.0,
 &end

# 19 GLN PHI:  (18 SER C)-(19 GLN N)-(19 GLN CA)-(19 GLN C) -135.0  75.0
 &rst     iat =   245,   247,   249,   262,
   r1 = -136.0, r2 = -135.0, r3 =  75.0, r4 =  76.0,
 &end

# 19 GLN PSI:  (19 GLN N)-(19 GLN CA)-(19 GLN C)-(20 ASP N) 105.0 185.0
 &rst     iat =   247,   249,   262,   264,
   r1 = 104.0, r2 = 105.0, r3 = 185.0, r4 = 186.0,
 &end

# 20 ASP PHI:  (19 GLN C)-(20 ASP N)-(20 ASP CA)-(20 ASP C) -175.0  75.0
 &rst     iat =   262,   264,   266,   274,
   r1 = -176.0, r2 = -175.0, r3 =  75.0, r4 =  76.0,
 &end

# 20 ASP PSI:  (20 ASP N)-(20 ASP CA)-(20 ASP C)-(21 TYR N) -75.0 185.0
 &rst     iat =   264,   266,   274,   276,
   r1 = -76.0, r2 = -75.0, r3 = 185.0, r4 = 186.0,
 &end

# 20 ASP PHI:  (19 GLN C)-(20 ASP N)-(20 ASP CA)-(20 ASP C) -255.0 -25.0
 &rst     iat =   262,   264,   266,   274,
   r1 = -256.0, r2 = -255.0, r3 = -25.0, r4 = -24.0,
 &end

# 20 ASP PSI:  (20 ASP N)-(20 ASP CA)-(20 ASP C)-(21 TYR N)  25.0  55.0
 &rst     iat =   264,   266,   274,   276,
   r1 =  24.0, r2 =  25.0, r3 =  55.0, r4 =  56.0,
 &end

# 20 ASP PHI:  (19 GLN C)-(20 ASP N)-(20 ASP CA)-(20 ASP C) -135.0  75.0
 &rst     iat =   262,   264,   266,   274,
   r1 = -136.0, r2 = -135.0, r3 =  75.0, r4 =  76.0,
 &end

# 20 ASP PSI:  (20 ASP N)-(20 ASP CA)-(20 ASP C)-(21 TYR N) 105.0 185.0
 &rst     iat =   264,   266,   274,   276,
   r1 = 104.0, r2 = 105.0, r3 = 185.0, r4 = 186.0,
 &end

# 21 TYR PHI:  (20 ASP C)-(21 TYR N)-(21 TYR CA)-(21 TYR C) -175.0  75.0
 &rst     iat =   274,   276,   278,   295,
   r1 = -176.0, r2 = -175.0, r3 =  75.0, r4 =  76.0,
 &end

# 21 TYR PSI:  (21 TYR N)-(21 TYR CA)-(21 TYR C)-(22 CYX N) -75.0 185.0
 &rst     iat =   276,   278,   295,   297,
   r1 = -76.0, r2 = -75.0, r3 = 185.0, r4 = 186.0,
 &end

# 21 TYR PHI:  (20 ASP C)-(21 TYR N)-(21 TYR CA)-(21 TYR C) -255.0 -25.0
 &rst     iat =   274,   276,   278,   295,
   r1 = -256.0, r2 = -255.0, r3 = -25.0, r4 = -24.0,
 &end

# 21 TYR PSI:  (21 TYR N)-(21 TYR CA)-(21 TYR C)-(22 CYX N)  25.0  55.0
 &rst     iat =   276,   278,   295,   297,
   r1 =  24.0, r2 =  25.0, r3 =  55.0, r4 =  56.0,
 &end

# 21 TYR PHI:  (20 ASP C)-(21 TYR N)-(21 TYR CA)-(21 TYR C) -135.0  75.0
 &rst     iat =   274,   276,   278,   295,
   r1 = -136.0, r2 = -135.0, r3 =  75.0, r4 =  76.0,
 &end

# 21 TYR PSI:  (21 TYR N)-(21 TYR CA)-(21 TYR C)-(22 CYX N) 105.0 185.0
 &rst     iat =   276,   278,   295,   297,
   r1 = 104.0, r2 = 105.0, r3 = 185.0, r4 = 186.0,
 &end

# 22 CYS PHI:  (21 TYR C)-(22 CYX N)-(22 CYX CA)-(22 CYX C) -175.0  75.0
 &rst     iat =   295,   297,   299,   305,
   r1 = -176.0, r2 = -175.0, r3 =  75.0, r4 =  76.0,
 &end

# 22 CYS PSI:  (22 CYX N)-(22 CYX CA)-(22 CYX C)-(23 LEU N) -75.0 185.0
 &rst     iat =   297,   299,   305,   307,
   r1 = -76.0, r2 = -75.0, r3 = 185.0, r4 = 186.0,
 &end

# 22 CYS PHI:  (21 TYR C)-(22 CYX N)-(22 CYX CA)-(22 CYX C) -255.0 -25.0
 &rst     iat =   295,   297,   299,   305,
   r1 = -256.0, r2 = -255.0, r3 = -25.0, r4 = -24.0,
 &end

# 22 CYS PSI:  (22 CYX N)-(22 CYX CA)-(22 CYX C)-(23 LEU N)  25.0  55.0
 &rst     iat =   297,   299,   305,   307,
   r1 =  24.0, r2 =  25.0, r3 =  55.0, r4 =  56.0,
 &end

# 22 CYS PHI:  (21 TYR C)-(22 CYX N)-(22 CYX CA)-(22 CYX C) -135.0  75.0
 &rst     iat =   295,   297,   299,   305,
   r1 = -136.0, r2 = -135.0, r3 =  75.0, r4 =  76.0,
 &end

# 22 CYS PSI:  (22 CYX N)-(22 CYX CA)-(22 CYX C)-(23 LEU N) 105.0 185.0
 &rst     iat =   297,   299,   305,   307,
   r1 = 104.0, r2 = 105.0, r3 = 185.0, r4 = 186.0,
 &end

# 23 LEU PHI:  (22 CYX C)-(23 LEU N)-(23 LEU CA)-(23 LEU C) -175.0  75.0
 &rst     iat =   305,   307,   309,   324,
   r1 = -176.0, r2 = -175.0, r3 =  75.0, r4 =  76.0,
 &end

# 23 LEU PSI:  (23 LEU N)-(23 LEU CA)-(23 LEU C)-(24 LYS N) -75.0 185.0
 &rst     iat =   307,   309,   324,   326,
   r1 = -76.0, r2 = -75.0, r3 = 185.0, r4 = 186.0,
 &end

# 23 LEU PHI:  (22 CYX C)-(23 LEU N)-(23 LEU CA)-(23 LEU C) -255.0 -25.0
 &rst     iat =   305,   307,   309,   324,
   r1 = -256.0, r2 = -255.0, r3 = -25.0, r4 = -24.0,
 &end

# 23 LEU PSI:  (23 LEU N)-(23 LEU CA)-(23 LEU C)-(24 LYS N)  25.0  55.0
 &rst     iat =   307,   309,   324,   326,
   r1 =  24.0, r2 =  25.0, r3 =  55.0, r4 =  56.0,
 &end

# 23 LEU PHI:  (22 CYX C)-(23 LEU N)-(23 LEU CA)-(23 LEU C) -135.0  75.0
 &rst     iat =   305,   307,   309,   324,
   r1 = -136.0, r2 = -135.0, r3 =  75.0, r4 =  76.0,
 &end

# 23 LEU PSI:  (23 LEU N)-(23 LEU CA)-(23 LEU C)-(24 LYS N) 105.0 185.0
 &rst     iat =   307,   309,   324,   326,
   r1 = 104.0, r2 = 105.0, r3 = 185.0, r4 = 186.0,
 &end

# 24 LYS PHI:  (23 LEU C)-(24 LYS N)-(24 LYS CA)-(24 LYS C) -175.0  75.0
 &rst     iat =   324,   326,   328,   346,
   r1 = -176.0, r2 = -175.0, r3 =  75.0, r4 =  76.0,
 &end

# 24 LYS PSI:  (24 LYS N)-(24 LYS CA)-(24 LYS C)-(25 HIE N) -75.0 185.0
 &rst     iat =   326,   328,   346,   348,
   r1 = -76.0, r2 = -75.0, r3 = 185.0, r4 = 186.0,
 &end

# 24 LYS PHI:  (23 LEU C)-(24 LYS N)-(24 LYS CA)-(24 LYS C) -255.0 -25.0
 &rst     iat =   324,   326,   328,   346,
   r1 = -256.0, r2 = -255.0, r3 = -25.0, r4 = -24.0,
 &end

# 24 LYS PSI:  (24 LYS N)-(24 LYS CA)-(24 LYS C)-(25 HIE N)  25.0  55.0
 &rst     iat =   326,   328,   346,   348,
   r1 =  24.0, r2 =  25.0, r3 =  55.0, r4 =  56.0,
 &end

# 24 LYS PHI:  (23 LEU C)-(24 LYS N)-(24 LYS CA)-(24 LYS C) -135.0  75.0
 &rst     iat =   324,   326,   328,   346,
   r1 = -136.0, r2 = -135.0, r3 =  75.0, r4 =  76.0,
 &end

# 24 LYS PSI:  (24 LYS N)-(24 LYS CA)-(24 LYS C)-(25 HIE N) 105.0 185.0
 &rst     iat =   326,   328,   346,   348,
   r1 = 104.0, r2 = 105.0, r3 = 185.0, r4 = 186.0,
 &end

# 25 HIS PHI:  (24 LYS C)-(25 HIE N)-(25 HIE CA)-(25 HIE C) -175.0  75.0
 &rst     iat =   346,   348,   350,   363,
   r1 = -176.0, r2 = -175.0, r3 =  75.0, r4 =  76.0,
 &end

# 25 HIS PSI:  (25 HIE N)-(25 HIE CA)-(25 HIE C)-(26 CYX N) -75.0 185.0
 &rst     iat =   348,   350,   363,   365,
   r1 = -76.0, r2 = -75.0, r3 = 185.0, r4 = 186.0,
 &end

# 25 HIS PHI:  (24 LYS C)-(25 HIE N)-(25 HIE CA)-(25 HIE C) -255.0 -25.0
 &rst     iat =   346,   348,   350,   363,
   r1 = -256.0, r2 = -255.0, r3 = -25.0, r4 = -24.0,
 &end

# 25 HIS PSI:  (25 HIE N)-(25 HIE CA)-(25 HIE C)-(26 CYX N)  25.0  55.0
 &rst     iat =   348,   350,   363,   365,
   r1 =  24.0, r2 =  25.0, r3 =  55.0, r4 =  56.0,
 &end

# 25 HIS PHI:  (24 LYS C)-(25 HIE N)-(25 HIE CA)-(25 HIE C) -135.0  75.0
 &rst     iat =   346,   348,   350,   363,
   r1 = -136.0, r2 = -135.0, r3 =  75.0, r4 =  76.0,
 &end

# 25 HIS PSI:  (25 HIE N)-(25 HIE CA)-(25 HIE C)-(26 CYX N) 105.0 185.0
 &rst     iat =   348,   350,   363,   365,
   r1 = 104.0, r2 = 105.0, r3 = 185.0, r4 = 186.0,
 &end

# 26 CYS PHI:  (25 HIE C)-(26 CYX N)-(26 CYX CA)-(26 CYX C) -175.0  75.0
 &rst     iat =   363,   365,   367,   373,
   r1 = -176.0, r2 = -175.0, r3 =  75.0, r4 =  76.0,
 &end

# 26 CYS PSI:  (26 CYX N)-(26 CYX CA)-(26 CYX C)-(27 LYS N) -75.0 185.0
 &rst     iat =   365,   367,   373,   375,
   r1 = -76.0, r2 = -75.0, r3 = 185.0, r4 = 186.0,
 &end

# 26 CYS PHI:  (25 HIE C)-(26 CYX N)-(26 CYX CA)-(26 CYX C) -255.0 -25.0
 &rst     iat =   363,   365,   367,   373,
   r1 = -256.0, r2 = -255.0, r3 = -25.0, r4 = -24.0,
 &end

# 26 CYS PSI:  (26 CYX N)-(26 CYX CA)-(26 CYX C)-(27 LYS N)  25.0  55.0
 &rst     iat =   365,   367,   373,   375,
   r1 =  24.0, r2 =  25.0, r3 =  55.0, r4 =  56.0,
 &end

# 26 CYS PHI:  (25 HIE C)-(26 CYX N)-(26 CYX CA)-(26 CYX C) -135.0  75.0
 &rst     iat =   363,   365,   367,   373,
   r1 = -136.0, r2 = -135.0, r3 =  75.0, r4 =  76.0,
 &end

# 26 CYS PSI:  (26 CYX N)-(26 CYX CA)-(26 CYX C)-(27 LYS N) 105.0 185.0
 &rst     iat =   365,   367,   373,   375,
   r1 = 104.0, r2 = 105.0, r3 = 185.0, r4 = 186.0,
 &end

# 27 LYS PHI:  (26 CYX C)-(27 LYS N)-(27 LYS CA)-(27 LYS C) -175.0  75.0
 &rst     iat =   373,   375,   377,   395,
   r1 = -176.0, r2 = -175.0, r3 =  75.0, r4 =  76.0,
 &end

# 27 LYS PSI:  (27 LYS N)-(27 LYS CA)-(27 LYS C)-(28 CYX N) -75.0 185.0
 &rst     iat =   375,   377,   395,   397,
   r1 = -76.0, r2 = -75.0, r3 = 185.0, r4 = 186.0,
 &end

# 27 LYS PHI:  (26 CYX C)-(27 LYS N)-(27 LYS CA)-(27 LYS C) -255.0 -25.0
 &rst     iat =   373,   375,   377,   395,
   r1 = -256.0, r2 = -255.0, r3 = -25.0, r4 = -24.0,
 &end

# 27 LYS PSI:  (27 LYS N)-(27 LYS CA)-(27 LYS C)-(28 CYX N)  25.0  55.0
 &rst     iat =   375,   377,   395,   397,
   r1 =  24.0, r2 =  25.0, r3 =  55.0, r4 =  56.0,
 &end

# 27 LYS PHI:  (26 CYX C)-(27 LYS N)-(27 LYS CA)-(27 LYS C) -135.0  75.0
 &rst     iat =   373,   375,   377,   395,
   r1 = -136.0, r2 = -135.0, r3 =  75.0, r4 =  76.0,
 &end

# 27 LYS PSI:  (27 LYS N)-(27 LYS CA)-(27 LYS C)-(28 CYX N) 105.0 185.0
 &rst     iat =   375,   377,   395,   397,
   r1 = 104.0, r2 = 105.0, r3 = 185.0, r4 = 186.0,
 &end

# 28 CYS PHI:  (27 LYS C)-(28 CYX N)-(28 CYX CA)-(28 CYX C) -175.0  75.0
 &rst     iat =   395,   397,   399,   405,
   r1 = -176.0, r2 = -175.0, r3 =  75.0, r4 =  76.0,
 &end

# 28 CYS PSI:  (28 CYX N)-(28 CYX CA)-(28 CYX C)-(29 ILE N) -75.0 185.0
 &rst     iat =   397,   399,   405,   407,
   r1 = -76.0, r2 = -75.0, r3 = 185.0, r4 = 186.0,
 &end

# 28 CYS PHI:  (27 LYS C)-(28 CYX N)-(28 CYX CA)-(28 CYX C) -255.0 -25.0
 &rst     iat =   395,   397,   399,   405,
   r1 = -256.0, r2 = -255.0, r3 = -25.0, r4 = -24.0,
 &end

# 28 CYS PSI:  (28 CYX N)-(28 CYX CA)-(28 CYX C)-(29 ILE N)  25.0  55.0
 &rst     iat =   397,   399,   405,   407,
   r1 =  24.0, r2 =  25.0, r3 =  55.0, r4 =  56.0,
 &end

# 28 CYS PHI:  (27 LYS C)-(28 CYX N)-(28 CYX CA)-(28 CYX C) -135.0  75.0
 &rst     iat =   395,   397,   399,   405,
   r1 = -136.0, r2 = -135.0, r3 =  75.0, r4 =  76.0,
 &end

# 28 CYS PSI:  (28 CYX N)-(28 CYX CA)-(28 CYX C)-(29 ILE N) 105.0 185.0
 &rst     iat =   397,   399,   405,   407,
   r1 = 104.0, r2 = 105.0, r3 = 185.0, r4 = 186.0,
 &end

# 31 ARG PHI:  (30 PRO C)-(31 ARG N)-(31 ARG CA)-(31 ARG C) -175.0  75.0
 &rst     iat =   438,   440,   442,   462,
   r1 = -176.0, r2 = -175.0, r3 =  75.0, r4 =  76.0,
 &end

# 31 ARG PHI:  (30 PRO C)-(31 ARG N)-(31 ARG CA)-(31 ARG C) -255.0 -25.0
 &rst     iat =   438,   440,   442,   462,
   r1 = -256.0, r2 = -255.0, r3 = -25.0, r4 = -24.0,
 &end

# 31 ARG PHI:  (30 PRO C)-(31 ARG N)-(31 ARG CA)-(31 ARG C) -135.0  75.0
 &rst     iat =   438,   440,   442,   462,
   r1 = -136.0, r2 = -135.0, r3 =  75.0, r4 =  76.0,
 &end

# 2 SER CHI1:  (2 SER N)-(2 SER CA)-(2 SER CB)-(2 SER OG) -90.0 210.0
 &rst     iat =    10,    12,    14,    17,
   r1 = -91.0, r2 = -90.0, r3 = 210.0, r4 = 211.0,
 &end

# 2 SER CHI1:  (2 SER N)-(2 SER CA)-(2 SER CB)-(2 SER OG) -330.0 -30.0
 &rst     iat =    10,    12,    14,    17,
   r1 = -331.0, r2 = -330.0, r3 = -30.0, r4 = -29.0,
 &end

# 2 SER CHI1:  (2 SER N)-(2 SER CA)-(2 SER CB)-(2 SER OG) -210.0  90.0
 &rst     iat =    10,    12,    14,    17,
   r1 = -211.0, r2 = -210.0, r3 =  90.0, r4 =  91.0,
 &end

# 4 CYS CHI1:  (4 CYX N)-(4 CYX CA)-(4 CYX CB)-(4 CYX SG) -90.0 210.0
 &rst     iat =    28,    30,    32,    35,
   r1 = -91.0, r2 = -90.0, r3 = 210.0, r4 = 211.0,
 &end

# 4 CYS CHI1:  (4 CYX N)-(4 CYX CA)-(4 CYX CB)-(4 CYX SG) -330.0 -30.0
 &rst     iat =    28,    30,    32,    35,
   r1 = -331.0, r2 = -330.0, r3 = -30.0, r4 = -29.0,
 &end

# 4 CYS CHI1:  (4 CYX N)-(4 CYX CA)-(4 CYX CB)-(4 CYX SG) -210.0  90.0
 &rst     iat =    28,    30,    32,    35,
   r1 = -211.0, r2 = -210.0, r3 =  90.0, r4 =  91.0,
 &end

# 5 MET CHI1:  (5 MET N)-(5 MET CA)-(5 MET CB)-(5 MET CG) -90.0 210.0
 &rst     iat =    38,    40,    42,    45,
   r1 = -91.0, r2 = -90.0, r3 = 210.0, r4 = 211.0,
 &end

# 5 MET CHI1:  (5 MET N)-(5 MET CA)-(5 MET CB)-(5 MET CG) -330.0 -30.0
 &rst     iat =    38,    40,    42,    45,
   r1 = -331.0, r2 = -330.0, r3 = -30.0, r4 = -29.0,
 &end

# 5 MET CHI1:  (5 MET N)-(5 MET CA)-(5 MET CB)-(5 MET CG) -210.0  90.0
 &rst     iat =    38,    40,    42,    45,
   r1 = -211.0, r2 = -210.0, r3 =  90.0, r4 =  91.0,
 &end

# 5 MET CHI2:  (5 MET CA)-(5 MET CB)-(5 MET CG)-(5 MET SD) -90.0 210.0
 &rst     iat =    40,    42,    45,    48,
   r1 = -91.0, r2 = -90.0, r3 = 210.0, r4 = 211.0,
 &end

# 5 MET CHI2:  (5 MET CA)-(5 MET CB)-(5 MET CG)-(5 MET SD) -330.0 -30.0
 &rst     iat =    40,    42,    45,    48,
   r1 = -331.0, r2 = -330.0, r3 = -30.0, r4 = -29.0,
 &end

# 5 MET CHI2:  (5 MET CA)-(5 MET CB)-(5 MET CG)-(5 MET SD) -210.0  90.0
 &rst     iat =    40,    42,    45,    48,
   r1 = -211.0, r2 = -210.0, r3 =  90.0, r4 =  91.0,
 &end

# 6 LYS CHI1:  (6 LYS N)-(6 LYS CA)-(6 LYS CB)-(6 LYS CG) -90.0 210.0
 &rst     iat =    55,    57,    59,    62,
   r1 = -91.0, r2 = -90.0, r3 = 210.0, r4 = 211.0,
 &end

# 6 LYS CHI1:  (6 LYS N)-(6 LYS CA)-(6 LYS CB)-(6 LYS CG) -330.0 -30.0
 &rst     iat =    55,    57,    59,    62,
   r1 = -331.0, r2 = -330.0, r3 = -30.0, r4 = -29.0,
 &end

# 6 LYS CHI1:  (6 LYS N)-(6 LYS CA)-(6 LYS CB)-(6 LYS CG) -210.0  90.0
 &rst     iat =    55,    57,    59,    62,
   r1 = -211.0, r2 = -210.0, r3 =  90.0, r4 =  91.0,
 &end

# 6 LYS CHI2:  (6 LYS CA)-(6 LYS CB)-(6 LYS CG)-(6 LYS CD) -90.0 210.0
 &rst     iat =    57,    59,    62,    65,
   r1 = -91.0, r2 = -90.0, r3 = 210.0, r4 = 211.0,
 &end

# 6 LYS CHI2:  (6 LYS CA)-(6 LYS CB)-(6 LYS CG)-(6 LYS CD) -330.0 -30.0
 &rst     iat =    57,    59,    62,    65,
   r1 = -331.0, r2 = -330.0, r3 = -30.0, r4 = -29.0,
 &end

# 6 LYS CHI2:  (6 LYS CA)-(6 LYS CB)-(6 LYS CG)-(6 LYS CD) -210.0  90.0
 &rst     iat =    57,    59,    62,    65,
   r1 = -211.0, r2 = -210.0, r3 =  90.0, r4 =  91.0,
 &end

# 6 LYS CHI3:  (6 LYS CB)-(6 LYS CG)-(6 LYS CD)-(6 LYS CE) -90.0 210.0
 &rst     iat =    59,    62,    65,    68,
   r1 = -91.0, r2 = -90.0, r3 = 210.0, r4 = 211.0,
 &end

# 6 LYS CHI3:  (6 LYS CB)-(6 LYS CG)-(6 LYS CD)-(6 LYS CE) -330.0 -30.0
 &rst     iat =    59,    62,    65,    68,
   r1 = -331.0, r2 = -330.0, r3 = -30.0, r4 = -29.0,
 &end

# 6 LYS CHI3:  (6 LYS CB)-(6 LYS CG)-(6 LYS CD)-(6 LYS CE) -210.0  90.0
 &rst     iat =    59,    62,    65,    68,
   r1 = -211.0, r2 = -210.0, r3 =  90.0, r4 =  91.0,
 &end

# 6 LYS CHI4:  (6 LYS CG)-(6 LYS CD)-(6 LYS CE)-(6 LYS NZ) -90.0 210.0
 &rst     iat =    62,    65,    68,    71,
   r1 = -91.0, r2 = -90.0, r3 = 210.0, r4 = 211.0,
 &end

# 6 LYS CHI4:  (6 LYS CG)-(6 LYS CD)-(6 LYS CE)-(6 LYS NZ) -330.0 -30.0
 &rst     iat =    62,    65,    68,    71,
   r1 = -331.0, r2 = -330.0, r3 = -30.0, r4 = -29.0,
 &end

# 6 LYS CHI4:  (6 LYS CG)-(6 LYS CD)-(6 LYS CE)-(6 LYS NZ) -210.0  90.0
 &rst     iat =    62,    65,    68,    71,
   r1 = -211.0, r2 = -210.0, r3 =  90.0, r4 =  91.0,
 &end

# 7 GLU CHI1:  (7 GLU N)-(7 GLU CA)-(7 GLU CB)-(7 GLU CG) -90.0 210.0
 &rst     iat =    77,    79,    81,    84,
   r1 = -91.0, r2 = -90.0, r3 = 210.0, r4 = 211.0,
 &end

# 7 GLU CHI1:  (7 GLU N)-(7 GLU CA)-(7 GLU CB)-(7 GLU CG) -330.0 -30.0
 &rst     iat =    77,    79,    81,    84,
   r1 = -331.0, r2 = -330.0, r3 = -30.0, r4 = -29.0,
 &end

# 7 GLU CHI1:  (7 GLU N)-(7 GLU CA)-(7 GLU CB)-(7 GLU CG) -210.0  90.0
 &rst     iat =    77,    79,    81,    84,
   r1 = -211.0, r2 = -210.0, r3 =  90.0, r4 =  91.0,
 &end

# 7 GLU CHI2:  (7 GLU CA)-(7 GLU CB)-(7 GLU CG)-(7 GLU CD) -90.0 210.0
 &rst     iat =    79,    81,    84,    87,
   r1 = -91.0, r2 = -90.0, r3 = 210.0, r4 = 211.0,
 &end

# 7 GLU CHI2:  (7 GLU CA)-(7 GLU CB)-(7 GLU CG)-(7 GLU CD) -330.0 -30.0
 &rst     iat =    79,    81,    84,    87,
   r1 = -331.0, r2 = -330.0, r3 = -30.0, r4 = -29.0,
 &end

# 7 GLU CHI2:  (7 GLU CA)-(7 GLU CB)-(7 GLU CG)-(7 GLU CD) -210.0  90.0
 &rst     iat =    79,    81,    84,    87,
   r1 = -211.0, r2 = -210.0, r3 =  90.0, r4 =  91.0,
 &end

# 8 TYR CHI1:  (8 TYR N)-(8 TYR CA)-(8 TYR CB)-(8 TYR CG) -90.0 210.0
 &rst     iat =    92,    94,    96,    99,
   r1 = -91.0, r2 = -90.0, r3 = 210.0, r4 = 211.0,
 &end

# 8 TYR CHI1:  (8 TYR N)-(8 TYR CA)-(8 TYR CB)-(8 TYR CG) -330.0 -30.0
 &rst     iat =    92,    94,    96,    99,
   r1 = -331.0, r2 = -330.0, r3 = -30.0, r4 = -29.0,
 &end

# 8 TYR CHI1:  (8 TYR N)-(8 TYR CA)-(8 TYR CB)-(8 TYR CG) -210.0  90.0
 &rst     iat =    92,    94,    96,    99,
   r1 = -211.0, r2 = -210.0, r3 =  90.0, r4 =  91.0,
 &end

# 9 CYS CHI1:  (9 CYX N)-(9 CYX CA)-(9 CYX CB)-(9 CYX SG) -90.0 210.0
 &rst     iat =   113,   115,   117,   120,
   r1 = -91.0, r2 = -90.0, r3 = 210.0, r4 = 211.0,
 &end

# 9 CYS CHI1:  (9 CYX N)-(9 CYX CA)-(9 CYX CB)-(9 CYX SG) -330.0 -30.0
 &rst     iat =   113,   115,   117,   120,
   r1 = -331.0, r2 = -330.0, r3 = -30.0, r4 = -29.0,
 &end

# 9 CYS CHI1:  (9 CYX N)-(9 CYX CA)-(9 CYX CB)-(9 CYX SG) -210.0  90.0
 &rst     iat =   113,   115,   117,   120,
   r1 = -211.0, r2 = -210.0, r3 =  90.0, r4 =  91.0,
 &end

# 12 GLN CHI1:  (12 GLN N)-(12 GLN CA)-(12 GLN CB)-(12 GLN CG) -90.0 210.0
 &rst     iat =   140,   142,   144,   147,
   r1 = -91.0, r2 = -90.0, r3 = 210.0, r4 = 211.0,
 &end

# 12 GLN CHI1:  (12 GLN N)-(12 GLN CA)-(12 GLN CB)-(12 GLN CG) -330.0 -30.0
 &rst     iat =   140,   142,   144,   147,
   r1 = -331.0, r2 = -330.0, r3 = -30.0, r4 = -29.0,
 &end

# 12 GLN CHI1:  (12 GLN N)-(12 GLN CA)-(12 GLN CB)-(12 GLN CG) -210.0  90.0
 &rst     iat =   140,   142,   144,   147,
   r1 = -211.0, r2 = -210.0, r3 =  90.0, r4 =  91.0,
 &end

# 12 GLN CHI2:  (12 GLN CA)-(12 GLN CB)-(12 GLN CG)-(12 GLN CD) -90.0 210.0
 &rst     iat =   142,   144,   147,   150,
   r1 = -91.0, r2 = -90.0, r3 = 210.0, r4 = 211.0,
 &end

# 12 GLN CHI2:  (12 GLN CA)-(12 GLN CB)-(12 GLN CG)-(12 GLN CD) -330.0 -30.0
 &rst     iat =   142,   144,   147,   150,
   r1 = -331.0, r2 = -330.0, r3 = -30.0, r4 = -29.0,
 &end

# 12 GLN CHI2:  (12 GLN CA)-(12 GLN CB)-(12 GLN CG)-(12 GLN CD) -210.0  90.0
 &rst     iat =   142,   144,   147,   150,
   r1 = -211.0, r2 = -210.0, r3 =  90.0, r4 =  91.0,
 &end

# 13 CYS CHI1:  (13 CYX N)-(13 CYX CA)-(13 CYX CB)-(13 CYX SG) -90.0 210.0
 &rst     iat =   157,   159,   161,   164,
   r1 = -91.0, r2 = -90.0, r3 = 210.0, r4 = 211.0,
 &end

# 13 CYS CHI1:  (13 CYX N)-(13 CYX CA)-(13 CYX CB)-(13 CYX SG) -330.0 -30.0
 &rst     iat =   157,   159,   161,   164,
   r1 = -331.0, r2 = -330.0, r3 = -30.0, r4 = -29.0,
 &end

# 13 CYS CHI1:  (13 CYX N)-(13 CYX CA)-(13 CYX CB)-(13 CYX SG) -210.0  90.0
 &rst     iat =   157,   159,   161,   164,
   r1 = -211.0, r2 = -210.0, r3 =  90.0, r4 =  91.0,
 &end

# 14 ARG CHI1:  (14 ARG N)-(14 ARG CA)-(14 ARG CB)-(14 ARG CG) -90.0 210.0
 &rst     iat =   167,   169,   171,   174,
   r1 = -91.0, r2 = -90.0, r3 = 210.0, r4 = 211.0,
 &end

# 14 ARG CHI1:  (14 ARG N)-(14 ARG CA)-(14 ARG CB)-(14 ARG CG) -330.0 -30.0
 &rst     iat =   167,   169,   171,   174,
   r1 = -331.0, r2 = -330.0, r3 = -30.0, r4 = -29.0,
 &end

# 14 ARG CHI1:  (14 ARG N)-(14 ARG CA)-(14 ARG CB)-(14 ARG CG) -210.0  90.0
 &rst     iat =   167,   169,   171,   174,
   r1 = -211.0, r2 = -210.0, r3 =  90.0, r4 =  91.0,
 &end

# 14 ARG CHI2:  (14 ARG CA)-(14 ARG CB)-(14 ARG CG)-(14 ARG CD) -90.0 210.0
 &rst     iat =   169,   171,   174,   177,
   r1 = -91.0, r2 = -90.0, r3 = 210.0, r4 = 211.0,
 &end

# 14 ARG CHI2:  (14 ARG CA)-(14 ARG CB)-(14 ARG CG)-(14 ARG CD) -330.0 -30.0
 &rst     iat =   169,   171,   174,   177,
   r1 = -331.0, r2 = -330.0, r3 = -30.0, r4 = -29.0,
 &end

# 14 ARG CHI2:  (14 ARG CA)-(14 ARG CB)-(14 ARG CG)-(14 ARG CD) -210.0  90.0
 &rst     iat =   169,   171,   174,   177,
   r1 = -211.0, r2 = -210.0, r3 =  90.0, r4 =  91.0,
 &end

# 14 ARG CHI3:  (14 ARG CB)-(14 ARG CG)-(14 ARG CD)-(14 ARG NE) -90.0 210.0
 &rst     iat =   171,   174,   177,   180,
   r1 = -91.0, r2 = -90.0, r3 = 210.0, r4 = 211.0,
 &end

# 14 ARG CHI3:  (14 ARG CB)-(14 ARG CG)-(14 ARG CD)-(14 ARG NE) -330.0 -30.0
 &rst     iat =   171,   174,   177,   180,
   r1 = -331.0, r2 = -330.0, r3 = -30.0, r4 = -29.0,
 &end

# 14 ARG CHI3:  (14 ARG CB)-(14 ARG CG)-(14 ARG CD)-(14 ARG NE) -210.0  90.0
 &rst     iat =   171,   174,   177,   180,
   r1 = -211.0, r2 = -210.0, r3 =  90.0, r4 =  91.0,
 &end

# 16 LYS CHI1:  (16 LYS N)-(16 LYS CA)-(16 LYS CB)-(16 LYS CG) -90.0 210.0
 &rst     iat =   198,   200,   202,   205,
   r1 = -91.0, r2 = -90.0, r3 = 210.0, r4 = 211.0,
 &end

# 16 LYS CHI1:  (16 LYS N)-(16 LYS CA)-(16 LYS CB)-(16 LYS CG) -330.0 -30.0
 &rst     iat =   198,   200,   202,   205,
   r1 = -331.0, r2 = -330.0, r3 = -30.0, r4 = -29.0,
 &end

# 16 LYS CHI1:  (16 LYS N)-(16 LYS CA)-(16 LYS CB)-(16 LYS CG) -210.0  90.0
 &rst     iat =   198,   200,   202,   205,
   r1 = -211.0, r2 = -210.0, r3 =  90.0, r4 =  91.0,
 &end

# 16 LYS CHI2:  (16 LYS CA)-(16 LYS CB)-(16 LYS CG)-(16 LYS CD) -90.0 210.0
 &rst     iat =   200,   202,   205,   208,
   r1 = -91.0, r2 = -90.0, r3 = 210.0, r4 = 211.0,
 &end

# 16 LYS CHI2:  (16 LYS CA)-(16 LYS CB)-(16 LYS CG)-(16 LYS CD) -330.0 -30.0
 &rst     iat =   200,   202,   205,   208,
   r1 = -331.0, r2 = -330.0, r3 = -30.0, r4 = -29.0,
 &end

# 16 LYS CHI2:  (16 LYS CA)-(16 LYS CB)-(16 LYS CG)-(16 LYS CD) -210.0  90.0
 &rst     iat =   200,   202,   205,   208,
   r1 = -211.0, r2 = -210.0, r3 =  90.0, r4 =  91.0,
 &end

# 16 LYS CHI3:  (16 LYS CB)-(16 LYS CG)-(16 LYS CD)-(16 LYS CE) -90.0 210.0
 &rst     iat =   202,   205,   208,   211,
   r1 = -91.0, r2 = -90.0, r3 = 210.0, r4 = 211.0,
 &end

# 16 LYS CHI3:  (16 LYS CB)-(16 LYS CG)-(16 LYS CD)-(16 LYS CE) -330.0 -30.0
 &rst     iat =   202,   205,   208,   211,
   r1 = -331.0, r2 = -330.0, r3 = -30.0, r4 = -29.0,
 &end

# 16 LYS CHI3:  (16 LYS CB)-(16 LYS CG)-(16 LYS CD)-(16 LYS CE) -210.0  90.0
 &rst     iat =   202,   205,   208,   211,
   r1 = -211.0, r2 = -210.0, r3 =  90.0, r4 =  91.0,
 &end

# 16 LYS CHI4:  (16 LYS CG)-(16 LYS CD)-(16 LYS CE)-(16 LYS NZ) -90.0 210.0
 &rst     iat =   205,   208,   211,   214,
   r1 = -91.0, r2 = -90.0, r3 = 210.0, r4 = 211.0,
 &end

# 16 LYS CHI4:  (16 LYS CG)-(16 LYS CD)-(16 LYS CE)-(16 LYS NZ) -330.0 -30.0
 &rst     iat =   205,   208,   211,   214,
   r1 = -331.0, r2 = -330.0, r3 = -30.0, r4 = -29.0,
 &end

# 16 LYS CHI4:  (16 LYS CG)-(16 LYS CD)-(16 LYS CE)-(16 LYS NZ) -210.0  90.0
 &rst     iat =   205,   208,   211,   214,
   r1 = -211.0, r2 = -210.0, r3 =  90.0, r4 =  91.0,
 &end

# 17 VAL CHI1:  (17 VAL N)-(17 VAL CA)-(17 VAL CB)-(17 VAL CG1) -90.0 210.0
 &rst     iat =   220,   222,   224,   226,
   r1 = -91.0, r2 = -90.0, r3 = 210.0, r4 = 211.0,
 &end

# 17 VAL CHI1:  (17 VAL N)-(17 VAL CA)-(17 VAL CB)-(17 VAL CG1) -330.0 -30.0
 &rst     iat =   220,   222,   224,   226,
   r1 = -331.0, r2 = -330.0, r3 = -30.0, r4 = -29.0,
 &end

# 17 VAL CHI1:  (17 VAL N)-(17 VAL CA)-(17 VAL CB)-(17 VAL CG1) -210.0  90.0
 &rst     iat =   220,   222,   224,   226,
   r1 = -211.0, r2 = -210.0, r3 =  90.0, r4 =  91.0,
 &end

# 18 SER CHI1:  (18 SER N)-(18 SER CA)-(18 SER CB)-(18 SER OG) -90.0 210.0
 &rst     iat =   236,   238,   240,   243,
   r1 = -91.0, r2 = -90.0, r3 = 210.0, r4 = 211.0,
 &end

# 18 SER CHI1:  (18 SER N)-(18 SER CA)-(18 SER CB)-(18 SER OG) -330.0 -30.0
 &rst     iat =   236,   238,   240,   243,
   r1 = -331.0, r2 = -330.0, r3 = -30.0, r4 = -29.0,
 &end

# 18 SER CHI1:  (18 SER N)-(18 SER CA)-(18 SER CB)-(18 SER OG) -210.0  90.0
 &rst     iat =   236,   238,   240,   243,
   r1 = -211.0, r2 = -210.0, r3 =  90.0, r4 =  91.0,
 &end

# 19 GLN CHI1:  (19 GLN N)-(19 GLN CA)-(19 GLN CB)-(19 GLN CG) -90.0 210.0
 &rst     iat =   247,   249,   251,   254,
   r1 = -91.0, r2 = -90.0, r3 = 210.0, r4 = 211.0,
 &end

# 19 GLN CHI1:  (19 GLN N)-(19 GLN CA)-(19 GLN CB)-(19 GLN CG) -330.0 -30.0
 &rst     iat =   247,   249,   251,   254,
   r1 = -331.0, r2 = -330.0, r3 = -30.0, r4 = -29.0,
 &end

# 19 GLN CHI1:  (19 GLN N)-(19 GLN CA)-(19 GLN CB)-(19 GLN CG) -210.0  90.0
 &rst     iat =   247,   249,   251,   254,
   r1 = -211.0, r2 = -210.0, r3 =  90.0, r4 =  91.0,
 &end

# 19 GLN CHI2:  (19 GLN CA)-(19 GLN CB)-(19 GLN CG)-(19 GLN CD) -90.0 210.0
 &rst     iat =   249,   251,   254,   257,
   r1 = -91.0, r2 = -90.0, r3 = 210.0, r4 = 211.0,
 &end

# 19 GLN CHI2:  (19 GLN CA)-(19 GLN CB)-(19 GLN CG)-(19 GLN CD) -330.0 -30.0
 &rst     iat =   249,   251,   254,   257,
   r1 = -331.0, r2 = -330.0, r3 = -30.0, r4 = -29.0,
 &end

# 19 GLN CHI2:  (19 GLN CA)-(19 GLN CB)-(19 GLN CG)-(19 GLN CD) -210.0  90.0
 &rst     iat =   249,   251,   254,   257,
   r1 = -211.0, r2 = -210.0, r3 =  90.0, r4 =  91.0,
 &end

# 20 ASP CHI1:  (20 ASP N)-(20 ASP CA)-(20 ASP CB)-(20 ASP CG) -90.0 210.0
 &rst     iat =   264,   266,   268,   271,
   r1 = -91.0, r2 = -90.0, r3 = 210.0, r4 = 211.0,
 &end

# 20 ASP CHI1:  (20 ASP N)-(20 ASP CA)-(20 ASP CB)-(20 ASP CG) -330.0 -30.0
 &rst     iat =   264,   266,   268,   271,
   r1 = -331.0, r2 = -330.0, r3 = -30.0, r4 = -29.0,
 &end

# 20 ASP CHI1:  (20 ASP N)-(20 ASP CA)-(20 ASP CB)-(20 ASP CG) -210.0  90.0
 &rst     iat =   264,   266,   268,   271,
   r1 = -211.0, r2 = -210.0, r3 =  90.0, r4 =  91.0,
 &end

# 21 TYR CHI1:  (21 TYR N)-(21 TYR CA)-(21 TYR CB)-(21 TYR CG) -90.0 210.0
 &rst     iat =   276,   278,   280,   283,
   r1 = -91.0, r2 = -90.0, r3 = 210.0, r4 = 211.0,
 &end

# 21 TYR CHI1:  (21 TYR N)-(21 TYR CA)-(21 TYR CB)-(21 TYR CG) -330.0 -30.0
 &rst     iat =   276,   278,   280,   283,
   r1 = -331.0, r2 = -330.0, r3 = -30.0, r4 = -29.0,
 &end

# 21 TYR CHI1:  (21 TYR N)-(21 TYR CA)-(21 TYR CB)-(21 TYR CG) -210.0  90.0
 &rst     iat =   276,   278,   280,   283,
   r1 = -211.0, r2 = -210.0, r3 =  90.0, r4 =  91.0,
 &end

# 22 CYS CHI1:  (22 CYX N)-(22 CYX CA)-(22 CYX CB)-(22 CYX SG) -90.0 210.0
 &rst     iat =   297,   299,   301,   304,
   r1 = -91.0, r2 = -90.0, r3 = 210.0, r4 = 211.0,
 &end

# 22 CYS CHI1:  (22 CYX N)-(22 CYX CA)-(22 CYX CB)-(22 CYX SG) -330.0 -30.0
 &rst     iat =   297,   299,   301,   304,
   r1 = -331.0, r2 = -330.0, r3 = -30.0, r4 = -29.0,
 &end

# 22 CYS CHI1:  (22 CYX N)-(22 CYX CA)-(22 CYX CB)-(22 CYX SG) -210.0  90.0
 &rst     iat =   297,   299,   301,   304,
   r1 = -211.0, r2 = -210.0, r3 =  90.0, r4 =  91.0,
 &end

# 23 LEU CHI1:  (23 LEU N)-(23 LEU CA)-(23 LEU CB)-(23 LEU CG) -90.0 210.0
 &rst     iat =   307,   309,   311,   314,
   r1 = -91.0, r2 = -90.0, r3 = 210.0, r4 = 211.0,
 &end

# 23 LEU CHI1:  (23 LEU N)-(23 LEU CA)-(23 LEU CB)-(23 LEU CG) -330.0 -30.0
 &rst     iat =   307,   309,   311,   314,
   r1 = -331.0, r2 = -330.0, r3 = -30.0, r4 = -29.0,
 &end

# 23 LEU CHI1:  (23 LEU N)-(23 LEU CA)-(23 LEU CB)-(23 LEU CG) -210.0  90.0
 &rst     iat =   307,   309,   311,   314,
   r1 = -211.0, r2 = -210.0, r3 =  90.0, r4 =  91.0,
 &end

# 23 LEU CHI2:  (23 LEU CA)-(23 LEU CB)-(23 LEU CG)-(23 LEU CD1) -90.0 210.0
 &rst     iat =   309,   311,   314,   316,
   r1 = -91.0, r2 = -90.0, r3 = 210.0, r4 = 211.0,
 &end

# 23 LEU CHI2:  (23 LEU CA)-(23 LEU CB)-(23 LEU CG)-(23 LEU CD1) -330.0 -30.0
 &rst     iat =   309,   311,   314,   316,
   r1 = -331.0, r2 = -330.0, r3 = -30.0, r4 = -29.0,
 &end

# 23 LEU CHI2:  (23 LEU CA)-(23 LEU CB)-(23 LEU CG)-(23 LEU CD1) -210.0  90.0
 &rst     iat =   309,   311,   314,   316,
   r1 = -211.0, r2 = -210.0, r3 =  90.0, r4 =  91.0,
 &end

# 24 LYS CHI1:  (24 LYS N)-(24 LYS CA)-(24 LYS CB)-(24 LYS CG) -90.0 210.0
 &rst     iat =   326,   328,   330,   333,
   r1 = -91.0, r2 = -90.0, r3 = 210.0, r4 = 211.0,
 &end

# 24 LYS CHI1:  (24 LYS N)-(24 LYS CA)-(24 LYS CB)-(24 LYS CG) -330.0 -30.0
 &rst     iat =   326,   328,   330,   333,
   r1 = -331.0, r2 = -330.0, r3 = -30.0, r4 = -29.0,
 &end

# 24 LYS CHI1:  (24 LYS N)-(24 LYS CA)-(24 LYS CB)-(24 LYS CG) -210.0  90.0
 &rst     iat =   326,   328,   330,   333,
   r1 = -211.0, r2 = -210.0, r3 =  90.0, r4 =  91.0,
 &end

# 24 LYS CHI2:  (24 LYS CA)-(24 LYS CB)-(24 LYS CG)-(24 LYS CD) -90.0 210.0
 &rst     iat =   328,   330,   333,   336,
   r1 = -91.0, r2 = -90.0, r3 = 210.0, r4 = 211.0,
 &end

# 24 LYS CHI2:  (24 LYS CA)-(24 LYS CB)-(24 LYS CG)-(24 LYS CD) -330.0 -30.0
 &rst     iat =   328,   330,   333,   336,
   r1 = -331.0, r2 = -330.0, r3 = -30.0, r4 = -29.0,
 &end

# 24 LYS CHI2:  (24 LYS CA)-(24 LYS CB)-(24 LYS CG)-(24 LYS CD) -210.0  90.0
 &rst     iat =   328,   330,   333,   336,
   r1 = -211.0, r2 = -210.0, r3 =  90.0, r4 =  91.0,
 &end

# 24 LYS CHI3:  (24 LYS CB)-(24 LYS CG)-(24 LYS CD)-(24 LYS CE) -90.0 210.0
 &rst     iat =   330,   333,   336,   339,
   r1 = -91.0, r2 = -90.0, r3 = 210.0, r4 = 211.0,
 &end

# 24 LYS CHI3:  (24 LYS CB)-(24 LYS CG)-(24 LYS CD)-(24 LYS CE) -330.0 -30.0
 &rst     iat =   330,   333,   336,   339,
   r1 = -331.0, r2 = -330.0, r3 = -30.0, r4 = -29.0,
 &end

# 24 LYS CHI3:  (24 LYS CB)-(24 LYS CG)-(24 LYS CD)-(24 LYS CE) -210.0  90.0
 &rst     iat =   330,   333,   336,   339,
   r1 = -211.0, r2 = -210.0, r3 =  90.0, r4 =  91.0,
 &end

# 24 LYS CHI4:  (24 LYS CG)-(24 LYS CD)-(24 LYS CE)-(24 LYS NZ) -90.0 210.0
 &rst     iat =   333,   336,   339,   342,
   r1 = -91.0, r2 = -90.0, r3 = 210.0, r4 = 211.0,
 &end

# 24 LYS CHI4:  (24 LYS CG)-(24 LYS CD)-(24 LYS CE)-(24 LYS NZ) -330.0 -30.0
 &rst     iat =   333,   336,   339,   342,
   r1 = -331.0, r2 = -330.0, r3 = -30.0, r4 = -29.0,
 &end

# 24 LYS CHI4:  (24 LYS CG)-(24 LYS CD)-(24 LYS CE)-(24 LYS NZ) -210.0  90.0
 &rst     iat =   333,   336,   339,   342,
   r1 = -211.0, r2 = -210.0, r3 =  90.0, r4 =  91.0,
 &end

# 25 HIS CHI1:  (25 HIE N)-(25 HIE CA)-(25 HIE CB)-(25 HIE CG) -90.0 210.0
 &rst     iat =   348,   350,   352,   355,
   r1 = -91.0, r2 = -90.0, r3 = 210.0, r4 = 211.0,
 &end

# 25 HIS CHI1:  (25 HIE N)-(25 HIE CA)-(25 HIE CB)-(25 HIE CG) -330.0 -30.0
 &rst     iat =   348,   350,   352,   355,
   r1 = -331.0, r2 = -330.0, r3 = -30.0, r4 = -29.0,
 &end

# 25 HIS CHI1:  (25 HIE N)-(25 HIE CA)-(25 HIE CB)-(25 HIE CG) -210.0  90.0
 &rst     iat =   348,   350,   352,   355,
   r1 = -211.0, r2 = -210.0, r3 =  90.0, r4 =  91.0,
 &end

# 26 CYS CHI1:  (26 CYX N)-(26 CYX CA)-(26 CYX CB)-(26 CYX SG) -90.0 210.0
 &rst     iat =   365,   367,   369,   372,
   r1 = -91.0, r2 = -90.0, r3 = 210.0, r4 = 211.0,
 &end

# 26 CYS CHI1:  (26 CYX N)-(26 CYX CA)-(26 CYX CB)-(26 CYX SG) -330.0 -30.0
 &rst     iat =   365,   367,   369,   372,
   r1 = -331.0, r2 = -330.0, r3 = -30.0, r4 = -29.0,
 &end

# 26 CYS CHI1:  (26 CYX N)-(26 CYX CA)-(26 CYX CB)-(26 CYX SG) -210.0  90.0
 &rst     iat =   365,   367,   369,   372,
   r1 = -211.0, r2 = -210.0, r3 =  90.0, r4 =  91.0,
 &end

# 27 LYS CHI1:  (27 LYS N)-(27 LYS CA)-(27 LYS CB)-(27 LYS CG) -90.0 210.0
 &rst     iat =   375,   377,   379,   382,
   r1 = -91.0, r2 = -90.0, r3 = 210.0, r4 = 211.0,
 &end

# 27 LYS CHI1:  (27 LYS N)-(27 LYS CA)-(27 LYS CB)-(27 LYS CG) -330.0 -30.0
 &rst     iat =   375,   377,   379,   382,
   r1 = -331.0, r2 = -330.0, r3 = -30.0, r4 = -29.0,
 &end

# 27 LYS CHI1:  (27 LYS N)-(27 LYS CA)-(27 LYS CB)-(27 LYS CG) -210.0  90.0
 &rst     iat =   375,   377,   379,   382,
   r1 = -211.0, r2 = -210.0, r3 =  90.0, r4 =  91.0,
 &end

# 27 LYS CHI2:  (27 LYS CA)-(27 LYS CB)-(27 LYS CG)-(27 LYS CD) -90.0 210.0
 &rst     iat =   377,   379,   382,   385,
   r1 = -91.0, r2 = -90.0, r3 = 210.0, r4 = 211.0,
 &end

# 27 LYS CHI2:  (27 LYS CA)-(27 LYS CB)-(27 LYS CG)-(27 LYS CD) -330.0 -30.0
 &rst     iat =   377,   379,   382,   385,
   r1 = -331.0, r2 = -330.0, r3 = -30.0, r4 = -29.0,
 &end

# 27 LYS CHI2:  (27 LYS CA)-(27 LYS CB)-(27 LYS CG)-(27 LYS CD) -210.0  90.0
 &rst     iat =   377,   379,   382,   385,
   r1 = -211.0, r2 = -210.0, r3 =  90.0, r4 =  91.0,
 &end

# 27 LYS CHI3:  (27 LYS CB)-(27 LYS CG)-(27 LYS CD)-(27 LYS CE) -90.0 210.0
 &rst     iat =   379,   382,   385,   388,
   r1 = -91.0, r2 = -90.0, r3 = 210.0, r4 = 211.0,
 &end

# 27 LYS CHI3:  (27 LYS CB)-(27 LYS CG)-(27 LYS CD)-(27 LYS CE) -330.0 -30.0
 &rst     iat =   379,   382,   385,   388,
   r1 = -331.0, r2 = -330.0, r3 = -30.0, r4 = -29.0,
 &end

# 27 LYS CHI3:  (27 LYS CB)-(27 LYS CG)-(27 LYS CD)-(27 LYS CE) -210.0  90.0
 &rst     iat =   379,   382,   385,   388,
   r1 = -211.0, r2 = -210.0, r3 =  90.0, r4 =  91.0,
 &end

# 27 LYS CHI4:  (27 LYS CG)-(27 LYS CD)-(27 LYS CE)-(27 LYS NZ) -90.0 210.0
 &rst     iat =   382,   385,   388,   391,
   r1 = -91.0, r2 = -90.0, r3 = 210.0, r4 = 211.0,
 &end

# 27 LYS CHI4:  (27 LYS CG)-(27 LYS CD)-(27 LYS CE)-(27 LYS NZ) -330.0 -30.0
 &rst     iat =   382,   385,   388,   391,
   r1 = -331.0, r2 = -330.0, r3 = -30.0, r4 = -29.0,
 &end

# 27 LYS CHI4:  (27 LYS CG)-(27 LYS CD)-(27 LYS CE)-(27 LYS NZ) -210.0  90.0
 &rst     iat =   382,   385,   388,   391,
   r1 = -211.0, r2 = -210.0, r3 =  90.0, r4 =  91.0,
 &end

# 28 CYS CHI1:  (28 CYX N)-(28 CYX CA)-(28 CYX CB)-(28 CYX SG) -90.0 210.0
 &rst     iat =   397,   399,   401,   404,
   r1 = -91.0, r2 = -90.0, r3 = 210.0, r4 = 211.0,
 &end

# 28 CYS CHI1:  (28 CYX N)-(28 CYX CA)-(28 CYX CB)-(28 CYX SG) -330.0 -30.0
 &rst     iat =   397,   399,   401,   404,
   r1 = -331.0, r2 = -330.0, r3 = -30.0, r4 = -29.0,
 &end

# 28 CYS CHI1:  (28 CYX N)-(28 CYX CA)-(28 CYX CB)-(28 CYX SG) -210.0  90.0
 &rst     iat =   397,   399,   401,   404,
   r1 = -211.0, r2 = -210.0, r3 =  90.0, r4 =  91.0,
 &end

# 29 ILE CHI1:  (29 ILE N)-(29 ILE CA)-(29 ILE CB)-(29 ILE CG1) -90.0 210.0
 &rst     iat =   407,   409,   411,   417,
   r1 = -91.0, r2 = -90.0, r3 = 210.0, r4 = 211.0,
 &end

# 29 ILE CHI1:  (29 ILE N)-(29 ILE CA)-(29 ILE CB)-(29 ILE CG1) -330.0 -30.0
 &rst     iat =   407,   409,   411,   417,
   r1 = -331.0, r2 = -330.0, r3 = -30.0, r4 = -29.0,
 &end

# 29 ILE CHI1:  (29 ILE N)-(29 ILE CA)-(29 ILE CB)-(29 ILE CG1) -210.0  90.0
 &rst     iat =   407,   409,   411,   417,
   r1 = -211.0, r2 = -210.0, r3 =  90.0, r4 =  91.0,
 &end

# 29 ILE CHI21:  (29 ILE CA)-(29 ILE CB)-(29 ILE CG1)-(29 ILE CD1) -90.0 210.0
 &rst     iat =   409,   411,   417,   420,
   r1 = -91.0, r2 = -90.0, r3 = 210.0, r4 = 211.0,
 &end

# 29 ILE CHI21:  (29 ILE CA)-(29 ILE CB)-(29 ILE CG1)-(29 ILE CD1) -330.0 -30.0
 &rst     iat =   409,   411,   417,   420,
   r1 = -331.0, r2 = -330.0, r3 = -30.0, r4 = -29.0,
 &end

# 29 ILE CHI21:  (29 ILE CA)-(29 ILE CB)-(29 ILE CG1)-(29 ILE CD1) -210.0  90.0
 &rst     iat =   409,   411,   417,   420,
   r1 = -211.0, r2 = -210.0, r3 =  90.0, r4 =  91.0,
 &end

# 31 ARG CHI1:  (31 ARG N)-(31 ARG CA)-(31 ARG CB)-(31 ARG CG) -90.0 210.0
 &rst     iat =   440,   442,   444,   447,
   r1 = -91.0, r2 = -90.0, r3 = 210.0, r4 = 211.0,
 &end

# 31 ARG CHI1:  (31 ARG N)-(31 ARG CA)-(31 ARG CB)-(31 ARG CG) -330.0 -30.0
 &rst     iat =   440,   442,   444,   447,
   r1 = -331.0, r2 = -330.0, r3 = -30.0, r4 = -29.0,
 &end

# 31 ARG CHI1:  (31 ARG N)-(31 ARG CA)-(31 ARG CB)-(31 ARG CG) -210.0  90.0
 &rst     iat =   440,   442,   444,   447,
   r1 = -211.0, r2 = -210.0, r3 =  90.0, r4 =  91.0,
 &end

# 31 ARG CHI2:  (31 ARG CA)-(31 ARG CB)-(31 ARG CG)-(31 ARG CD) -90.0 210.0
 &rst     iat =   442,   444,   447,   450,
   r1 = -91.0, r2 = -90.0, r3 = 210.0, r4 = 211.0,
 &end

# 31 ARG CHI2:  (31 ARG CA)-(31 ARG CB)-(31 ARG CG)-(31 ARG CD) -330.0 -30.0
 &rst     iat =   442,   444,   447,   450,
   r1 = -331.0, r2 = -330.0, r3 = -30.0, r4 = -29.0,
 &end

# 31 ARG CHI2:  (31 ARG CA)-(31 ARG CB)-(31 ARG CG)-(31 ARG CD) -210.0  90.0
 &rst     iat =   442,   444,   447,   450,
   r1 = -211.0, r2 = -210.0, r3 =  90.0, r4 =  91.0,
 &end

# 31 ARG CHI3:  (31 ARG CB)-(31 ARG CG)-(31 ARG CD)-(31 ARG NE) -90.0 210.0
 &rst     iat =   444,   447,   450,   453,
   r1 = -91.0, r2 = -90.0, r3 = 210.0, r4 = 211.0,
 &end

# 31 ARG CHI3:  (31 ARG CB)-(31 ARG CG)-(31 ARG CD)-(31 ARG NE) -330.0 -30.0
 &rst     iat =   444,   447,   450,   453,
   r1 = -331.0, r2 = -330.0, r3 = -30.0, r4 = -29.0,
 &end

# 31 ARG CHI3:  (31 ARG CB)-(31 ARG CG)-(31 ARG CD)-(31 ARG NE) -210.0  90.0
 &rst     iat =   444,   447,   450,   453,
   r1 = -211.0, r2 = -210.0, r3 =  90.0, r4 =  91.0,
 &end


  Entry H atom name         Submitted Coord H atom name
  Start of MODEL    1
    1    H1   GLY   1           H1       GLY   1  16.059  19.755  38.248
    2    H2   GLY   1           H2       GLY   1  17.156  19.009  37.279
    3    H3   GLY   1           H3       GLY   1  16.131  20.114  36.639
    4    HA2  GLY   1           HA2      GLY   1  18.119  20.755  38.709
    5    HA3  GLY   1           HA3      GLY   1  18.426  20.928  36.964
    6    H    SER   2           H        SER   2  18.750  23.247  38.139
    7    HA   SER   2           HA       SER   2  16.342  24.790  38.518
    8    HB2  SER   2           HB2      SER   2  17.831  26.660  38.808
    9    HB3  SER   2           HB3      SER   2  18.525  25.238  39.611
   10    HG   SER   2           HG       SER   2  20.204  25.842  38.475
   11    H    GLY   3           H        GLY   3  17.503  23.651  35.656
   12    HA2  GLY   3           HA2      GLY   3  16.682  24.263  33.454
   13    HA3  GLY   3           HA3      GLY   3  16.553  25.938  33.987
   14    H    CYS   4           H        CYS   4  19.996  24.845  32.311
   15    HA   CYS   4           HA       CYS   4  18.125  22.680  33.015
   16    HB2  CYS   4           HB2      CYS   4  19.932  22.971  31.004
   17    HB3  CYS   4           HB3      CYS   4  20.943  22.130  32.175
   18    H    MET   5           H        MET   5  21.538  23.457  33.764
   19    HA   MET   5           HA       MET   5  20.771  24.045  36.495
   20    HB2  MET   5           HB2      MET   5  23.224  22.307  35.944
   21    HB3  MET   5           HB3      MET   5  22.837  23.100  37.472
   22    HG2  MET   5           HG2      MET   5  20.717  21.772  37.572
   23    HG3  MET   5           HG3      MET   5  21.237  20.894  36.132
   24    HE1  MET   5           HE1      MET   5  20.694  18.735  37.730
   25    HE2  MET   5           HE2      MET   5  21.581  18.398  39.236
   26    HE3  MET   5           HE3      MET   5  20.443  19.763  39.164
   27    H    LYS   6           H        LYS   6  21.935  25.969  37.156
   28    HA   LYS   6           HA       LYS   6  23.050  27.509  34.992
   29    HB2  LYS   6           HB2      LYS   6  21.802  28.410  36.985
   30    HB3  LYS   6           HB3      LYS   6  23.245  28.099  37.966
   31    HG2  LYS   6           HG2      LYS   6  24.544  29.684  36.657
   32    HG3  LYS   6           HG3      LYS   6  23.261  29.816  35.447
   33    HD2  LYS   6           HD2      LYS   6  23.406  31.784  36.900
   34    HD3  LYS   6           HD3      LYS   6  21.826  31.005  36.989
   35    HE2  LYS   6           HE2      LYS   6  22.304  30.048  39.146
   36    HE3  LYS   6           HE3      LYS   6  24.026  30.438  39.012
   37    HZ1  LYS   6           HZ1      LYS   6  23.433  32.797  39.072
   38    HZ2  LYS   6           HZ2      LYS   6  21.845  32.439  39.211
   39    HZ3  LYS   6           HZ3      LYS   6  22.902  32.025  40.422
   40    H    GLU   7           H        GLU   7  24.534  25.427  37.326
   41    HA   GLU   7           HA       GLU   7  27.299  26.132  36.864
   42    HB2  GLU   7           HB2      GLU   7  26.016  23.472  37.693
   43    HB3  GLU   7           HB3      GLU   7  27.720  23.871  37.813
   44    HG2  GLU   7           HG2      GLU   7  26.747  23.970  39.995
   45    HG3  GLU   7           HG3      GLU   7  27.217  25.591  39.520
   46    H    TYR   8           H        TYR   8  25.332  23.415  35.582
   47    HA   TYR   8           HA       TYR   8  27.107  22.400  33.653
   48    HB2  TYR   8           HB2      TYR   8  25.049  21.293  34.337
   49    HB3  TYR   8           HB3      TYR   8  24.069  22.596  33.728
   50    HD1  TYR   8           HD1      TYR   8  26.150  19.699  32.739
   51    HD2  TYR   8           HD2      TYR   8  23.502  22.829  31.394
   52    HE1  TYR   8           HE1      TYR   8  25.825  18.497  30.554
   53    HE2  TYR   8           HE2      TYR   8  23.170  21.626  29.229
   54    HH   TYR   8           HH       TYR   8  24.540  18.398  28.622
   55    H    CYS   9           H        CYS   9  24.605  24.941  33.233
   56    HA   CYS   9           HA       CYS   9  25.091  25.310  30.471
   57    HB2  CYS   9           HB2      CYS   9  23.817  27.064  32.581
   58    HB3  CYS   9           HB3      CYS   9  23.869  27.513  30.882
   59    H    ALA  10           H        ALA  10  26.838  26.860  33.218
   60    HA   ALA  10           HA       ALA  10  28.334  28.554  31.330
   61    HB1  ALA  10           HB1      ALA  10  28.710  28.018  34.297
   62    HB2  ALA  10           HB2      ALA  10  29.550  29.263  33.347
   63    HB3  ALA  10           HB3      ALA  10  27.794  29.367  33.569
   64    H    GLY  11           H        GLY  11  28.725  25.391  32.789
   65    HA2  GLY  11           HA2      GLY  11  31.499  24.969  32.050
   66    HA3  GLY  11           HA3      GLY  11  30.311  23.755  32.535
   67    H    GLN  12           H        GLN  12  28.591  24.968  30.161
   68    HA   GLN  12           HA       GLN  12  29.989  23.545  27.913
   69    HB2  GLN  12           HB2      GLN  12  27.012  23.823  28.464
   70    HB3  GLN  12           HB3      GLN  12  27.731  23.002  27.082
   71    HG2  GLN  12           HG2      GLN  12  28.028  22.158  29.998
   72    HG3  GLN  12           HG3      GLN  12  26.955  21.433  28.817
   73   HE21  GLN  12          HE22      GLN  12  28.823  19.925  30.265
   74   HE22  GLN  12          HE21      GLN  12  29.979  19.291  29.112
   75    H    CYS  13           H        CYS  13  27.963  26.432  28.663
   76    HA   CYS  13           HA       CYS  13  28.447  27.422  25.881
   77    HB2  CYS  13           HB2      CYS  13  26.159  26.386  26.457
   78    HB3  CYS  13           HB3      CYS  13  25.936  27.787  27.512
   79    H    ARG  14           H        ARG  14  28.505  29.689  25.615
   80    HA   ARG  14           HA       ARG  14  29.319  31.156  28.102
   81    HB2  ARG  14           HB2      ARG  14  30.567  31.170  25.340
   82    HB3  ARG  14           HB3      ARG  14  31.188  32.026  26.730
   83    HG2  ARG  14           HG2      ARG  14  31.161  28.999  26.301
   84    HG3  ARG  14           HG3      ARG  14  32.554  30.064  26.259
   85    HD2  ARG  14           HD2      ARG  14  30.922  29.292  28.698
   86    HD3  ARG  14           HD3      ARG  14  32.596  28.865  28.325
   87    HE   ARG  14           HE       ARG  14  32.666  31.621  28.334
   88   HH11  ARG  14          HH11      ARG  14  31.730  29.280  30.821
   89   HH12  ARG  14          HH12      ARG  14  32.312  30.387  32.048
   90   HH21  ARG  14          HH21      ARG  14  32.974  32.966  29.945
   91   HH22  ARG  14          HH22      ARG  14  32.618  32.468  31.609
   92    H    GLY  15           H        GLY  15  29.077  33.187  28.418
   93    HA2  GLY  15           HA2      GLY  15  28.485  35.425  28.014
   94    HA3  GLY  15           HA3      GLY  15  27.897  35.000  26.400
   95    H    LYS  16           H        LYS  16  26.482  36.590  28.275
   96    HA   LYS  16           HA       LYS  16  24.851  35.242  30.146
   97    HB2  LYS  16           HB2      LYS  16  25.332  37.664  30.176
   98    HB3  LYS  16           HB3      LYS  16  24.378  37.892  28.703
   99    HG2  LYS  16           HG2      LYS  16  22.340  37.122  29.908
  100    HG3  LYS  16           HG3      LYS  16  23.300  36.902  31.381
  101    HD2  LYS  16           HD2      LYS  16  23.747  39.325  31.483
  102    HD3  LYS  16           HD3      LYS  16  22.918  39.555  29.924
  103    HE2  LYS  16           HE2      LYS  16  20.839  38.575  30.930
  104    HE3  LYS  16           HE3      LYS  16  21.649  38.509  32.500
  105    HZ1  LYS  16           HZ1      LYS  16  21.765  40.915  32.487
  106    HZ2  LYS  16           HZ2      LYS  16  21.167  41.011  30.955
  107    HZ3  LYS  16           HZ3      LYS  16  20.231  40.477  32.192
  108    H    VAL  17           H        VAL  17  24.129  36.019  26.757
  109    HA   VAL  17           HA       VAL  17  21.335  35.186  26.965
  110    HB   VAL  17           HB       VAL  17  22.976  35.888  24.509
  111   HG11  VAL  17          HG11      VAL  17  20.753  36.418  23.506
  112   HG12  VAL  17          HG12      VAL  17  20.890  34.705  23.900
  113   HG13  VAL  17          HG13      VAL  17  19.949  35.776  24.953
  114   HG21  VAL  17          HG21      VAL  17  22.924  37.752  26.110
  115   HG22  VAL  17          HG22      VAL  17  21.887  38.113  24.725
  116   HG23  VAL  17          HG23      VAL  17  21.168  37.597  26.271
  117    H    SER  18           H        SER  18  24.356  33.809  25.616
  118    HA   SER  18           HA       SER  18  23.254  31.453  24.506
  119    HB2  SER  18           HB2      SER  18  25.950  31.646  25.858
  120    HB3  SER  18           HB3      SER  18  25.505  30.777  24.378
  121    HG   SER  18           HG       SER  18  26.701  32.963  24.479
  122    H    GLN  19           H        GLN  19  24.842  32.007  27.711
  123    HA   GLN  19           HA       GLN  19  24.022  29.570  28.929
  124    HB2  GLN  19           HB2      GLN  19  24.595  32.354  30.020
  125    HB3  GLN  19           HB3      GLN  19  24.274  30.965  31.061
  126    HG2  GLN  19           HG2      GLN  19  26.149  29.743  30.201
  127    HG3  GLN  19           HG3      GLN  19  26.395  30.865  28.867
  128   HE21  GLN  19          HE22      GLN  19  28.562  30.290  30.088
  129   HE22  GLN  19          HE21      GLN  19  29.062  31.535  31.256
  130    H    ASP  20           H        ASP  20  22.106  32.640  28.665
  131    HA   ASP  20           HA       ASP  20  19.873  31.719  30.179
  132    HB2  ASP  20           HB2      ASP  20  20.210  34.062  29.691
  133    HB3  ASP  20           HB3      ASP  20  20.062  33.768  27.951
  134    H    TYR  21           H        TYR  21  20.606  31.384  26.663
  135    HA   TYR  21           HA       TYR  21  18.189  30.041  25.969
  136    HB2  TYR  21           HB2      TYR  21  20.086  30.936  24.475
  137    HB3  TYR  21           HB3      TYR  21  20.905  29.416  24.788
  138    HD1  TYR  21           HD2      TYR  21  19.909  27.251  23.857
  139    HD2  TYR  21           HD1      TYR  21  18.151  31.129  23.092
  140    HE1  TYR  21           HE2      TYR  21  18.531  26.283  22.025
  141    HE2  TYR  21           HE1      TYR  21  16.777  30.142  21.260
  142    HH   TYR  21           HH       TYR  21  16.195  28.240  20.130
  143    H    CYS  22           H        CYS  22  21.198  28.790  27.431
  144    HA   CYS  22           HA       CYS  22  20.373  26.002  27.362
  145    HB2  CYS  22           HB2      CYS  22  22.691  26.618  27.449
  146    HB3  CYS  22           HB3      CYS  22  22.478  27.485  28.963
  147    H    LEU  23           H        LEU  23  19.947  28.598  29.736
  148    HA   LEU  23           HA       LEU  23  18.651  27.100  31.770
  149    HB2  LEU  23           HB2      LEU  23  19.040  29.916  30.961
  150    HB3  LEU  23           HB3      LEU  23  17.529  29.633  31.810
  151    HG   LEU  23           HG       LEU  23  18.745  28.715  33.722
  152   HD11  LEU  23          HD11      LEU  23  21.313  29.454  32.250
  153   HD12  LEU  23          HD12      LEU  23  21.190  28.853  33.913
  154   HD13  LEU  23          HD13      LEU  23  20.777  27.793  32.558
  155   HD21  LEU  23          HD21      LEU  23  19.874  30.799  34.426
  156   HD22  LEU  23          HD22      LEU  23  19.817  31.367  32.735
  157   HD23  LEU  23          HD23      LEU  23  18.303  31.083  33.653
  158    H    LYS  24           H        LYS  24  17.451  28.062  28.684
  159    HA   LYS  24           HA       LYS  24  14.603  27.445  29.371
  160    HB2  LYS  24           HB2      LYS  24  15.968  28.758  26.994
  161    HB3  LYS  24           HB3      LYS  24  14.231  28.394  27.056
  162    HG2  LYS  24           HG2      LYS  24  13.929  29.834  28.968
  163    HG3  LYS  24           HG3      LYS  24  15.683  30.091  29.110
  164    HD2  LYS  24           HD2      LYS  24  15.774  31.334  27.052
  165    HD3  LYS  24           HD3      LYS  24  14.088  30.927  26.671
  166    HE2  LYS  24           HE2      LYS  24  14.264  33.226  27.525
  167    HE3  LYS  24           HE3      LYS  24  13.273  32.202  28.570
  168    HZ1  LYS  24           HZ1      LYS  24  16.088  33.016  29.091
  169    HZ2  LYS  24           HZ2      LYS  24  14.750  33.513  29.914
  170    HZ3  LYS  24           HZ3      LYS  24  15.233  31.972  30.043
  171    H    HIS  25           H        HIS  25  17.224  26.318  27.328
  172    HA   HIS  25           HA       HIS  25  15.477  24.136  26.199
  173    HB2  HIS  25           HB2      HIS  25  17.623  25.835  24.880
  174    HB3  HIS  25           HB3      HIS  25  16.715  24.562  24.099
  175    HD2  HIS  25           HD2      HIS  25  16.529  28.244  24.827
  176    HE1  HIS  25           HE1      HIS  25  12.669  27.188  23.354
  177    HE2  HIS  25           HE2      HIS  25  14.248  29.122  23.820
  178    H    CYS  26           H        CYS  26  18.049  24.298  28.269
  179    HA   CYS  26           HA       CYS  26  19.781  22.991  28.833
  180    HB2  CYS  26           HB2      CYS  26  17.942  20.892  27.682
  181    HB3  CYS  26           HB3      CYS  26  19.411  20.503  28.563
  182    H    LYS  27           H        LYS  27  20.045  24.230  26.193
  183    HA   LYS  27           HA       LYS  27  22.438  22.776  25.299
  184    HB2  LYS  27           HB2      LYS  27  21.808  22.803  22.963
  185    HB3  LYS  27           HB3      LYS  27  20.632  21.869  23.866
  186    HG2  LYS  27           HG2      LYS  27  19.083  23.843  23.851
  187    HG3  LYS  27           HG3      LYS  27  20.264  24.753  22.903
  188    HD2  LYS  27           HD2      LYS  27  18.861  22.198  22.059
  189    HD3  LYS  27           HD3      LYS  27  18.463  23.809  21.501
  190    HE2  LYS  27           HE2      LYS  27  21.112  22.370  21.000
  191    HE3  LYS  27           HE3      LYS  27  19.789  22.511  19.850
  192    HZ1  LYS  27           HZ1      LYS  27  21.362  24.800  20.910
  193    HZ2  LYS  27           HZ2      LYS  27  21.423  24.197  19.397
  194    HZ3  LYS  27           HZ3      LYS  27  20.054  24.925  19.911
  195    H    CYS  28           H        CYS  28  23.720  24.064  23.791
  196    HA   CYS  28           HA       CYS  28  23.734  26.868  24.527
  197    HB2  CYS  28           HB2      CYS  28  25.730  25.279  24.049
  198    HB3  CYS  28           HB3      CYS  28  25.420  25.635  22.348
  199    H    ILE  29           H        ILE  29  23.861  28.603  22.903
  200    HA   ILE  29           HA       ILE  29  21.323  28.588  21.499
  201    HB   ILE  29           HB       ILE  29  22.054  30.401  22.961
  202   HG12  ILE  29          HG12      ILE  29  21.538  31.395  20.133
  203   HG13  ILE  29          HG13      ILE  29  20.318  30.746  21.237
  204   HG21  ILE  29          HG21      ILE  29  24.468  30.450  22.303
  205   HG22  ILE  29          HG22      ILE  29  23.998  31.243  20.783
  206   HG23  ILE  29          HG23      ILE  29  23.708  32.041  22.335
  207   HD11  ILE  29          HD11      ILE  29  20.180  33.118  21.355
  208   HD12  ILE  29          HD12      ILE  29  20.870  32.541  22.885
  209   HD13  ILE  29          HD13      ILE  29  21.919  33.286  21.650
  210    HA   PRO  30           HA       PRO  30  23.092  27.738  17.495
  211    HB2  PRO  30           HB2      PRO  30  20.990  28.289  15.834
  212    HB3  PRO  30           HB3      PRO  30  21.024  26.883  16.944
  213    HG2  PRO  30           HG2      PRO  30  19.746  29.602  17.412
  214    HG3  PRO  30           HG3      PRO  30  18.998  27.983  17.610
  215    HD2  PRO  30           HD2      PRO  30  20.046  29.313  19.706
  216    HD3  PRO  30           HD3      PRO  30  20.260  27.554  19.575
  217    H    ARG  31           H        ARG  31  23.595  28.736  15.407
  218    HA   ARG  31           HA       ARG  31  23.870  31.727  15.468
  219    HB2  ARG  31           HB2      ARG  31  25.837  29.747  14.263
  220    HB3  ARG  31           HB3      ARG  31  26.041  31.486  14.411
  221    HG2  ARG  31           HG2      ARG  31  25.967  29.474  16.703
  222    HG3  ARG  31           HG3      ARG  31  27.406  30.237  16.036
  223    HD2  ARG  31           HD2      ARG  31  26.716  32.426  16.823
  224    HD3  ARG  31           HD3      ARG  31  25.146  31.791  17.349
  225    HE   ARG  31           HE       ARG  31  27.084  30.259  18.676
  226   HH11  ARG  31          HH21      ARG  31  25.969  33.597  18.729
  227   HH12  ARG  31          HH22      ARG  31  26.194  33.721  20.459
  228   HH21  ARG  31          HH11      ARG  31  27.588  30.618  20.818
  229   HH22  ARG  31          HH12      ARG  31  27.264  32.196  21.531
  Start of MODEL    2
    1    H1   GLY   1           H1       GLY   1   9.188  21.939  34.371
    2    H2   GLY   1           H2       GLY   1   9.147  21.627  35.986
    3    H3   GLY   1           H3       GLY   1  10.579  21.574  35.193
    4    HA2  GLY   1           HA2      GLY   1   8.957  24.025  35.406
    5    HA3  GLY   1           HA3      GLY   1  10.261  23.596  36.551
    6    H    SER   2           H        SER   2  11.455  25.475  35.950
    7    HA   SER   2           HA       SER   2  13.001  25.055  33.443
    8    HB2  SER   2           HB2      SER   2  13.676  27.305  33.475
    9    HB3  SER   2           HB3      SER   2  11.933  27.332  33.772
   10    HG   SER   2           HG       SER   2  12.374  27.595  35.986
   11    H    GLY   3           H        GLY   3  16.134  24.865  35.282
   12    HA2  GLY   3           HA2      GLY   3  14.835  25.265  32.592
   13    HA3  GLY   3           HA3      GLY   3  16.279  26.112  33.142
   14    H    CYS   4           H        CYS   4  18.080  24.693  33.915
   15    HA   CYS   4           HA       CYS   4  18.189  21.932  32.889
   16    HB2  CYS   4           HB2      CYS   4  18.951  23.521  31.091
   17    HB3  CYS   4           HB3      CYS   4  20.227  24.065  32.141
   18    H    MET   5           H        MET   5  21.098  23.577  33.746
   19    HA   MET   5           HA       MET   5  20.708  23.782  36.585
   20    HB2  MET   5           HB2      MET   5  22.905  21.915  35.594
   21    HB3  MET   5           HB3      MET   5  22.793  22.575  37.218
   22    HG2  MET   5           HG2      MET   5  20.644  21.351  37.520
   23    HG3  MET   5           HG3      MET   5  20.868  20.636  35.914
   24    HE1  MET   5           HE1      MET   5  20.315  18.867  38.339
   25    HE2  MET   5           HE2      MET   5  20.736  18.144  36.768
   26    HE3  MET   5           HE3      MET   5  21.554  17.595  38.249
   27    H    LYS   6           H        LYS   6  22.030  25.489  37.332
   28    HA   LYS   6           HA       LYS   6  22.888  27.346  35.354
   29    HB2  LYS   6           HB2      LYS   6  22.001  27.884  37.591
   30    HB3  LYS   6           HB3      LYS   6  23.464  27.253  38.345
   31    HG2  LYS   6           HG2      LYS   6  24.839  28.981  37.304
   32    HG3  LYS   6           HG3      LYS   6  23.444  29.575  36.382
   33    HD2  LYS   6           HD2      LYS   6  23.680  29.628  39.430
   34    HD3  LYS   6           HD3      LYS   6  24.009  30.973  38.348
   35    HE2  LYS   6           HE2      LYS   6  21.574  30.476  37.428
   36    HE3  LYS   6           HE3      LYS   6  21.353  29.662  38.996
   37    HZ1  LYS   6           HZ1      LYS   6  22.097  32.481  38.538
   38    HZ2  LYS   6           HZ2      LYS   6  20.646  31.936  39.106
   39    HZ3  LYS   6           HZ3      LYS   6  22.035  31.825  40.030
   40    H    GLU   7           H        GLU   7  24.864  25.272  37.461
   41    HA   GLU   7           HA       GLU   7  27.429  26.320  36.596
   42    HB2  GLU   7           HB2      GLU   7  26.653  23.692  37.928
   43    HB3  GLU   7           HB3      GLU   7  28.310  24.238  37.692
   44    HG2  GLU   7           HG2      GLU   7  27.868  26.261  39.044
   45    HG3  GLU   7           HG3      GLU   7  26.204  25.731  39.342
   46    H    TYR   8           H        TYR   8  25.527  23.465  35.706
   47    HA   TYR   8           HA       TYR   8  27.295  22.199  33.876
   48    HB2  TYR   8           HB2      TYR   8  25.266  21.167  34.810
   49    HB3  TYR   8           HB3      TYR   8  24.269  22.388  34.029
   50    HD1  TYR   8           HD2      TYR   8  26.300  19.369  33.437
   51    HD2  TYR   8           HD1      TYR   8  23.666  22.322  31.718
   52    HE1  TYR   8           HE2      TYR   8  26.050  17.957  31.374
   53    HE2  TYR   8           HE1      TYR   8  23.455  20.947  29.659
   54    HH   TYR   8           HH       TYR   8  24.110  19.083  28.580
   55    H    CYS   9           H        CYS   9  24.762  24.672  33.344
   56    HA   CYS   9           HA       CYS   9  25.144  24.965  30.533
   57    HB2  CYS   9           HB2      CYS   9  23.935  26.701  32.712
   58    HB3  CYS   9           HB3      CYS   9  23.999  27.232  31.035
   59    H    ALA  10           H        ALA  10  26.598  26.840  33.269
   60    HA   ALA  10           HA       ALA  10  28.257  28.466  31.571
   61    HB1  ALA  10           HB1      ALA  10  27.778  29.020  33.909
   62    HB2  ALA  10           HB2      ALA  10  28.625  27.560  34.459
   63    HB3  ALA  10           HB3      ALA  10  29.524  28.863  33.652
   64    H    GLY  11           H        GLY  11  28.606  25.127  32.724
   65    HA2  GLY  11           HA2      GLY  11  31.292  24.711  31.785
   66    HA3  GLY  11           HA3      GLY  11  30.095  23.482  32.185
   67    H    GLN  12           H        GLN  12  28.402  25.067  29.870
   68    HA   GLN  12           HA       GLN  12  29.910  23.930  27.569
   69    HB2  GLN  12           HB2      GLN  12  28.012  22.926  26.568
   70    HB3  GLN  12           HB3      GLN  12  28.366  22.211  28.137
   71    HG2  GLN  12           HG2      GLN  12  26.490  23.197  29.147
   72    HG3  GLN  12           HG3      GLN  12  26.328  24.415  27.882
   73   HE21  GLN  12          HE22      GLN  12  26.169  20.747  28.162
   74   HE22  GLN  12          HE21      GLN  12  24.732  20.687  27.144
   75    H    CYS  13           H        CYS  13  28.240  26.721  28.628
   76    HA   CYS  13           HA       CYS  13  28.381  27.815  25.864
   77    HB2  CYS  13           HB2      CYS  13  26.067  26.774  26.735
   78    HB3  CYS  13           HB3      CYS  13  25.931  28.339  27.524
   79    H    ARG  14           H        ARG  14  28.418  30.179  25.771
   80    HA   ARG  14           HA       ARG  14  28.806  31.688  28.281
   81    HB2  ARG  14           HB2      ARG  14  31.075  32.396  27.663
   82    HB3  ARG  14           HB3      ARG  14  30.897  30.710  28.120
   83    HG2  ARG  14           HG2      ARG  14  30.906  30.110  25.624
   84    HG3  ARG  14           HG3      ARG  14  31.274  31.804  25.292
   85    HD2  ARG  14           HD2      ARG  14  33.283  30.444  25.245
   86    HD3  ARG  14           HD3      ARG  14  33.377  31.591  26.592
   87    HE   ARG  14           HE       ARG  14  32.306  29.297  27.738
   88   HH11  ARG  14          HH11      ARG  14  35.271  29.563  25.825
   89   HH12  ARG  14          HH12      ARG  14  36.034  28.373  26.868
   90   HH21  ARG  14          HH21      ARG  14  33.346  27.812  28.827
   91   HH22  ARG  14          HH22      ARG  14  35.010  27.422  28.455
   92    H    GLY  15           H        GLY  15  29.010  33.872  28.176
   93    HA2  GLY  15           HA2      GLY  15  28.255  35.970  27.258
   94    HA3  GLY  15           HA3      GLY  15  27.616  35.123  25.837
   95    H    LYS  16           H        LYS  16  26.315  36.845  28.054
   96    HA   LYS  16           HA       LYS  16  24.908  35.121  29.833
   97    HB2  LYS  16           HB2      LYS  16  25.456  37.510  30.173
   98    HB3  LYS  16           HB3      LYS  16  24.220  37.983  29.019
   99    HG2  LYS  16           HG2      LYS  16  23.525  36.277  31.450
  100    HG3  LYS  16           HG3      LYS  16  23.787  38.016  31.614
  101    HD2  LYS  16           HD2      LYS  16  22.031  38.432  29.880
  102    HD3  LYS  16           HD3      LYS  16  21.631  36.716  29.887
  103    HE2  LYS  16           HE2      LYS  16  21.529  38.562  32.313
  104    HE3  LYS  16           HE3      LYS  16  20.145  38.139  31.301
  105    HZ1  LYS  16           HZ1      LYS  16  20.522  35.794  31.913
  106    HZ2  LYS  16           HZ2      LYS  16  21.709  36.236  32.973
  107    HZ3  LYS  16           HZ3      LYS  16  20.165  36.727  33.201
  108    H    VAL  17           H        VAL  17  23.931  36.331  26.653
  109    HA   VAL  17           HA       VAL  17  21.221  35.284  26.808
  110    HB   VAL  17           HB       VAL  17  21.912  37.129  25.318
  111   HG11  VAL  17          HG11      VAL  17  23.097  35.018  23.483
  112   HG12  VAL  17          HG12      VAL  17  22.925  36.753  23.174
  113   HG13  VAL  17          HG13      VAL  17  24.042  36.192  24.427
  114   HG21  VAL  17          HG21      VAL  17  20.621  34.802  23.854
  115   HG22  VAL  17          HG22      VAL  17  19.794  35.893  24.990
  116   HG23  VAL  17          HG23      VAL  17  20.459  36.526  23.472
  117    H    SER  18           H        SER  18  24.323  33.984  25.665
  118    HA   SER  18           HA       SER  18  23.360  31.609  24.494
  119    HB2  SER  18           HB2      SER  18  26.078  32.031  25.769
  120    HB3  SER  18           HB3      SER  18  25.667  31.140  24.309
  121    HG   SER  18           HG       SER  18  26.491  33.047  23.570
  122    H    GLN  19           H        GLN  19  24.757  32.304  27.732
  123    HA   GLN  19           HA       GLN  19  24.101  29.759  28.911
  124    HB2  GLN  19           HB2      GLN  19  24.622  32.537  30.034
  125    HB3  GLN  19           HB3      GLN  19  24.343  31.121  31.061
  126    HG2  GLN  19           HG2      GLN  19  26.235  29.956  30.246
  127    HG3  GLN  19           HG3      GLN  19  26.440  31.035  28.874
  128   HE21  GLN  19          HE22      GLN  19  28.609  30.431  30.228
  129   HE22  GLN  19          HE21      GLN  19  29.200  31.896  30.996
  130    H    ASP  20           H        ASP  20  22.092  32.719  28.514
  131    HA   ASP  20           HA       ASP  20  19.831  31.766  30.005
  132    HB2  ASP  20           HB2      ASP  20  20.063  34.114  29.387
  133    HB3  ASP  20           HB3      ASP  20  19.987  33.702  27.674
  134    H    TYR  21           H        TYR  21  20.680  31.403  26.499
  135    HA   TYR  21           HA       TYR  21  18.434  29.847  25.764
  136    HB2  TYR  21           HB2      TYR  21  20.459  30.686  24.364
  137    HB3  TYR  21           HB3      TYR  21  21.225  29.175  24.812
  138    HD1  TYR  21           HD2      TYR  21  20.112  26.924  23.975
  139    HD2  TYR  21           HD1      TYR  21  18.745  30.854  22.757
  140    HE1  TYR  21           HE2      TYR  21  18.904  25.930  22.080
  141    HE2  TYR  21           HE1      TYR  21  17.524  29.817  20.853
  142    HH   TYR  21           HH       TYR  21  17.639  26.305  20.218
  143    H    CYS  22           H        CYS  22  21.361  28.805  27.569
  144    HA   CYS  22           HA       CYS  22  20.548  26.001  27.521
  145    HB2  CYS  22           HB2      CYS  22  22.865  26.717  27.659
  146    HB3  CYS  22           HB3      CYS  22  22.579  27.433  29.243
  147    H    LEU  23           H        LEU  23  19.982  28.668  29.781
  148    HA   LEU  23           HA       LEU  23  18.480  27.088  31.698
  149    HB2  LEU  23           HB2      LEU  23  19.099  29.948  31.105
  150    HB3  LEU  23           HB3      LEU  23  17.603  29.651  31.984
  151    HG   LEU  23           HG       LEU  23  18.779  28.483  33.767
  152   HD11  LEU  23          HD11      LEU  23  21.345  29.035  32.212
  153   HD12  LEU  23          HD12      LEU  23  21.258  28.450  33.884
  154   HD13  LEU  23          HD13      LEU  23  20.653  27.435  32.573
  155   HD21  LEU  23          HD21      LEU  23  20.116  31.105  32.997
  156   HD22  LEU  23          HD22      LEU  23  18.578  30.931  33.872
  157   HD23  LEU  23          HD23      LEU  23  20.090  30.401  34.631
  158    H    LYS  24           H        LYS  24  17.580  28.423  28.582
  159    HA   LYS  24           HA       LYS  24  14.693  27.825  29.080
  160    HB2  LYS  24           HB2      LYS  24  16.177  29.271  26.849
  161    HB3  LYS  24           HB3      LYS  24  14.441  28.906  26.802
  162    HG2  LYS  24           HG2      LYS  24  14.141  30.143  28.928
  163    HG3  LYS  24           HG3      LYS  24  15.865  30.571  28.901
  164    HD2  LYS  24           HD2      LYS  24  15.591  31.871  26.882
  165    HD3  LYS  24           HD3      LYS  24  13.973  31.228  26.607
  166    HE2  LYS  24           HE2      LYS  24  13.852  33.523  27.404
  167    HE3  LYS  24           HE3      LYS  24  13.069  32.397  28.519
  168    HZ1  LYS  24           HZ1      LYS  24  14.504  34.136  29.554
  169    HZ2  LYS  24           HZ2      LYS  24  14.897  32.607  30.026
  170    HZ3  LYS  24           HZ3      LYS  24  15.838  33.403  28.952
  171    H    HIS  25           H        HIS  25  17.344  26.331  27.539
  172    HA   HIS  25           HA       HIS  25  15.511  24.339  26.208
  173    HB2  HIS  25           HB2      HIS  25  18.014  25.593  25.018
  174    HB3  HIS  25           HB3      HIS  25  16.997  24.389  24.264
  175    HD2  HIS  25           HD2      HIS  25  17.005  28.145  25.119
  176    HE1  HIS  25           HE1      HIS  25  14.054  27.522  22.140
  177    HE2  HIS  25           HE2      HIS  25  15.373  29.281  23.447
  178    H    CYS  26           H        CYS  26  18.162  24.522  28.373
  179    HA   CYS  26           HA       CYS  26  19.816  23.207  28.993
  180    HB2  CYS  26           HB2      CYS  26  17.662  21.945  29.537
  181    HB3  CYS  26           HB3      CYS  26  18.119  20.818  28.280
  182    H    LYS  27           H        LYS  27  20.108  24.166  26.477
  183    HA   LYS  27           HA       LYS  27  22.163  22.421  25.222
  184    HB2  LYS  27           HB2      LYS  27  19.968  23.996  23.801
  185    HB3  LYS  27           HB3      LYS  27  21.301  23.177  22.996
  186    HG2  LYS  27           HG2      LYS  27  20.440  21.016  23.481
  187    HG3  LYS  27           HG3      LYS  27  19.298  21.639  24.681
  188    HD2  LYS  27           HD2      LYS  27  18.127  22.932  22.868
  189    HD3  LYS  27           HD3      LYS  27  19.212  22.185  21.691
  190    HE2  LYS  27           HE2      LYS  27  17.230  20.827  21.678
  191    HE3  LYS  27           HE3      LYS  27  18.494  19.919  22.523
  192    HZ1  LYS  27           HZ1      LYS  27  16.151  21.275  23.710
  193    HZ2  LYS  27           HZ2      LYS  27  16.614  19.687  23.829
  194    HZ3  LYS  27           HZ3      LYS  27  17.442  20.850  24.630
  195    H    CYS  28           H        CYS  28  23.712  23.748  23.970
  196    HA   CYS  28           HA       CYS  28  23.804  26.580  24.777
  197    HB2  CYS  28           HB2      CYS  28  25.847  25.132  24.549
  198    HB3  CYS  28           HB3      CYS  28  25.605  25.196  22.804
  199    H    ILE  29           H        ILE  29  24.100  28.242  23.080
  200    HA   ILE  29           HA       ILE  29  21.614  28.348  21.599
  201    HB   ILE  29           HB       ILE  29  22.455  30.162  22.999
  202   HG12  ILE  29          HG12      ILE  29  22.238  31.162  20.144
  203   HG13  ILE  29          HG13      ILE  29  20.866  30.580  21.088
  204   HG21  ILE  29          HG21      ILE  29  24.867  29.966  22.526
  205   HG22  ILE  29          HG22      ILE  29  24.604  30.598  20.890
  206   HG23  ILE  29          HG23      ILE  29  24.295  31.617  22.299
  207   HD11  ILE  29          HD11      ILE  29  22.597  32.979  21.782
  208   HD12  ILE  29          HD12      ILE  29  20.919  32.981  21.220
  209   HD13  ILE  29          HD13      ILE  29  21.312  32.318  22.817
  210    HA   PRO  30           HA       PRO  30  23.661  27.866  17.562
  211    HB2  PRO  30           HB2      PRO  30  21.555  27.805  15.911
  212    HB3  PRO  30           HB3      PRO  30  21.805  26.517  17.133
  213    HG2  PRO  30           HG2      PRO  30  19.992  28.939  17.307
  214    HG3  PRO  30           HG3      PRO  30  19.600  27.237  17.698
  215    HD2  PRO  30           HD2      PRO  30  20.357  29.121  19.573
  216    HD3  PRO  30           HD3      PRO  30  20.639  27.366  19.766
  217    H    ARG  31           H        ARG  31  24.070  28.998  15.651
  218    HA   ARG  31           HA       ARG  31  23.334  31.899  15.523
  219    HB2  ARG  31           HB2      ARG  31  25.600  30.446  14.101
  220    HB3  ARG  31           HB3      ARG  31  25.187  32.157  13.982
  221    HG2  ARG  31           HG2      ARG  31  25.616  32.319  16.514
  222    HG3  ARG  31           HG3      ARG  31  26.259  30.673  16.418
  223    HD2  ARG  31           HD2      ARG  31  28.099  32.243  16.308
  224    HD3  ARG  31           HD3      ARG  31  27.916  31.461  14.724
  225    HE   ARG  31           HE       ARG  31  26.460  33.999  15.018
  226   HH11  ARG  31          HH11      ARG  31  29.590  32.740  13.971
  227   HH12  ARG  31          HH12      ARG  31  29.734  34.022  12.789
  228   HH21  ARG  31          HH21      ARG  31  26.731  35.488  13.602
  229   HH22  ARG  31          HH22      ARG  31  28.220  35.647  12.683
  Start of MODEL    3
    1    H1   GLY   1           H1       GLY   1  12.441  25.858  28.455
    2    H2   GLY   1           H2       GLY   1  10.889  26.392  28.522
    3    H3   GLY   1           H3       GLY   1  11.224  24.772  28.579
    4    HA2  GLY   1           HA2      GLY   1  10.659  25.588  30.781
    5    HA3  GLY   1           HA3      GLY   1  12.311  24.949  30.665
    6    H    SER   2           H        SER   2  12.545  26.311  32.634
    7    HA   SER   2           HA       SER   2  13.580  28.997  31.834
    8    HB2  SER   2           HB2      SER   2  12.787  30.055  33.804
    9    HB3  SER   2           HB3      SER   2  11.409  29.282  33.015
   10    HG   SER   2           HG       SER   2  11.508  27.602  34.522
   11    H    GLY   3           H        GLY   3  14.329  26.005  33.267
   12    HA2  GLY   3           HA2      GLY   3  17.060  26.868  33.425
   13    HA3  GLY   3           HA3      GLY   3  16.448  26.457  35.033
   14    H    CYS   4           H        CYS   4  18.542  25.093  33.976
   15    HA   CYS   4           HA       CYS   4  17.414  22.364  33.817
   16    HB2  CYS   4           HB2      CYS   4  18.245  23.131  31.509
   17    HB3  CYS   4           HB3      CYS   4  19.865  23.086  32.174
   18    H    MET   5           H        MET   5  20.828  23.366  33.809
   19    HA   MET   5           HA       MET   5  20.895  23.647  36.706
   20    HB2  MET   5           HB2      MET   5  22.725  21.664  35.278
   21    HB3  MET   5           HB3      MET   5  23.106  22.406  36.830
   22    HG2  MET   5           HG2      MET   5  20.948  21.453  37.741
   23    HG3  MET   5           HG3      MET   5  20.772  20.578  36.215
   24    HE1  MET   5           HE1      MET   5  22.505  20.816  39.667
   25    HE2  MET   5           HE2      MET   5  23.885  19.710  39.539
   26    HE3  MET   5           HE3      MET   5  23.916  21.264  38.682
   27    H    LYS   6           H        LYS   6  22.075  25.484  37.135
   28    HA   LYS   6           HA       LYS   6  22.977  27.018  34.903
   29    HB2  LYS   6           HB2      LYS   6  22.022  27.839  37.142
   30    HB3  LYS   6           HB3      LYS   6  23.666  27.657  37.793
   31    HG2  LYS   6           HG2      LYS   6  24.507  29.216  36.018
   32    HG3  LYS   6           HG3      LYS   6  22.888  29.299  35.335
   33    HD2  LYS   6           HD2      LYS   6  22.997  31.268  36.552
   34    HD3  LYS   6           HD3      LYS   6  22.102  30.191  37.609
   35    HE2  LYS   6           HE2      LYS   6  23.673  31.446  38.918
   36    HE3  LYS   6           HE3      LYS   6  24.223  29.763  38.909
   37    HZ1  LYS   6           HZ1      LYS   6  25.882  31.671  38.450
   38    HZ2  LYS   6           HZ2      LYS   6  25.994  30.335  37.495
   39    HZ3  LYS   6           HZ3      LYS   6  25.278  31.694  36.930
   40    H    GLU   7           H        GLU   7  24.800  25.070  37.221
   41    HA   GLU   7           HA       GLU   7  27.429  25.926  36.382
   42    HB2  GLU   7           HB2      GLU   7  26.392  23.360  37.643
   43    HB3  GLU   7           HB3      GLU   7  28.104  23.730  37.445
   44    HG2  GLU   7           HG2      GLU   7  27.990  25.665  38.881
   45    HG3  GLU   7           HG3      GLU   7  26.238  25.666  38.905
   46    H    TYR   8           H        TYR   8  25.219  23.472  35.103
   47    HA   TYR   8           HA       TYR   8  27.108  22.296  33.216
   48    HB2  TYR   8           HB2      TYR   8  25.107  21.099  33.945
   49    HB3  TYR   8           HB3      TYR   8  24.070  22.378  33.337
   50    HD1  TYR   8           HD2      TYR   8  26.586  19.856  32.290
   51    HD2  TYR   8           HD1      TYR   8  23.283  22.347  31.107
   52    HE1  TYR   8           HE2      TYR   8  26.437  18.638  30.091
   53    HE2  TYR   8           HE1      TYR   8  23.139  21.149  28.918
   54    HH   TYR   8           HH       TYR   8  24.017  19.472  27.586
   55    H    CYS   9           H        CYS   9  24.442  24.702  32.938
   56    HA   CYS   9           HA       CYS   9  24.981  25.325  30.239
   57    HB2  CYS   9           HB2      CYS   9  23.511  26.773  32.463
   58    HB3  CYS   9           HB3      CYS   9  23.521  27.348  30.802
   59    H    ALA  10           H        ALA  10  26.253  27.033  33.147
   60    HA   ALA  10           HA       ALA  10  27.676  28.983  31.557
   61    HB1  ALA  10           HB1      ALA  10  26.915  29.408  33.868
   62    HB2  ALA  10           HB2      ALA  10  28.005  28.135  34.457
   63    HB3  ALA  10           HB3      ALA  10  28.675  29.604  33.717
   64    H    GLY  11           H        GLY  11  28.378  25.695  32.376
   65    HA2  GLY  11           HA2      GLY  11  31.284  25.889  31.926
   66    HA3  GLY  11           HA3      GLY  11  30.315  24.433  32.147
   67    H    GLN  12           H        GLN  12  28.464  24.473  30.190
   68    HA   GLN  12           HA       GLN  12  30.046  23.800  27.835
   69    HB2  GLN  12           HB2      GLN  12  27.036  23.689  28.255
   70    HB3  GLN  12           HB3      GLN  12  27.951  22.861  26.998
   71    HG2  GLN  12           HG2      GLN  12  28.140  22.291  29.986
   72    HG3  GLN  12           HG3      GLN  12  27.235  21.361  28.807
   73   HE21  GLN  12          HE22      GLN  12  28.349  19.764  27.600
   74   HE22  GLN  12          HE21      GLN  12  30.066  19.461  27.841
   75    H    CYS  13           H        CYS  13  28.194  26.626  28.688
   76    HA   CYS  13           HA       CYS  13  28.319  27.620  25.877
   77    HB2  CYS  13           HB2      CYS  13  26.069  26.570  26.795
   78    HB3  CYS  13           HB3      CYS  13  25.938  28.106  27.652
   79    H    ARG  14           H        ARG  14  28.480  29.899  25.636
   80    HA   ARG  14           HA       ARG  14  29.041  31.500  28.107
   81    HB2  ARG  14           HB2      ARG  14  30.962  31.435  25.785
   82    HB3  ARG  14           HB3      ARG  14  31.137  32.187  27.371
   83    HG2  ARG  14           HG2      ARG  14  32.515  30.357  27.653
   84    HG3  ARG  14           HG3      ARG  14  31.012  29.696  28.279
   85    HD2  ARG  14           HD2      ARG  14  30.675  28.898  25.747
   86    HD3  ARG  14           HD3      ARG  14  32.395  29.235  25.623
   87    HE   ARG  14           HE       ARG  14  31.942  27.548  27.896
   88   HH11  ARG  14          HH11      ARG  14  32.405  27.418  24.437
   89   HH12  ARG  14          HH12      ARG  14  32.734  25.696  24.523
   90   HH21  ARG  14          HH21      ARG  14  32.092  25.326  27.798
   91   HH22  ARG  14          HH22      ARG  14  32.291  24.531  26.245
   92    H    GLY  15           H        GLY  15  29.165  33.700  27.899
   93    HA2  GLY  15           HA2      GLY  15  28.368  35.782  27.013
   94    HA3  GLY  15           HA3      GLY  15  27.572  34.924  25.677
   95    H    LYS  16           H        LYS  16  26.544  36.756  27.938
   96    HA   LYS  16           HA       LYS  16  25.265  35.238  29.957
   97    HB2  LYS  16           HB2      LYS  16  25.701  37.663  30.086
   98    HB3  LYS  16           HB3      LYS  16  24.481  37.973  28.844
   99    HG2  LYS  16           HG2      LYS  16  22.690  37.104  30.296
  100    HG3  LYS  16           HG3      LYS  16  23.898  36.644  31.513
  101    HD2  LYS  16           HD2      LYS  16  24.530  39.005  31.835
  102    HD3  LYS  16           HD3      LYS  16  23.325  39.489  30.634
  103    HE2  LYS  16           HE2      LYS  16  22.599  37.873  33.113
  104    HE3  LYS  16           HE3      LYS  16  22.696  39.637  33.138
  105    HZ1  LYS  16           HZ1      LYS  16  20.441  38.921  32.724
  106    HZ2  LYS  16           HZ2      LYS  16  21.018  39.751  31.444
  107    HZ3  LYS  16           HZ3      LYS  16  20.849  38.118  31.353
  108    H    VAL  17           H        VAL  17  24.021  36.153  26.763
  109    HA   VAL  17           HA       VAL  17  21.355  35.102  27.362
  110    HB   VAL  17           HB       VAL  17  22.477  36.211  24.775
  111   HG11  VAL  17          HG11      VAL  17  19.601  35.664  25.685
  112   HG12  VAL  17          HG12      VAL  17  20.066  36.573  24.224
  113   HG13  VAL  17          HG13      VAL  17  20.463  34.864  24.343
  114   HG21  VAL  17          HG21      VAL  17  21.198  38.252  25.450
  115   HG22  VAL  17          HG22      VAL  17  20.828  37.489  27.016
  116   HG23  VAL  17          HG23      VAL  17  22.498  37.893  26.574
  117    H    SER  18           H        SER  18  24.293  33.925  25.726
  118    HA   SER  18           HA       SER  18  23.194  31.546  24.612
  119    HB2  SER  18           HB2      SER  18  25.932  31.821  25.863
  120    HB3  SER  18           HB3      SER  18  25.453  30.892  24.458
  121    HG   SER  18           HG       SER  18  26.675  32.859  24.159
  122    H    GLN  19           H        GLN  19  24.857  32.183  27.783
  123    HA   GLN  19           HA       GLN  19  24.243  29.681  28.981
  124    HB2  GLN  19           HB2      GLN  19  24.679  32.463  30.145
  125    HB3  GLN  19           HB3      GLN  19  24.498  31.005  31.148
  126    HG2  GLN  19           HG2      GLN  19  26.364  29.926  30.016
  127    HG3  GLN  19           HG3      GLN  19  26.559  31.277  28.912
  128   HE21  GLN  19          HE22      GLN  19  28.742  30.496  30.063
  129   HE22  GLN  19          HE21      GLN  19  29.284  31.748  31.173
  130    H    ASP  20           H        ASP  20  22.198  32.646  28.865
  131    HA   ASP  20           HA       ASP  20  20.050  31.538  30.387
  132    HB2  ASP  20           HB2      ASP  20  20.299  33.936  29.962
  133    HB3  ASP  20           HB3      ASP  20  19.985  33.672  28.240
  134    H    TYR  21           H        TYR  21  20.640  31.426  26.799
  135    HA   TYR  21           HA       TYR  21  18.238  30.090  26.085
  136    HB2  TYR  21           HB2      TYR  21  20.084  31.006  24.584
  137    HB3  TYR  21           HB3      TYR  21  20.986  29.544  24.916
  138    HD1  TYR  21           HD2      TYR  21  19.847  27.216  24.198
  139    HD2  TYR  21           HD1      TYR  21  18.459  31.110  22.905
  140    HE1  TYR  21           HE2      TYR  21  18.792  26.207  22.211
  141    HE2  TYR  21           HE1      TYR  21  17.364  30.049  20.939
  142    HH   TYR  21           HH       TYR  21  17.083  28.112  19.731
  143    H    CYS  22           H        CYS  22  21.209  28.784  27.555
  144    HA   CYS  22           HA       CYS  22  20.316  26.005  27.324
  145    HB2  CYS  22           HB2      CYS  22  22.652  26.553  27.276
  146    HB3  CYS  22           HB3      CYS  22  22.568  27.333  28.842
  147    H    LEU  23           H        LEU  23  20.009  28.525  29.821
  148    HA   LEU  23           HA       LEU  23  18.660  26.809  31.735
  149    HB2  LEU  23           HB2      LEU  23  19.073  29.723  31.233
  150    HB3  LEU  23           HB3      LEU  23  17.621  29.308  32.139
  151    HG   LEU  23           HG       LEU  23  18.886  28.227  33.863
  152   HD11  LEU  23          HD11      LEU  23  20.726  27.182  32.643
  153   HD12  LEU  23          HD12      LEU  23  21.400  28.783  32.244
  154   HD13  LEU  23          HD13      LEU  23  21.346  28.213  33.926
  155   HD21  LEU  23          HD21      LEU  23  18.688  30.693  33.935
  156   HD22  LEU  23          HD22      LEU  23  20.165  30.130  34.727
  157   HD23  LEU  23          HD23      LEU  23  20.247  30.845  33.097
  158    H    LYS  24           H        LYS  24  17.443  28.823  29.010
  159    HA   LYS  24           HA       LYS  24  14.688  28.104  29.326
  160    HB2  LYS  24           HB2      LYS  24  16.206  28.985  26.843
  161    HB3  LYS  24           HB3      LYS  24  14.458  28.910  26.974
  162    HG2  LYS  24           HG2      LYS  24  16.240  30.748  28.635
  163    HG3  LYS  24           HG3      LYS  24  15.368  31.196  27.180
  164    HD2  LYS  24           HD2      LYS  24  13.238  30.541  28.373
  165    HD3  LYS  24           HD3      LYS  24  14.178  30.363  29.855
  166    HE2  LYS  24           HE2      LYS  24  13.979  32.917  28.183
  167    HE3  LYS  24           HE3      LYS  24  13.021  32.573  29.628
  168    HZ1  LYS  24           HZ1      LYS  24  14.871  33.902  30.299
  169    HZ2  LYS  24           HZ2      LYS  24  15.156  32.394  30.859
  170    HZ3  LYS  24           HZ3      LYS  24  15.976  32.959  29.557
  171    H    HIS  25           H        HIS  25  17.221  26.459  27.470
  172    HA   HIS  25           HA       HIS  25  15.243  24.396  26.558
  173    HB2  HIS  25           HB2      HIS  25  17.541  25.766  25.113
  174    HB3  HIS  25           HB3      HIS  25  16.592  24.491  24.410
  175    HD2  HIS  25           HD2      HIS  25  16.768  28.088  24.349
  176    HE1  HIS  25           HE1      HIS  25  12.575  27.457  23.992
  177    HE2  HIS  25           HE2      HIS  25  14.458  29.160  23.725
  178    H    CYS  26           H        CYS  26  18.002  24.453  28.494
  179    HA   CYS  26           HA       CYS  26  19.752  23.160  28.872
  180    HB2  CYS  26           HB2      CYS  26  17.680  21.829  29.607
  181    HB3  CYS  26           HB3      CYS  26  18.124  20.703  28.323
  182    H    LYS  27           H        LYS  27  19.858  24.105  26.260
  183    HA   LYS  27           HA       LYS  27  22.137  22.464  25.374
  184    HB2  LYS  27           HB2      LYS  27  21.525  22.843  22.955
  185    HB3  LYS  27           HB3      LYS  27  20.575  21.609  23.778
  186    HG2  LYS  27           HG2      LYS  27  18.631  22.959  23.830
  187    HG3  LYS  27           HG3      LYS  27  19.539  24.453  23.619
  188    HD2  LYS  27           HD2      LYS  27  18.298  23.970  21.638
  189    HD3  LYS  27           HD3      LYS  27  20.028  23.900  21.285
  190    HE2  LYS  27           HE2      LYS  27  19.997  21.487  21.157
  191    HE3  LYS  27           HE3      LYS  27  18.406  21.418  21.932
  192    HZ1  LYS  27           HZ1      LYS  27  17.455  22.495  19.998
  193    HZ2  LYS  27           HZ2      LYS  27  18.908  22.459  19.191
  194    HZ3  LYS  27           HZ3      LYS  27  18.159  21.063  19.595
  195    H    CYS  28           H        CYS  28  23.692  23.736  24.125
  196    HA   CYS  28           HA       CYS  28  23.626  26.575  24.768
  197    HB2  CYS  28           HB2      CYS  28  25.679  25.090  24.594
  198    HB3  CYS  28           HB3      CYS  28  25.480  25.173  22.843
  199    H    ILE  29           H        ILE  29  23.955  28.233  23.058
  200    HA   ILE  29           HA       ILE  29  21.489  28.244  21.556
  201    HB   ILE  29           HB       ILE  29  22.204  30.080  22.972
  202   HG12  ILE  29          HG12      ILE  29  21.929  31.037  20.100
  203   HG13  ILE  29          HG13      ILE  29  20.601  30.422  21.082
  204   HG21  ILE  29          HG21      ILE  29  24.648  30.031  22.483
  205   HG22  ILE  29          HG22      ILE  29  24.316  30.736  20.888
  206   HG23  ILE  29          HG23      ILE  29  23.955  31.646  22.360
  207   HD11  ILE  29          HD11      ILE  29  20.538  32.821  21.175
  208   HD12  ILE  29          HD12      ILE  29  21.061  32.241  22.767
  209   HD13  ILE  29          HD13      ILE  29  22.242  32.925  21.625
  210    HA   PRO  30           HA       PRO  30  23.179  27.469  17.447
  211    HB2  PRO  30           HB2      PRO  30  20.899  29.215  16.533
  212    HB3  PRO  30           HB3      PRO  30  21.415  27.617  15.907
  213    HG2  PRO  30           HG2      PRO  30  19.261  27.802  17.531
  214    HG3  PRO  30           HG3      PRO  30  20.461  26.494  17.799
  215    HD2  PRO  30           HD2      PRO  30  20.221  29.148  19.240
  216    HD3  PRO  30           HD3      PRO  30  20.438  27.502  19.916
  217    H    ARG  31           H        ARG  31  23.937  28.669  15.464
  218    HA   ARG  31           HA       ARG  31  25.450  30.994  15.954
  219    HB2  ARG  31           HB2      ARG  31  25.995  29.241  14.328
  220    HB3  ARG  31           HB3      ARG  31  24.575  29.668  13.353
  221    HG2  ARG  31           HG2      ARG  31  25.471  31.844  12.875
  222    HG3  ARG  31           HG3      ARG  31  26.754  31.637  14.079
  223    HD2  ARG  31           HD2      ARG  31  27.696  31.448  11.864
  224    HD3  ARG  31           HD3      ARG  31  27.800  29.886  12.690
  225    HE   ARG  31           HE       ARG  31  25.403  29.841  11.198
  226   HH11  ARG  31          HH21      ARG  31  28.760  30.469  10.171
  227   HH12  ARG  31          HH22      ARG  31  28.411  29.668   8.647
  228   HH21  ARG  31          HH11      ARG  31  25.394  28.471   9.386
  229   HH22  ARG  31          HH12      ARG  31  26.737  28.656   8.258
  Start of MODEL    4
    1    H1   GLY   1           H1       GLY   1   8.871  25.792  37.480
    2    H2   GLY   1           H2       GLY   1   9.136  24.862  38.811
    3    H3   GLY   1           H3       GLY   1   9.724  24.388  37.343
    4    HA2  GLY   1           HA2      GLY   1  10.580  26.729  38.906
    5    HA3  GLY   1           HA3      GLY   1  11.522  25.248  38.642
    6    H    SER   2           H        SER   2  12.939  27.236  37.958
    7    HA   SER   2           HA       SER   2  12.706  27.693  35.002
    8    HB2  SER   2           HB2      SER   2  13.785  29.499  37.198
    9    HB3  SER   2           HB3      SER   2  13.936  29.827  35.464
   10    HG   SER   2           HG       SER   2  11.772  30.010  35.264
   11    H    GLY   3           H        GLY   3  14.681  27.807  33.776
   12    HA2  GLY   3           HA2      GLY   3  16.926  27.381  33.306
   13    HA3  GLY   3           HA3      GLY   3  17.226  27.075  35.007
   14    H    CYS   4           H        CYS   4  18.637  25.409  33.872
   15    HA   CYS   4           HA       CYS   4  17.144  22.829  33.850
   16    HB2  CYS   4           HB2      CYS   4  17.910  23.372  31.520
   17    HB3  CYS   4           HB3      CYS   4  19.580  23.292  32.082
   18    H    MET   5           H        MET   5  20.639  23.564  33.715
   19    HA   MET   5           HA       MET   5  20.974  23.107  36.591
   20    HB2  MET   5           HB2      MET   5  22.453  21.610  34.404
   21    HB3  MET   5           HB3      MET   5  23.070  21.763  36.055
   22    HG2  MET   5           HG2      MET   5  21.136  20.541  36.905
   23    HG3  MET   5           HG3      MET   5  20.392  20.513  35.308
   24    HE1  MET   5           HE1      MET   5  24.137  18.009  36.440
   25    HE2  MET   5           HE2      MET   5  24.257  19.764  36.234
   26    HE3  MET   5           HE3      MET   5  23.286  19.087  37.564
   27    H    LYS   6           H        LYS   6  21.815  24.946  37.230
   28    HA   LYS   6           HA       LYS   6  22.641  27.028  35.601
   29    HB2  LYS   6           HB2      LYS   6  21.756  27.133  37.915
   30    HB3  LYS   6           HB3      LYS   6  23.295  26.513  38.533
   31    HG2  LYS   6           HG2      LYS   6  24.457  28.519  37.800
   32    HG3  LYS   6           HG3      LYS   6  23.037  29.085  36.926
   33    HD2  LYS   6           HD2      LYS   6  23.317  30.303  39.043
   34    HD3  LYS   6           HD3      LYS   6  21.805  29.418  38.972
   35    HE2  LYS   6           HE2      LYS   6  22.695  29.225  41.190
   36    HE3  LYS   6           HE3      LYS   6  22.746  27.634  40.418
   37    HZ1  LYS   6           HZ1      LYS   6  25.113  27.947  40.041
   38    HZ2  LYS   6           HZ2      LYS   6  25.071  29.471  40.664
   39    HZ3  LYS   6           HZ3      LYS   6  24.786  28.159  41.621
   40    H    GLU   7           H        GLU   7  24.769  24.716  37.274
   41    HA   GLU   7           HA       GLU   7  27.227  26.100  36.539
   42    HB2  GLU   7           HB2      GLU   7  26.618  23.333  37.627
   43    HB3  GLU   7           HB3      GLU   7  28.238  23.810  37.183
   44    HG2  GLU   7           HG2      GLU   7  27.873  24.082  39.603
   45    HG3  GLU   7           HG3      GLU   7  28.316  25.592  38.799
   46    H    TYR   8           H        TYR   8  25.511  23.275  35.243
   47    HA   TYR   8           HA       TYR   8  27.293  22.467  33.196
   48    HB2  TYR   8           HB2      TYR   8  25.315  21.168  33.934
   49    HB3  TYR   8           HB3      TYR   8  24.262  22.458  33.410
   50    HD1  TYR   8           HD2      TYR   8  26.809  20.091  32.055
   51    HD2  TYR   8           HD1      TYR   8  23.287  22.466  31.299
   52    HE1  TYR   8           HE2      TYR   8  26.632  19.104  29.755
   53    HE2  TYR   8           HE1      TYR   8  23.151  21.532  28.997
   54    HH   TYR   8           HH       TYR   8  25.354  18.979  27.812
   55    H    CYS   9           H        CYS   9  24.494  24.718  33.009
   56    HA   CYS   9           HA       CYS   9  24.976  25.448  30.288
   57    HB2  CYS   9           HB2      CYS   9  23.359  26.665  32.555
   58    HB3  CYS   9           HB3      CYS   9  23.377  27.349  30.930
   59    H    ALA  10           H        ALA  10  26.039  27.019  33.346
   60    HA   ALA  10           HA       ALA  10  27.249  29.274  32.061
   61    HB1  ALA  10           HB1      ALA  10  27.789  27.953  34.755
   62    HB2  ALA  10           HB2      ALA  10  28.273  29.594  34.289
   63    HB3  ALA  10           HB3      ALA  10  26.557  29.192  34.426
   64    H    GLY  11           H        GLY  11  28.407  25.987  32.552
   65    HA2  GLY  11           HA2      GLY  11  31.225  26.647  32.011
   66    HA3  GLY  11           HA3      GLY  11  30.536  25.088  32.444
   67    H    GLN  12           H        GLN  12  28.619  24.748  30.338
   68    HA   GLN  12           HA       GLN  12  30.435  24.219  28.070
   69    HB2  GLN  12           HB2      GLN  12  27.491  23.549  28.486
   70    HB3  GLN  12           HB3      GLN  12  28.468  23.028  27.109
   71    HG2  GLN  12           HG2      GLN  12  28.932  22.314  30.013
   72    HG3  GLN  12           HG3      GLN  12  28.293  21.239  28.769
   73   HE21  GLN  12          HE22      GLN  12  31.074  21.991  30.448
   74   HE22  GLN  12          HE21      GLN  12  32.285  21.497  29.277
   75    H    CYS  13           H        CYS  13  28.164  26.679  28.848
   76    HA   CYS  13           HA       CYS  13  28.296  27.719  26.043
   77    HB2  CYS  13           HB2      CYS  13  26.073  26.647  27.041
   78    HB3  CYS  13           HB3      CYS  13  25.928  28.228  27.804
   79    H    ARG  14           H        ARG  14  28.487  29.965  25.759
   80    HA   ARG  14           HA       ARG  14  29.038  31.617  28.192
   81    HB2  ARG  14           HB2      ARG  14  30.890  31.035  25.867
   82    HB3  ARG  14           HB3      ARG  14  31.126  32.393  26.972
   83    HG2  ARG  14           HG2      ARG  14  31.075  29.481  27.881
   84    HG3  ARG  14           HG3      ARG  14  32.545  30.370  27.506
   85    HD2  ARG  14           HD2      ARG  14  32.255  31.901  29.302
   86    HD3  ARG  14           HD3      ARG  14  30.567  31.486  29.513
   87    HE   ARG  14           HE       ARG  14  31.084  29.513  30.646
   88   HH11  ARG  14          HH11      ARG  14  34.152  31.060  29.710
   89   HH12  ARG  14          HH12      ARG  14  34.967  30.284  31.052
   90   HH21  ARG  14          HH21      ARG  14  32.229  28.770  32.378
   91   HH22  ARG  14          HH22      ARG  14  33.931  29.122  32.492
   92    H    GLY  15           H        GLY  15  29.120  33.745  28.046
   93    HA2  GLY  15           HA2      GLY  15  28.347  35.840  27.211
   94    HA3  GLY  15           HA3      GLY  15  27.644  35.045  25.797
   95    H    LYS  16           H        LYS  16  26.428  36.791  27.847
   96    HA   LYS  16           HA       LYS  16  24.923  35.504  29.867
   97    HB2  LYS  16           HB2      LYS  16  25.296  37.921  29.710
   98    HB3  LYS  16           HB3      LYS  16  24.419  37.994  28.186
   99    HG2  LYS  16           HG2      LYS  16  23.038  38.911  29.855
  100    HG3  LYS  16           HG3      LYS  16  22.312  37.383  29.376
  101    HD2  LYS  16           HD2      LYS  16  22.884  36.337  31.445
  102    HD3  LYS  16           HD3      LYS  16  24.126  37.549  31.802
  103    HE2  LYS  16           HE2      LYS  16  22.246  38.007  33.232
  104    HE3  LYS  16           HE3      LYS  16  22.406  39.302  32.047
  105    HZ1  LYS  16           HZ1      LYS  16  20.596  38.235  30.769
  106    HZ2  LYS  16           HZ2      LYS  16  20.407  37.110  31.986
  107    HZ3  LYS  16           HZ3      LYS  16  20.142  38.724  32.250
  108    H    VAL  17           H        VAL  17  23.998  36.168  26.493
  109    HA   VAL  17           HA       VAL  17  21.270  35.189  26.826
  110    HB   VAL  17           HB       VAL  17  22.764  35.889  24.275
  111   HG11  VAL  17          HG11      VAL  17  20.664  34.679  23.833
  112   HG12  VAL  17          HG12      VAL  17  19.781  35.767  24.930
  113   HG13  VAL  17          HG13      VAL  17  20.477  36.382  23.417
  114   HG21  VAL  17          HG21      VAL  17  21.647  38.116  24.493
  115   HG22  VAL  17          HG22      VAL  17  21.111  37.657  26.128
  116   HG23  VAL  17          HG23      VAL  17  22.841  37.827  25.753
  117    H    SER  18           H        SER  18  24.330  33.906  25.427
  118    HA   SER  18           HA       SER  18  23.328  31.473  24.419
  119    HB2  SER  18           HB2      SER  18  25.976  31.837  25.824
  120    HB3  SER  18           HB3      SER  18  25.608  30.826  24.442
  121    HG   SER  18           HG       SER  18  26.803  32.909  24.268
  122    H    GLN  19           H        GLN  19  24.800  32.210  27.637
  123    HA   GLN  19           HA       GLN  19  24.145  29.725  28.884
  124    HB2  GLN  19           HB2      GLN  19  24.497  32.542  29.989
  125    HB3  GLN  19           HB3      GLN  19  24.255  31.118  31.025
  126    HG2  GLN  19           HG2      GLN  19  26.216  30.026  30.111
  127    HG3  GLN  19           HG3      GLN  19  26.462  31.304  28.931
  128   HE21  GLN  19          HE22      GLN  19  28.572  30.735  30.248
  129   HE22  GLN  19          HE21      GLN  19  28.959  32.148  31.247
  130    H    ASP  20           H        ASP  20  22.127  32.710  28.659
  131    HA   ASP  20           HA       ASP  20  19.949  31.701  30.176
  132    HB2  ASP  20           HB2      ASP  20  20.315  34.074  29.640
  133    HB3  ASP  20           HB3      ASP  20  19.978  33.741  27.936
  134    H    TYR  21           H        TYR  21  20.560  31.481  26.613
  135    HA   TYR  21           HA       TYR  21  18.217  30.072  25.868
  136    HB2  TYR  21           HB2      TYR  21  20.151  30.945  24.431
  137    HB3  TYR  21           HB3      TYR  21  21.011  29.474  24.834
  138    HD1  TYR  21           HD2      TYR  21  19.989  27.187  24.066
  139    HD2  TYR  21           HD1      TYR  21  18.538  31.030  22.721
  140    HE1  TYR  21           HE2      TYR  21  19.046  26.128  22.041
  141    HE2  TYR  21           HE1      TYR  21  17.552  29.942  20.715
  142    HH   TYR  21           HH       TYR  21  17.364  28.003  19.501
  143    H    CYS  22           H        CYS  22  21.183  28.839  27.465
  144    HA   CYS  22           HA       CYS  22  20.281  26.055  27.352
  145    HB2  CYS  22           HB2      CYS  22  22.633  26.676  27.282
  146    HB3  CYS  22           HB3      CYS  22  22.524  27.407  28.877
  147    H    LEU  23           H        LEU  23  19.937  28.686  29.695
  148    HA   LEU  23           HA       LEU  23  18.674  26.996  31.697
  149    HB2  LEU  23           HB2      LEU  23  19.164  29.881  31.176
  150    HB3  LEU  23           HB3      LEU  23  17.710  29.533  32.105
  151    HG   LEU  23           HG       LEU  23  18.937  28.416  33.828
  152   HD11  LEU  23          HD11      LEU  23  21.412  28.211  33.845
  153   HD12  LEU  23          HD12      LEU  23  20.663  27.185  32.639
  154   HD13  LEU  23          HD13      LEU  23  21.448  28.709  32.135
  155   HD21  LEU  23          HD21      LEU  23  20.506  30.897  33.037
  156   HD22  LEU  23          HD22      LEU  23  18.954  30.879  33.913
  157   HD23  LEU  23          HD23      LEU  23  20.394  30.172  34.659
  158    H    LYS  24           H        LYS  24  17.350  28.829  28.890
  159    HA   LYS  24           HA       LYS  24  14.607  27.983  29.403
  160    HB2  LYS  24           HB2      LYS  24  15.919  28.852  26.792
  161    HB3  LYS  24           HB3      LYS  24  14.190  28.712  27.078
  162    HG2  LYS  24           HG2      LYS  24  16.088  30.741  28.309
  163    HG3  LYS  24           HG3      LYS  24  14.824  31.014  27.124
  164    HD2  LYS  24           HD2      LYS  24  13.136  30.290  28.856
  165    HD3  LYS  24           HD3      LYS  24  14.437  30.242  30.059
  166    HE2  LYS  24           HE2      LYS  24  13.909  32.694  28.339
  167    HE3  LYS  24           HE3      LYS  24  12.982  32.410  29.812
  168    HZ1  LYS  24           HZ1      LYS  24  15.005  33.842  30.061
  169    HZ2  LYS  24           HZ2      LYS  24  14.926  32.595  31.120
  170    HZ3  LYS  24           HZ3      LYS  24  15.964  32.562  29.845
  171    H    HIS  25           H        HIS  25  17.185  26.554  27.477
  172    HA   HIS  25           HA       HIS  25  15.323  24.411  26.516
  173    HB2  HIS  25           HB2      HIS  25  17.673  25.787  25.164
  174    HB3  HIS  25           HB3      HIS  25  16.700  24.547  24.438
  175    HD2  HIS  25           HD2      HIS  25  16.969  28.095  24.175
  176    HE1  HIS  25           HE1      HIS  25  12.761  27.557  23.866
  177    HE2  HIS  25           HE2      HIS  25  14.682  29.117  23.331
  178    H    CYS  26           H        CYS  26  17.974  24.573  28.583
  179    HA   CYS  26           HA       CYS  26  19.641  23.263  29.210
  180    HB2  CYS  26           HB2      CYS  26  17.529  21.907  29.657
  181    HB3  CYS  26           HB3      CYS  26  18.112  20.823  28.382
  182    H    LYS  27           H        LYS  27  19.606  23.981  26.276
  183    HA   LYS  27           HA       LYS  27  22.087  22.500  25.581
  184    HB2  LYS  27           HB2      LYS  27  21.461  22.663  23.175
  185    HB3  LYS  27           HB3      LYS  27  20.502  21.500  24.090
  186    HG2  LYS  27           HG2      LYS  27  18.568  22.927  24.060
  187    HG3  LYS  27           HG3      LYS  27  19.512  24.330  23.573
  188    HD2  LYS  27           HD2      LYS  27  18.196  23.497  21.704
  189    HD3  LYS  27           HD3      LYS  27  19.924  23.408  21.387
  190    HE2  LYS  27           HE2      LYS  27  18.887  21.437  20.505
  191    HE3  LYS  27           HE3      LYS  27  19.895  20.959  21.869
  192    HZ1  LYS  27           HZ1      LYS  27  17.933  20.695  23.208
  193    HZ2  LYS  27           HZ2      LYS  27  16.960  21.405  22.093
  194    HZ3  LYS  27           HZ3      LYS  27  17.623  19.948  21.789
  195    H    CYS  28           H        CYS  28  23.516  23.724  24.210
  196    HA   CYS  28           HA       CYS  28  23.486  26.581  24.851
  197    HB2  CYS  28           HB2      CYS  28  25.509  25.109  24.949
  198    HB3  CYS  28           HB3      CYS  28  25.455  25.005  23.195
  199    H    ILE  29           H        ILE  29  24.055  28.115  23.067
  200    HA   ILE  29           HA       ILE  29  21.615  28.213  21.513
  201    HB   ILE  29           HB       ILE  29  22.434  29.985  22.975
  202   HG12  ILE  29          HG12      ILE  29  22.186  31.063  20.177
  203   HG13  ILE  29          HG13      ILE  29  20.823  30.439  21.119
  204   HG21  ILE  29          HG21      ILE  29  24.589  30.471  20.918
  205   HG22  ILE  29          HG22      ILE  29  24.248  31.504  22.292
  206   HG23  ILE  29          HG23      ILE  29  24.843  29.853  22.541
  207   HD11  ILE  29          HD11      ILE  29  22.543  32.863  21.816
  208   HD12  ILE  29          HD12      ILE  29  20.839  32.824  21.332
  209   HD13  ILE  29          HD13      ILE  29  21.324  32.155  22.881
  210    HA   PRO  30           HA       PRO  30  23.400  27.745  17.345
  211    HB2  PRO  30           HB2      PRO  30  21.192  29.629  16.531
  212    HB3  PRO  30           HB3      PRO  30  21.670  28.062  15.809
  213    HG2  PRO  30           HG2      PRO  30  19.501  28.203  17.384
  214    HG3  PRO  30           HG3      PRO  30  20.663  26.850  17.599
  215    HD2  PRO  30           HD2      PRO  30  20.502  29.464  19.145
  216    HD3  PRO  30           HD3      PRO  30  20.575  27.792  19.775
  217    H    ARG  31           H        ARG  31  24.611  29.793  19.007
  218    HA   ARG  31           HA       ARG  31  25.516  31.798  17.008
  219    HB2  ARG  31           HB2      ARG  31  24.565  32.568  19.793
  220    HB3  ARG  31           HB3      ARG  31  25.308  33.641  18.608
  221    HG2  ARG  31           HG2      ARG  31  23.347  33.375  17.109
  222    HG3  ARG  31           HG3      ARG  31  22.616  32.254  18.268
  223    HD2  ARG  31           HD2      ARG  31  22.863  34.166  19.997
  224    HD3  ARG  31           HD3      ARG  31  23.102  35.227  18.603
  225    HE   ARG  31           HE       ARG  31  20.760  33.805  18.032
  226   HH11  ARG  31          HH11      ARG  31  21.687  35.846  20.786
  227   HH12  ARG  31          HH12      ARG  31  19.978  36.175  21.126
  228   HH21  ARG  31          HH21      ARG  31  18.632  34.439  18.609
  229   HH22  ARG  31          HH22      ARG  31  18.462  35.489  20.002
  Start of MODEL    5
    1    H1   GLY   1           H1       GLY   1  15.560  19.793  38.005
    2    H2   GLY   1           H2       GLY   1  16.567  18.745  37.241
    3    H3   GLY   1           H3       GLY   1  15.816  19.939  36.383
    4    HA2  GLY   1           HA2      GLY   1  17.825  20.371  38.500
    5    HA3  GLY   1           HA3      GLY   1  18.133  20.500  36.751
    6    H    SER   2           H        SER   2  18.748  22.666  38.219
    7    HA   SER   2           HA       SER   2  16.647  24.531  38.673
    8    HB2  SER   2           HB2      SER   2  18.443  26.058  39.240
    9    HB3  SER   2           HB3      SER   2  18.802  24.457  39.881
   10    HG   SER   2           HG       SER   2  20.668  25.103  38.875
   11    H    GLY   3           H        GLY   3  17.641  23.629  35.691
   12    HA2  GLY   3           HA2      GLY   3  16.740  24.594  33.668
   13    HA3  GLY   3           HA3      GLY   3  16.894  26.196  34.375
   14    H    CYS   4           H        CYS   4  19.955  24.808  32.208
   15    HA   CYS   4           HA       CYS   4  17.880  22.853  32.887
   16    HB2  CYS   4           HB2      CYS   4  19.381  23.041  30.812
   17    HB3  CYS   4           HB3      CYS   4  20.679  22.375  31.797
   18    H    MET   5           H        MET   5  21.351  23.283  33.646
   19    HA   MET   5           HA       MET   5  20.544  23.693  36.366
   20    HB2  MET   5           HB2      MET   5  22.954  21.921  35.778
   21    HB3  MET   5           HB3      MET   5  22.625  22.683  37.335
   22    HG2  MET   5           HG2      MET   5  20.542  21.400  37.537
   23    HG3  MET   5           HG3      MET   5  20.834  20.645  35.968
   24    HE1  MET   5           HE1      MET   5  20.222  19.099  38.713
   25    HE2  MET   5           HE2      MET   5  20.440  18.275  37.149
   26    HE3  MET   5           HE3      MET   5  21.352  17.740  38.576
   27    H    LYS   6           H        LYS   6  21.503  25.640  37.040
   28    HA   LYS   6           HA       LYS   6  22.540  27.306  35.037
   29    HB2  LYS   6           HB2      LYS   6  21.347  28.047  37.091
   30    HB3  LYS   6           HB3      LYS   6  22.812  27.706  38.045
   31    HG2  LYS   6           HG2      LYS   6  24.042  29.409  36.611
   32    HG3  LYS   6           HG3      LYS   6  22.535  29.722  35.766
   33    HD2  LYS   6           HD2      LYS   6  22.746  31.482  37.335
   34    HD3  LYS   6           HD3      LYS   6  21.523  30.392  37.994
   35    HE2  LYS   6           HE2      LYS   6  22.888  30.949  39.837
   36    HE3  LYS   6           HE3      LYS   6  23.393  29.320  39.383
   37    HZ1  LYS   6           HZ1      LYS   6  24.832  31.842  38.711
   38    HZ2  LYS   6           HZ2      LYS   6  25.310  30.695  39.778
   39    HZ3  LYS   6           HZ3      LYS   6  25.307  30.374  38.181
   40    H    GLU   7           H        GLU   7  24.374  25.659  37.586
   41    HA   GLU   7           HA       GLU   7  26.952  26.759  36.880
   42    HB2  GLU   7           HB2      GLU   7  26.094  24.264  38.402
   43    HB3  GLU   7           HB3      GLU   7  27.782  24.615  38.064
   44    HG2  GLU   7           HG2      GLU   7  27.413  25.440  40.230
   45    HG3  GLU   7           HG3      GLU   7  27.524  26.852  39.186
   46    H    TYR   8           H        TYR   8  25.375  23.679  35.925
   47    HA   TYR   8           HA       TYR   8  27.426  22.660  34.273
   48    HB2  TYR   8           HB2      TYR   8  25.459  21.416  35.132
   49    HB3  TYR   8           HB3      TYR   8  24.409  22.363  34.093
   50    HD1  TYR   8           HD2      TYR   8  27.371  20.046  33.898
   51    HD2  TYR   8           HD1      TYR   8  23.770  21.505  32.019
   52    HE1  TYR   8           HE2      TYR   8  27.591  18.315  32.120
   53    HE2  TYR   8           HE1      TYR   8  23.984  19.754  30.260
   54    HH   TYR   8           HH       TYR   8  26.642  17.364  30.266
   55    H    CYS   9           H        CYS   9  24.657  24.762  33.440
   56    HA   CYS   9           HA       CYS   9  25.136  24.980  30.662
   57    HB2  CYS   9           HB2      CYS   9  23.757  26.721  32.718
   58    HB3  CYS   9           HB3      CYS   9  23.939  27.280  31.058
   59    H    ALA  10           H        ALA  10  26.933  26.587  33.279
   60    HA   ALA  10           HA       ALA  10  28.098  28.575  31.526
   61    HB1  ALA  10           HB1      ALA  10  29.496  29.107  33.446
   62    HB2  ALA  10           HB2      ALA  10  27.819  28.883  33.977
   63    HB3  ALA  10           HB3      ALA  10  29.024  27.603  34.254
   64    H    GLY  11           H        GLY  11  28.752  25.229  31.933
   65    HA2  GLY  11           HA2      GLY  11  31.424  25.417  30.598
   66    HA3  GLY  11           HA3      GLY  11  30.701  23.976  31.309
   67    H    GLN  12           H        GLN  12  28.089  24.133  30.073
   68    HA   GLN  12           HA       GLN  12  28.650  23.115  27.427
   69    HB2  GLN  12           HB2      GLN  12  25.998  23.954  28.665
   70    HB3  GLN  12           HB3      GLN  12  26.186  23.022  27.183
   71    HG2  GLN  12           HG2      GLN  12  26.983  22.132  29.970
   72    HG3  GLN  12           HG3      GLN  12  25.586  21.593  29.054
   73   HE21  GLN  12          HE22      GLN  12  28.843  20.877  29.782
   74   HE22  GLN  12          HE21      GLN  12  29.080  19.641  28.550
   75    H    CYS  13           H        CYS  13  27.870  26.363  28.543
   76    HA   CYS  13           HA       CYS  13  27.985  27.362  25.760
   77    HB2  CYS  13           HB2      CYS  13  25.600  26.658  26.618
   78    HB3  CYS  13           HB3      CYS  13  25.696  28.141  27.581
   79    H    ARG  14           H        ARG  14  28.383  29.595  25.511
   80    HA   ARG  14           HA       ARG  14  29.167  31.133  27.976
   81    HB2  ARG  14           HB2      ARG  14  30.636  31.041  25.332
   82    HB3  ARG  14           HB3      ARG  14  31.152  31.858  26.800
   83    HG2  ARG  14           HG2      ARG  14  30.997  28.828  26.392
   84    HG3  ARG  14           HG3      ARG  14  32.458  29.791  26.305
   85    HD2  ARG  14           HD2      ARG  14  30.766  29.425  28.793
   86    HD3  ARG  14           HD3      ARG  14  32.270  28.577  28.427
   87    HE   ARG  14           HE       ARG  14  33.055  31.180  28.227
   88   HH11  ARG  14          HH11      ARG  14  31.436  29.414  30.807
   89   HH12  ARG  14          HH12      ARG  14  31.621  30.758  31.914
   90   HH21  ARG  14          HH21      ARG  14  33.696  32.570  29.845
   91   HH22  ARG  14          HH22      ARG  14  33.243  32.265  31.494
   92    H    GLY  15           H        GLY  15  29.197  33.336  27.920
   93    HA2  GLY  15           HA2      GLY  15  28.512  35.475  27.176
   94    HA3  GLY  15           HA3      GLY  15  27.693  34.764  25.783
   95    H    LYS  16           H        LYS  16  26.631  36.613  27.911
   96    HA   LYS  16           HA       LYS  16  25.239  35.192  29.944
   97    HB2  LYS  16           HB2      LYS  16  25.808  37.645  29.905
   98    HB3  LYS  16           HB3      LYS  16  24.501  37.890  28.733
   99    HG2  LYS  16           HG2      LYS  16  22.887  36.976  30.450
  100    HG3  LYS  16           HG3      LYS  16  24.228  36.871  31.604
  101    HD2  LYS  16           HD2      LYS  16  24.602  39.341  31.311
  102    HD3  LYS  16           HD3      LYS  16  23.200  39.409  30.239
  103    HE2  LYS  16           HE2      LYS  16  23.188  38.647  33.199
  104    HE3  LYS  16           HE3      LYS  16  22.651  40.181  32.496
  105    HZ1  LYS  16           HZ1      LYS  16  20.692  38.953  32.766
  106    HZ2  LYS  16           HZ2      LYS  16  21.030  38.710  31.175
  107    HZ3  LYS  16           HZ3      LYS  16  21.345  37.540  32.268
  108    H    VAL  17           H        VAL  17  24.111  36.184  26.723
  109    HA   VAL  17           HA       VAL  17  21.343  35.376  27.202
  110    HB   VAL  17           HB       VAL  17  22.708  36.113  24.589
  111   HG11  VAL  17          HG11      VAL  17  20.562  34.968  24.202
  112   HG12  VAL  17          HG12      VAL  17  19.756  36.033  25.379
  113   HG13  VAL  17          HG13      VAL  17  20.401  36.686  23.859
  114   HG21  VAL  17          HG21      VAL  17  22.899  37.946  26.197
  115   HG22  VAL  17          HG22      VAL  17  21.675  38.347  24.990
  116   HG23  VAL  17          HG23      VAL  17  21.178  37.808  26.614
  117    H    SER  18           H        SER  18  24.204  34.006  25.562
  118    HA   SER  18           HA       SER  18  23.024  31.648  24.518
  119    HB2  SER  18           HB2      SER  18  25.787  31.983  25.703
  120    HB3  SER  18           HB3      SER  18  25.306  30.962  24.353
  121    HG   SER  18           HG       SER  18  26.416  32.941  23.803
  122    H    GLN  19           H        GLN  19  24.810  32.163  27.697
  123    HA   GLN  19           HA       GLN  19  23.942  29.697  28.833
  124    HB2  GLN  19           HB2      GLN  19  24.649  32.370  30.087
  125    HB3  GLN  19           HB3      GLN  19  24.279  30.919  31.040
  126    HG2  GLN  19           HG2      GLN  19  26.066  29.660  29.972
  127    HG3  GLN  19           HG3      GLN  19  26.418  30.990  28.870
  128   HE21  GLN  19          HE22      GLN  19  28.568  30.260  29.963
  129   HE22  GLN  19          HE21      GLN  19  29.037  31.333  31.305
  130    H    ASP  20           H        ASP  20  22.087  32.800  28.731
  131    HA   ASP  20           HA       ASP  20  19.864  31.861  30.278
  132    HB2  ASP  20           HB2      ASP  20  20.258  34.208  29.825
  133    HB3  ASP  20           HB3      ASP  20  20.032  33.944  28.098
  134    H    TYR  21           H        TYR  21  20.574  31.552  26.761
  135    HA   TYR  21           HA       TYR  21  18.213  30.130  26.042
  136    HB2  TYR  21           HB2      TYR  21  20.158  31.050  24.591
  137    HB3  TYR  21           HB3      TYR  21  20.959  29.525  24.902
  138    HD1  TYR  21           HD1      TYR  21  18.175  31.230  23.257
  139    HD2  TYR  21           HD2      TYR  21  20.037  27.356  23.880
  140    HE1  TYR  21           HE1      TYR  21  16.972  30.323  21.292
  141    HE2  TYR  21           HE2      TYR  21  18.846  26.494  21.879
  142    HH   TYR  21           HH       TYR  21  16.666  28.551  19.930
  143    H    CYS  22           H        CYS  22  21.267  28.926  27.483
  144    HA   CYS  22           HA       CYS  22  20.479  26.124  27.384
  145    HB2  CYS  22           HB2      CYS  22  22.794  26.849  27.475
  146    HB3  CYS  22           HB3      CYS  22  22.555  27.565  29.070
  147    H    LEU  23           H        LEU  23  20.022  28.700  29.764
  148    HA   LEU  23           HA       LEU  23  18.775  27.147  31.816
  149    HB2  LEU  23           HB2      LEU  23  19.086  29.990  31.045
  150    HB3  LEU  23           HB3      LEU  23  17.611  29.645  31.925
  151    HG   LEU  23           HG       LEU  23  18.884  28.725  33.805
  152   HD11  LEU  23          HD11      LEU  23  21.386  29.479  32.204
  153   HD12  LEU  23          HD12      LEU  23  21.343  28.932  33.902
  154   HD13  LEU  23          HD13      LEU  23  20.887  27.836  32.606
  155   HD21  LEU  23          HD21      LEU  23  18.407  31.130  33.716
  156   HD22  LEU  23          HD22      LEU  23  19.964  30.846  34.501
  157   HD23  LEU  23          HD23      LEU  23  19.900  31.424  32.806
  158    H    LYS  24           H        LYS  24  17.457  28.469  28.805
  159    HA   LYS  24           HA       LYS  24  14.693  27.627  29.398
  160    HB2  LYS  24           HB2      LYS  24  16.049  28.421  26.800
  161    HB3  LYS  24           HB3      LYS  24  14.324  28.110  26.990
  162    HG2  LYS  24           HG2      LYS  24  14.135  30.092  28.471
  163    HG3  LYS  24           HG3      LYS  24  15.870  30.394  28.268
  164    HD2  LYS  24           HD2      LYS  24  15.523  30.481  25.769
  165    HD3  LYS  24           HD3      LYS  24  13.780  30.325  26.059
  166    HE2  LYS  24           HE2      LYS  24  13.905  32.450  27.424
  167    HE3  LYS  24           HE3      LYS  24  15.598  32.613  26.929
  168    HZ1  LYS  24           HZ1      LYS  24  14.101  33.855  25.466
  169    HZ2  LYS  24           HZ2      LYS  24  14.797  32.636  24.596
  170    HZ3  LYS  24           HZ3      LYS  24  13.254  32.496  25.122
  171    H    HIS  25           H        HIS  25  17.351  26.426  27.395
  172    HA   HIS  25           HA       HIS  25  15.611  24.199  26.415
  173    HB2  HIS  25           HB2      HIS  25  17.777  25.866  25.068
  174    HB3  HIS  25           HB3      HIS  25  16.930  24.554  24.291
  175    HD2  HIS  25           HD2      HIS  25  16.781  28.145  24.409
  176    HE1  HIS  25           HE1      HIS  25  12.715  27.056  23.759
  177    HE2  HIS  25           HE2      HIS  25  14.406  28.978  23.675
  178    H    CYS  26           H        CYS  26  18.317  24.257  28.384
  179    HA   CYS  26           HA       CYS  26  19.975  22.811  28.860
  180    HB2  CYS  26           HB2      CYS  26  18.190  20.798  27.464
  181    HB3  CYS  26           HB3      CYS  26  19.555  20.398  28.499
  182    H    LYS  27           H        LYS  27  19.982  24.025  25.995
  183    HA   LYS  27           HA       LYS  27  22.504  22.703  25.138
  184    HB2  LYS  27           HB2      LYS  27  21.792  22.886  22.792
  185    HB3  LYS  27           HB3      LYS  27  20.735  21.809  23.723
  186    HG2  LYS  27           HG2      LYS  27  19.033  23.614  23.845
  187    HG3  LYS  27           HG3      LYS  27  20.116  24.721  23.005
  188    HD2  LYS  27           HD2      LYS  27  18.426  23.848  21.494
  189    HD3  LYS  27           HD3      LYS  27  20.048  23.323  20.996
  190    HE2  LYS  27           HE2      LYS  27  19.646  21.109  22.076
  191    HE3  LYS  27           HE3      LYS  27  18.033  21.644  22.568
  192    HZ1  LYS  27           HZ1      LYS  27  17.973  20.344  20.518
  193    HZ2  LYS  27           HZ2      LYS  27  17.460  21.882  20.239
  194    HZ3  LYS  27           HZ3      LYS  27  18.956  21.398  19.752
  195    H    CYS  28           H        CYS  28  23.680  24.093  23.492
  196    HA   CYS  28           HA       CYS  28  23.594  26.905  24.385
  197    HB2  CYS  28           HB2      CYS  28  25.720  25.477  24.285
  198    HB3  CYS  28           HB3      CYS  28  25.630  25.687  22.535
  199    H    ILE  29           H        ILE  29  23.907  28.624  22.805
  200    HA   ILE  29           HA       ILE  29  21.599  28.472  21.054
  201    HB   ILE  29           HB       ILE  29  22.000  30.238  22.737
  202   HG12  ILE  29          HG12      ILE  29  21.553  31.281  19.927
  203   HG13  ILE  29          HG13      ILE  29  20.350  30.454  20.931
  204   HG21  ILE  29          HG21      ILE  29  24.441  30.624  22.229
  205   HG22  ILE  29          HG22      ILE  29  23.937  31.491  20.763
  206   HG23  ILE  29          HG23      ILE  29  23.460  32.092  22.349
  207   HD11  ILE  29          HD11      ILE  29  21.620  33.170  21.477
  208   HD12  ILE  29          HD12      ILE  29  19.928  32.807  21.093
  209   HD13  ILE  29          HD13      ILE  29  20.607  32.287  22.646
  210    HA   PRO  30           HA       PRO  30  24.113  28.076  17.345
  211    HB2  PRO  30           HB2      PRO  30  22.208  28.105  15.411
  212    HB3  PRO  30           HB3      PRO  30  22.345  26.742  16.564
  213    HG2  PRO  30           HG2      PRO  30  20.485  29.139  16.730
  214    HG3  PRO  30           HG3      PRO  30  20.066  27.404  16.897
  215    HD2  PRO  30           HD2      PRO  30  20.509  29.002  19.061
  216    HD3  PRO  30           HD3      PRO  30  21.021  27.289  19.052
  217    H    ARG  31           H        ARG  31  24.679  30.937  15.511
  218    HA   ARG  31           HA       ARG  31  24.684  28.044  15.224
  219    HB2  ARG  31           HB2      ARG  31  25.746  28.256  13.296
  220    HB3  ARG  31           HB3      ARG  31  24.889  29.774  13.331
  221    HG2  ARG  31           HG2      ARG  31  27.854  29.411  13.997
  222    HG3  ARG  31           HG3      ARG  31  27.209  29.803  12.421
  223    HD2  ARG  31           HD2      ARG  31  28.021  31.796  13.325
  224    HD3  ARG  31           HD3      ARG  31  26.256  31.919  13.314
  225    HE   ARG  31           HE       ARG  31  27.039  30.972  15.871
  226   HH11  ARG  31          HH11      ARG  31  27.707  33.915  14.004
  227   HH12  ARG  31          HH12      ARG  31  27.710  34.883  15.482
  228   HH21  ARG  31          HH21      ARG  31  27.005  32.394  17.636
  229   HH22  ARG  31          HH22      ARG  31  27.445  34.072  17.362
  Start of MODEL    6
    1    H1   GLY   1           H1       GLY   1  16.705  22.591  39.583
    2    H2   GLY   1           H2       GLY   1  17.399  23.743  40.516
    3    H3   GLY   1           H3       GLY   1  17.922  22.177  40.625
    4    HA2  GLY   1           HA2      GLY   1  19.480  23.588  39.398
    5    HA3  GLY   1           HA3      GLY   1  18.847  22.224  38.453
    6    H    SER   2           H        SER   2  19.503  25.472  38.214
    7    HA   SER   2           HA       SER   2  17.115  26.546  37.169
    8    HB2  SER   2           HB2      SER   2  19.869  27.561  36.442
    9    HB3  SER   2           HB3      SER   2  18.364  28.470  36.691
   10    HG   SER   2           HG       SER   2  19.482  28.702  38.594
   11    H    GLY   3           H        GLY   3  16.063  25.837  35.404
   12    HA2  GLY   3           HA2      GLY   3  15.553  25.287  33.212
   13    HA3  GLY   3           HA3      GLY   3  17.163  25.796  32.737
   14    H    CYS   4           H        CYS   4  18.869  24.247  33.740
   15    HA   CYS   4           HA       CYS   4  18.084  21.417  33.881
   16    HB2  CYS   4           HB2      CYS   4  19.563  22.485  31.636
   17    HB3  CYS   4           HB3      CYS   4  20.652  21.473  32.578
   18    H    MET   5           H        MET   5  21.205  23.170  33.887
   19    HA   MET   5           HA       MET   5  20.915  23.843  36.663
   20    HB2  MET   5           HB2      MET   5  23.332  22.164  35.831
   21    HB3  MET   5           HB3      MET   5  23.261  23.170  37.276
   22    HG2  MET   5           HG2      MET   5  21.241  21.861  38.036
   23    HG3  MET   5           HG3      MET   5  21.575  20.742  36.695
   24    HE1  MET   5           HE1      MET   5  22.615  18.587  39.721
   25    HE2  MET   5           HE2      MET   5  21.241  19.710  39.567
   26    HE3  MET   5           HE3      MET   5  21.700  18.673  38.207
   27    H    LYS   6           H        LYS   6  21.905  25.780  37.072
   28    HA   LYS   6           HA       LYS   6  22.785  27.555  35.011
   29    HB2  LYS   6           HB2      LYS   6  21.922  28.251  37.224
   30    HB3  LYS   6           HB3      LYS   6  23.312  27.516  38.021
   31    HG2  LYS   6           HG2      LYS   6  24.816  29.135  36.860
   32    HG3  LYS   6           HG3      LYS   6  23.395  29.880  36.102
   33    HD2  LYS   6           HD2      LYS   6  22.518  30.492  38.325
   34    HD3  LYS   6           HD3      LYS   6  23.879  29.667  39.107
   35    HE2  LYS   6           HE2      LYS   6  25.464  31.208  37.965
   36    HE3  LYS   6           HE3      LYS   6  24.110  32.035  37.188
   37    HZ1  LYS   6           HZ1      LYS   6  23.313  32.683  39.374
   38    HZ2  LYS   6           HZ2      LYS   6  24.545  31.893  40.122
   39    HZ3  LYS   6           HZ3      LYS   6  24.857  33.204  39.179
   40    H    GLU   7           H        GLU   7  24.608  25.506  37.230
   41    HA   GLU   7           HA       GLU   7  27.260  26.257  36.557
   42    HB2  GLU   7           HB2      GLU   7  26.083  23.643  37.620
   43    HB3  GLU   7           HB3      GLU   7  27.803  23.990  37.522
   44    HG2  GLU   7           HG2      GLU   7  27.134  24.424  39.756
   45    HG3  GLU   7           HG3      GLU   7  27.517  25.965  38.987
   46    H    TYR   8           H        TYR   8  25.388  23.435  35.389
   47    HA   TYR   8           HA       TYR   8  27.204  22.440  33.452
   48    HB2  TYR   8           HB2      TYR   8  25.259  21.201  34.265
   49    HB3  TYR   8           HB3      TYR   8  24.163  22.417  33.644
   50    HD1  TYR   8           HD2      TYR   8  26.428  19.642  32.695
   51    HD2  TYR   8           HD1      TYR   8  23.483  22.483  31.332
   52    HE1  TYR   8           HE2      TYR   8  26.114  18.316  30.601
   53    HE2  TYR   8           HE1      TYR   8  23.177  21.160  29.235
   54    HH   TYR   8           HH       TYR   8  24.880  18.063  28.680
   55    H    CYS   9           H        CYS   9  24.470  24.757  33.069
   56    HA   CYS   9           HA       CYS   9  24.906  25.270  30.319
   57    HB2  CYS   9           HB2      CYS   9  23.612  26.866  32.556
   58    HB3  CYS   9           HB3      CYS   9  23.645  27.437  30.890
   59    H    ALA  10           H        ALA  10  26.550  26.754  33.128
   60    HA   ALA  10           HA       ALA  10  27.994  28.609  31.408
   61    HB1  ALA  10           HB1      ALA  10  29.134  29.228  33.520
   62    HB2  ALA  10           HB2      ALA  10  27.368  29.233  33.682
   63    HB3  ALA  10           HB3      ALA  10  28.312  27.882  34.342
   64    H    GLY  11           H        GLY  11  28.584  25.325  32.448
   65    HA2  GLY  11           HA2      GLY  11  31.426  25.292  31.713
   66    HA3  GLY  11           HA3      GLY  11  30.383  23.912  32.069
   67    H    GLN  12           H        GLN  12  28.346  24.496  30.116
   68    HA   GLN  12           HA       GLN  12  29.727  23.529  27.678
   69    HB2  GLN  12           HB2      GLN  12  26.785  23.488  28.426
   70    HB3  GLN  12           HB3      GLN  12  27.539  22.631  27.078
   71    HG2  GLN  12           HG2      GLN  12  28.084  22.119  30.034
   72    HG3  GLN  12           HG3      GLN  12  27.050  21.156  28.992
   73   HE21  GLN  12          HE22      GLN  12  28.088  19.851  27.250
   74   HE22  GLN  12          HE21      GLN  12  29.761  19.364  27.547
   75    H    CYS  13           H        CYS  13  28.273  26.459  28.687
   76    HA   CYS  13           HA       CYS  13  28.392  27.511  25.923
   77    HB2  CYS  13           HB2      CYS  13  26.020  26.640  26.736
   78    HB3  CYS  13           HB3      CYS  13  25.992  28.151  27.641
   79    H    ARG  14           H        ARG  14  28.724  29.799  25.792
   80    HA   ARG  14           HA       ARG  14  29.041  31.329  28.355
   81    HB2  ARG  14           HB2      ARG  14  31.086  31.012  26.169
   82    HB3  ARG  14           HB3      ARG  14  31.148  32.244  27.438
   83    HG2  ARG  14           HG2      ARG  14  31.302  30.558  29.194
   84    HG3  ARG  14           HG3      ARG  14  31.184  29.246  28.012
   85    HD2  ARG  14           HD2      ARG  14  33.395  31.335  28.007
   86    HD3  ARG  14           HD3      ARG  14  33.527  29.763  28.793
   87    HE   ARG  14           HE       ARG  14  33.447  30.293  25.868
   88   HH11  ARG  14          HH11      ARG  14  33.537  27.722  28.340
   89   HH12  ARG  14          HH12      ARG  14  34.305  26.659  27.162
   90   HH21  ARG  14          HH21      ARG  14  34.061  28.754  24.518
   91   HH22  ARG  14          HH22      ARG  14  34.333  27.106  25.093
   92    H    GLY  15           H        GLY  15  29.197  33.508  28.264
   93    HA2  GLY  15           HA2      GLY  15  28.494  35.641  27.420
   94    HA3  GLY  15           HA3      GLY  15  27.774  34.860  26.008
   95    H    LYS  16           H        LYS  16  26.646  36.626  28.212
   96    HA   LYS  16           HA       LYS  16  25.216  35.113  30.125
   97    HB2  LYS  16           HB2      LYS  16  25.922  37.593  30.032
   98    HB3  LYS  16           HB3      LYS  16  24.431  37.873  29.125
   99    HG2  LYS  16           HG2      LYS  16  23.157  36.874  31.079
  100    HG3  LYS  16           HG3      LYS  16  24.690  36.745  31.950
  101    HD2  LYS  16           HD2      LYS  16  23.317  39.290  30.992
  102    HD3  LYS  16           HD3      LYS  16  23.501  38.742  32.659
  103    HE2  LYS  16           HE2      LYS  16  25.984  38.988  32.464
  104    HE3  LYS  16           HE3      LYS  16  25.775  39.568  30.803
  105    HZ1  LYS  16           HZ1      LYS  16  24.807  40.916  33.258
  106    HZ2  LYS  16           HZ2      LYS  16  25.977  41.444  32.207
  107    HZ3  LYS  16           HZ3      LYS  16  24.422  41.407  31.735
  108    H    VAL  17           H        VAL  17  24.174  36.232  26.932
  109    HA   VAL  17           HA       VAL  17  21.398  35.324  27.222
  110    HB   VAL  17           HB       VAL  17  22.926  36.165  24.736
  111   HG11  VAL  17          HG11      VAL  17  20.690  36.698  23.807
  112   HG12  VAL  17          HG12      VAL  17  20.876  34.978  24.115
  113   HG13  VAL  17          HG13      VAL  17  19.930  35.986  25.245
  114   HG21  VAL  17          HG21      VAL  17  21.180  37.780  26.628
  115   HG22  VAL  17          HG22      VAL  17  22.927  37.969  26.354
  116   HG23  VAL  17          HG23      VAL  17  21.800  38.357  25.056
  117    H    SER  18           H        SER  18  24.420  34.059  25.786
  118    HA   SER  18           HA       SER  18  23.356  31.790  24.492
  119    HB2  SER  18           HB2      SER  18  26.020  32.040  25.901
  120    HB3  SER  18           HB3      SER  18  25.645  31.081  24.486
  121    HG   SER  18           HG       SER  18  26.807  33.094  24.170
  122    H    GLN  19           H        GLN  19  24.817  32.165  27.769
  123    HA   GLN  19           HA       GLN  19  23.942  29.640  28.788
  124    HB2  GLN  19           HB2      GLN  19  24.563  32.307  30.100
  125    HB3  GLN  19           HB3      GLN  19  24.220  30.828  31.020
  126    HG2  GLN  19           HG2      GLN  19  26.083  29.666  30.004
  127    HG3  GLN  19           HG3      GLN  19  26.399  30.978  28.879
  128   HE21  GLN  19          HE22      GLN  19  28.549  30.234  30.134
  129   HE22  GLN  19          HE21      GLN  19  28.955  31.411  31.403
  130    H    ASP  20           H        ASP  20  22.079  32.735  28.586
  131    HA   ASP  20           HA       ASP  20  19.896  31.751  30.176
  132    HB2  ASP  20           HB2      ASP  20  20.381  34.146  29.758
  133    HB3  ASP  20           HB3      ASP  20  19.855  33.939  28.084
  134    H    TYR  21           H        TYR  21  20.500  31.577  26.604
  135    HA   TYR  21           HA       TYR  21  18.101  30.167  25.936
  136    HB2  TYR  21           HB2      TYR  21  19.795  30.943  24.286
  137    HB3  TYR  21           HB3      TYR  21  20.900  29.708  24.846
  138    HD1  TYR  21           HD2      TYR  21  17.753  30.282  22.968
  139    HD2  TYR  21           HD1      TYR  21  20.630  27.332  24.243
  140    HE1  TYR  21           HE2      TYR  21  16.778  28.616  21.380
  141    HE2  TYR  21           HE1      TYR  21  19.688  25.702  22.642
  142    HH   TYR  21           HH       TYR  21  18.201  25.366  20.909
  143    H    CYS  22           H        CYS  22  21.110  28.919  27.447
  144    HA   CYS  22           HA       CYS  22  20.268  26.138  27.306
  145    HB2  CYS  22           HB2      CYS  22  22.602  26.802  27.433
  146    HB3  CYS  22           HB3      CYS  22  22.352  27.532  29.013
  147    H    LEU  23           H        LEU  23  19.829  28.692  29.732
  148    HA   LEU  23           HA       LEU  23  18.449  27.107  31.685
  149    HB2  LEU  23           HB2      LEU  23  18.906  29.962  31.018
  150    HB3  LEU  23           HB3      LEU  23  17.391  29.650  31.846
  151    HG   LEU  23           HG       LEU  23  18.543  28.633  33.733
  152   HD11  LEU  23          HD11      LEU  23  20.485  27.566  32.673
  153   HD12  LEU  23          HD12      LEU  23  21.137  29.158  32.210
  154   HD13  LEU  23          HD13      LEU  23  21.020  28.695  33.920
  155   HD21  LEU  23          HD21      LEU  23  19.768  30.643  34.501
  156   HD22  LEU  23          HD22      LEU  23  19.833  31.248  32.835
  157   HD23  LEU  23          HD23      LEU  23  18.263  31.077  33.664
  158    H    LYS  24           H        LYS  24  17.397  28.228  28.549
  159    HA   LYS  24           HA       LYS  24  14.532  27.617  29.135
  160    HB2  LYS  24           HB2      LYS  24  15.892  28.599  26.607
  161    HB3  LYS  24           HB3      LYS  24  14.148  28.388  26.822
  162    HG2  LYS  24           HG2      LYS  24  14.167  30.135  28.563
  163    HG3  LYS  24           HG3      LYS  24  15.915  30.322  28.389
  164    HD2  LYS  24           HD2      LYS  24  15.474  30.827  25.900
  165    HD3  LYS  24           HD3      LYS  24  13.763  30.962  26.363
  166    HE2  LYS  24           HE2      LYS  24  14.446  32.679  28.100
  167    HE3  LYS  24           HE3      LYS  24  16.077  32.615  27.417
  168    HZ1  LYS  24           HZ1      LYS  24  15.124  33.277  25.272
  169    HZ2  LYS  24           HZ2      LYS  24  13.620  33.340  25.899
  170    HZ3  LYS  24           HZ3      LYS  24  14.779  34.416  26.399
  171    H    HIS  25           H        HIS  25  17.277  26.212  27.458
  172    HA   HIS  25           HA       HIS  25  15.590  23.925  26.481
  173    HB2  HIS  25           HB2      HIS  25  17.559  25.592  24.875
  174    HB3  HIS  25           HB3      HIS  25  16.690  24.181  24.282
  175    HD2  HIS  25           HD2      HIS  25  16.384  27.868  24.497
  176    HE1  HIS  25           HE1      HIS  25  12.492  26.509  23.412
  177    HE2  HIS  25           HE2      HIS  25  14.006  28.538  23.541
  178    H    CYS  26           H        CYS  26  18.196  24.243  28.461
  179    HA   CYS  26           HA       CYS  26  19.949  22.960  29.012
  180    HB2  CYS  26           HB2      CYS  26  17.880  21.606  29.423
  181    HB3  CYS  26           HB3      CYS  26  18.255  20.688  27.976
  182    H    LYS  27           H        LYS  27  20.249  23.995  26.347
  183    HA   LYS  27           HA       LYS  27  22.526  22.374  25.327
  184    HB2  LYS  27           HB2      LYS  27  20.227  23.483  23.650
  185    HB3  LYS  27           HB3      LYS  27  21.721  22.804  22.996
  186    HG2  LYS  27           HG2      LYS  27  21.178  20.592  23.893
  187    HG3  LYS  27           HG3      LYS  27  19.727  21.225  24.676
  188    HD2  LYS  27           HD2      LYS  27  18.794  21.889  22.508
  189    HD3  LYS  27           HD3      LYS  27  20.234  21.228  21.692
  190    HE2  LYS  27           HE2      LYS  27  19.745  18.985  22.749
  191    HE3  LYS  27           HE3      LYS  27  18.259  19.660  23.427
  192    HZ1  LYS  27           HZ1      LYS  27  17.800  18.472  21.392
  193    HZ2  LYS  27           HZ2      LYS  27  17.521  20.086  21.125
  194    HZ3  LYS  27           HZ3      LYS  27  18.890  19.341  20.562
  195    H    CYS  28           H        CYS  28  23.955  23.791  23.891
  196    HA   CYS  28           HA       CYS  28  23.912  26.572  24.862
  197    HB2  CYS  28           HB2      CYS  28  26.028  25.206  24.501
  198    HB3  CYS  28           HB3      CYS  28  25.707  25.405  22.770
  199    H    ILE  29           H        ILE  29  23.988  28.361  23.349
  200    HA   ILE  29           HA       ILE  29  21.519  28.393  21.969
  201    HB   ILE  29           HB       ILE  29  22.443  30.248  23.228
  202   HG12  ILE  29          HG12      ILE  29  21.782  31.047  20.370
  203   HG13  ILE  29          HG13      ILE  29  20.615  30.595  21.620
  204   HG21  ILE  29          HG21      ILE  29  24.152  31.737  22.350
  205   HG22  ILE  29          HG22      ILE  29  24.797  30.105  22.472
  206   HG23  ILE  29          HG23      ILE  29  24.314  30.763  20.885
  207   HD11  ILE  29          HD11      ILE  29  20.654  32.973  21.513
  208   HD12  ILE  29          HD12      ILE  29  21.434  32.504  23.032
  209   HD13  ILE  29          HD13      ILE  29  22.419  33.040  21.646
  210    HA   PRO  30           HA       PRO  30  22.814  27.129  17.896
  211    HB2  PRO  30           HB2      PRO  30  20.615  27.764  16.409
  212    HB3  PRO  30           HB3      PRO  30  20.666  26.390  17.552
  213    HG2  PRO  30           HG2      PRO  30  19.572  29.175  18.071
  214    HG3  PRO  30           HG3      PRO  30  18.786  27.597  18.403
  215    HD2  PRO  30           HD2      PRO  30  20.091  28.913  20.347
  216    HD3  PRO  30           HD3      PRO  30  20.254  27.141  20.198
  217    H    ARG  31           H        ARG  31  24.440  28.264  17.101
  218    HA   ARG  31           HA       ARG  31  24.110  30.825  15.736
  219    HB2  ARG  31           HB2      ARG  31  24.545  31.325  18.113
  220    HB3  ARG  31           HB3      ARG  31  25.932  30.217  18.127
  221    HG2  ARG  31           HG2      ARG  31  27.149  31.539  16.588
  222    HG3  ARG  31           HG3      ARG  31  25.753  32.576  16.243
  223    HD2  ARG  31           HD2      ARG  31  27.227  32.404  18.910
  224    HD3  ARG  31           HD3      ARG  31  27.388  33.717  17.731
  225    HE   ARG  31           HE       ARG  31  24.635  33.518  18.334
  226   HH11  ARG  31          HH11      ARG  31  27.547  34.444  20.143
  227   HH12  ARG  31          HH12      ARG  31  26.616  35.606  21.040
  228   HH21  ARG  31          HH21      ARG  31  23.588  34.750  19.746
  229   HH22  ARG  31          HH22      ARG  31  24.447  35.447  21.124
  Start of MODEL    7
    1    H1   GLY   1           H1       GLY   1  10.236  24.815  35.483
    2    H2   GLY   1           H2       GLY   1  10.248  23.192  35.767
    3    H3   GLY   1           H3       GLY   1  11.027  23.814  34.457
    4    HA2  GLY   1           HA2      GLY   1  11.773  24.307  37.271
    5    HA3  GLY   1           HA3      GLY   1  12.612  23.207  36.162
    6    H    SER   2           H        SER   2  14.301  24.980  37.150
    7    HA   SER   2           HA       SER   2  14.437  27.452  35.608
    8    HB2  SER   2           HB2      SER   2  16.432  26.200  37.508
    9    HB3  SER   2           HB3      SER   2  16.546  27.816  36.788
   10    HG   SER   2           HG       SER   2  14.451  28.253  37.750
   11    H    GLY   3           H        GLY   3  14.223  25.600  33.708
   12    HA2  GLY   3           HA2      GLY   3  15.131  25.114  31.636
   13    HA3  GLY   3           HA3      GLY   3  16.596  25.978  32.117
   14    H    CYS   4           H        CYS   4  18.127  24.854  33.487
   15    HA   CYS   4           HA       CYS   4  17.928  21.994  33.882
   16    HB2  CYS   4           HB2      CYS   4  19.557  23.046  31.657
   17    HB3  CYS   4           HB3      CYS   4  20.475  22.040  32.777
   18    H    MET   5           H        MET   5  21.036  23.732  33.856
   19    HA   MET   5           HA       MET   5  20.783  24.628  36.608
   20    HB2  MET   5           HB2      MET   5  22.871  22.536  35.853
   21    HB3  MET   5           HB3      MET   5  22.913  23.521  37.316
   22    HG2  MET   5           HG2      MET   5  20.740  22.530  38.022
   23    HG3  MET   5           HG3      MET   5  20.784  21.488  36.596
   24    HE1  MET   5           HE1      MET   5  20.297  20.267  39.366
   25    HE2  MET   5           HE2      MET   5  20.519  19.260  37.917
   26    HE3  MET   5           HE3      MET   5  21.422  18.893  39.403
   27    H    LYS   6           H        LYS   6  22.275  26.272  37.070
   28    HA   LYS   6           HA       LYS   6  23.403  27.780  34.891
   29    HB2  LYS   6           HB2      LYS   6  24.074  27.835  37.870
   30    HB3  LYS   6           HB3      LYS   6  24.550  29.052  36.683
   31    HG2  LYS   6           HG2      LYS   6  22.135  29.539  36.241
   32    HG3  LYS   6           HG3      LYS   6  21.681  28.418  37.532
   33    HD2  LYS   6           HD2      LYS   6  23.530  30.812  37.918
   34    HD3  LYS   6           HD3      LYS   6  21.795  30.892  38.188
   35    HE2  LYS   6           HE2      LYS   6  23.356  28.721  39.610
   36    HE3  LYS   6           HE3      LYS   6  23.554  30.383  40.166
   37    HZ1  LYS   6           HZ1      LYS   6  21.727  29.152  41.286
   38    HZ2  LYS   6           HZ2      LYS   6  21.274  30.570  40.599
   39    HZ3  LYS   6           HZ3      LYS   6  20.868  29.155  39.877
   40    H    GLU   7           H        GLU   7  24.933  25.663  37.313
   41    HA   GLU   7           HA       GLU   7  27.617  26.014  36.442
   42    HB2  GLU   7           HB2      GLU   7  26.337  23.628  37.853
   43    HB3  GLU   7           HB3      GLU   7  28.055  23.919  37.677
   44    HG2  GLU   7           HG2      GLU   7  27.733  24.707  39.795
   45    HG3  GLU   7           HG3      GLU   7  27.651  26.196  38.866
   46    H    TYR   8           H        TYR   8  25.225  23.542  35.500
   47    HA   TYR   8           HA       TYR   8  26.795  21.870  33.907
   48    HB2  TYR   8           HB2      TYR   8  24.493  21.389  34.558
   49    HB3  TYR   8           HB3      TYR   8  23.897  22.718  33.574
   50    HD1  TYR   8           HD2      TYR   8  25.865  19.534  33.299
   51    HD2  TYR   8           HD1      TYR   8  23.213  22.316  31.349
   52    HE1  TYR   8           HE2      TYR   8  25.685  17.995  31.335
   53    HE2  TYR   8           HE1      TYR   8  23.026  20.783  29.402
   54    HH   TYR   8           HH       TYR   8  23.577  18.727  28.535
   55    H    CYS   9           H        CYS   9  25.045  24.806  32.892
   56    HA   CYS   9           HA       CYS   9  26.190  24.568  30.195
   57    HB2  CYS   9           HB2      CYS   9  23.968  26.092  31.437
   58    HB3  CYS   9           HB3      CYS   9  24.756  26.829  30.034
   59    H    ALA  10           H        ALA  10  27.015  26.535  33.053
   60    HA   ALA  10           HA       ALA  10  28.982  28.130  31.652
   61    HB1  ALA  10           HB1      ALA  10  28.868  27.011  34.488
   62    HB2  ALA  10           HB2      ALA  10  30.041  28.211  33.918
   63    HB3  ALA  10           HB3      ALA  10  28.312  28.607  33.943
   64    H    GLY  11           H        GLY  11  28.864  24.739  32.574
   65    HA2  GLY  11           HA2      GLY  11  31.593  24.064  31.756
   66    HA3  GLY  11           HA3      GLY  11  30.285  22.958  32.191
   67    H    GLN  12           H        GLN  12  29.115  25.111  29.857
   68    HA   GLN  12           HA       GLN  12  29.972  23.434  27.531
   69    HB2  GLN  12           HB2      GLN  12  27.246  24.697  28.036
   70    HB3  GLN  12           HB3      GLN  12  27.741  23.908  26.547
   71    HG2  GLN  12           HG2      GLN  12  27.679  22.454  29.211
   72    HG3  GLN  12           HG3      GLN  12  26.285  22.575  28.162
   73   HE21  GLN  12          HE22      GLN  12  28.524  20.411  29.015
   74   HE22  GLN  12          HE21      GLN  12  28.749  19.561  27.484
   75    H    CYS  13           H        CYS  13  28.561  26.658  28.395
   76    HA   CYS  13           HA       CYS  13  30.240  28.013  26.369
   77    HB2  CYS  13           HB2      CYS  13  27.204  27.836  26.269
   78    HB3  CYS  13           HB3      CYS  13  28.120  29.050  25.403
   79    H    ARG  14           H        ARG  14  29.903  30.315  26.300
   80    HA   ARG  14           HA       ARG  14  28.711  31.584  28.735
   81    HB2  ARG  14           HB2      ARG  14  31.352  32.403  27.538
   82    HB3  ARG  14           HB3      ARG  14  30.520  33.088  28.944
   83    HG2  ARG  14           HG2      ARG  14  30.893  31.031  30.230
   84    HG3  ARG  14           HG3      ARG  14  31.677  30.273  28.838
   85    HD2  ARG  14           HD2      ARG  14  33.383  31.022  30.326
   86    HD3  ARG  14           HD3      ARG  14  33.455  32.006  28.873
   87    HE   ARG  14           HE       ARG  14  32.745  32.825  31.609
   88   HH11  ARG  14          HH11      ARG  14  33.024  34.000  28.288
   89   HH12  ARG  14          HH12      ARG  14  32.869  35.657  28.803
   90   HH21  ARG  14          HH21      ARG  14  32.424  34.912  32.139
   91   HH22  ARG  14          HH22      ARG  14  32.401  36.140  30.902
   92    H    GLY  15           H        GLY  15  28.898  34.060  28.381
   93    HA2  GLY  15           HA2      GLY  15  28.066  35.888  27.057
   94    HA3  GLY  15           HA3      GLY  15  27.548  34.747  25.803
   95    H    LYS  16           H        LYS  16  26.345  36.669  28.067
   96    HA   LYS  16           HA       LYS  16  24.755  35.196  29.847
   97    HB2  LYS  16           HB2      LYS  16  25.333  37.709  29.703
   98    HB3  LYS  16           HB3      LYS  16  23.968  37.854  28.595
   99    HG2  LYS  16           HG2      LYS  16  22.446  37.014  30.383
  100    HG3  LYS  16           HG3      LYS  16  23.857  36.783  31.433
  101    HD2  LYS  16           HD2      LYS  16  24.335  39.308  31.080
  102    HD3  LYS  16           HD3      LYS  16  22.725  39.401  30.369
  103    HE2  LYS  16           HE2      LYS  16  22.632  40.086  32.679
  104    HE3  LYS  16           HE3      LYS  16  21.749  38.564  32.509
  105    HZ1  LYS  16           HZ1      LYS  16  24.563  38.752  33.472
  106    HZ2  LYS  16           HZ2      LYS  16  23.253  38.637  34.466
  107    HZ3  LYS  16           HZ3      LYS  16  23.631  37.406  33.458
  108    H    VAL  17           H        VAL  17  24.046  36.070  26.502
  109    HA   VAL  17           HA       VAL  17  21.316  35.088  26.587
  110    HB   VAL  17           HB       VAL  17  22.180  36.909  25.091
  111   HG11  VAL  17          HG11      VAL  17  24.209  35.719  24.199
  112   HG12  VAL  17          HG12      VAL  17  23.129  34.646  23.280
  113   HG13  VAL  17          HG13      VAL  17  23.149  36.385  22.953
  114   HG21  VAL  17          HG21      VAL  17  19.972  35.877  24.831
  115   HG22  VAL  17          HG22      VAL  17  20.664  36.345  23.267
  116   HG23  VAL  17          HG23      VAL  17  20.667  34.637  23.758
  117    H    SER  18           H        SER  18  24.408  33.555  25.854
  118    HA   SER  18           HA       SER  18  23.193  31.177  24.639
  119    HB2  SER  18           HB2      SER  18  25.575  31.924  24.213
  120    HB3  SER  18           HB3      SER  18  25.967  31.395  25.867
  121    HG   SER  18           HG       SER  18  26.080  29.899  23.844
  122    H    GLN  19           H        GLN  19  24.589  32.042  27.869
  123    HA   GLN  19           HA       GLN  19  23.608  29.671  29.148
  124    HB2  GLN  19           HB2      GLN  19  24.208  32.447  30.233
  125    HB3  GLN  19           HB3      GLN  19  23.830  31.031  31.247
  126    HG2  GLN  19           HG2      GLN  19  25.710  29.776  30.222
  127    HG3  GLN  19           HG3      GLN  19  26.112  31.160  29.211
  128   HE21  GLN  19          HE22      GLN  19  28.163  30.321  30.464
  129   HE22  GLN  19          HE21      GLN  19  28.535  31.355  31.838
  130    H    ASP  20           H        ASP  20  21.851  32.812  28.649
  131    HA   ASP  20           HA       ASP  20  19.526  31.940  30.053
  132    HB2  ASP  20           HB2      ASP  20  20.008  34.282  29.602
  133    HB3  ASP  20           HB3      ASP  20  19.799  34.013  27.862
  134    H    TYR  21           H        TYR  21  20.390  31.531  26.560
  135    HA   TYR  21           HA       TYR  21  17.952  30.239  25.797
  136    HB2  TYR  21           HB2      TYR  21  19.780  31.032  24.279
  137    HB3  TYR  21           HB3      TYR  21  20.759  29.664  24.791
  138    HD1  TYR  21           HD1      TYR  21  17.816  30.754  22.856
  139    HD2  TYR  21           HD2      TYR  21  20.231  27.343  23.995
  140    HE1  TYR  21           HE1      TYR  21  16.751  29.390  21.058
  141    HE2  TYR  21           HE2      TYR  21  19.176  26.017  22.186
  142    HH   TYR  21           HH       TYR  21  16.690  27.341  19.989
  143    H    CYS  22           H        CYS  22  20.931  28.925  27.310
  144    HA   CYS  22           HA       CYS  22  20.060  26.179  27.334
  145    HB2  CYS  22           HB2      CYS  22  22.375  26.755  27.783
  146    HB3  CYS  22           HB3      CYS  22  21.923  27.668  29.224
  147    H    LEU  23           H        LEU  23  19.420  28.856  29.548
  148    HA   LEU  23           HA       LEU  23  17.915  27.338  31.445
  149    HB2  LEU  23           HB2      LEU  23  18.656  30.122  30.867
  150    HB3  LEU  23           HB3      LEU  23  17.104  29.932  31.680
  151    HG   LEU  23           HG       LEU  23  18.124  28.752  33.540
  152   HD11  LEU  23          HD11      LEU  23  20.555  28.397  33.754
  153   HD12  LEU  23          HD12      LEU  23  19.910  27.445  32.420
  154   HD13  LEU  23          HD13      LEU  23  20.800  28.943  32.083
  155   HD21  LEU  23          HD21      LEU  23  19.779  31.175  32.711
  156   HD22  LEU  23          HD22      LEU  23  18.224  31.193  33.569
  157   HD23  LEU  23          HD23      LEU  23  19.655  30.521  34.366
  158    H    LYS  24           H        LYS  24  17.047  28.070  28.283
  159    HA   LYS  24           HA       LYS  24  14.196  27.308  28.861
  160    HB2  LYS  24           HB2      LYS  24  15.474  28.567  26.399
  161    HB3  LYS  24           HB3      LYS  24  13.806  28.008  26.460
  162    HG2  LYS  24           HG2      LYS  24  14.987  30.197  28.190
  163    HG3  LYS  24           HG3      LYS  24  14.067  30.453  26.717
  164    HD2  LYS  24           HD2      LYS  24  12.116  29.278  27.750
  165    HD3  LYS  24           HD3      LYS  24  12.999  29.177  29.279
  166    HE2  LYS  24           HE2      LYS  24  12.470  31.812  27.837
  167    HE3  LYS  24           HE3      LYS  24  11.312  31.094  28.962
  168    HZ1  LYS  24           HZ1      LYS  24  12.950  31.182  30.696
  169    HZ2  LYS  24           HZ2      LYS  24  14.087  31.839  29.732
  170    HZ3  LYS  24           HZ3      LYS  24  12.706  32.680  30.100
  171    H    HIS  25           H        HIS  25  17.139  26.244  27.383
  172    HA   HIS  25           HA       HIS  25  15.741  23.902  26.081
  173    HB2  HIS  25           HB2      HIS  25  17.849  25.778  24.956
  174    HB3  HIS  25           HB3      HIS  25  17.327  24.310  24.154
  175    HD2  HIS  25           HD2      HIS  25  16.467  27.903  24.353
  176    HE1  HIS  25           HE1      HIS  25  12.961  26.078  22.762
  177    HE2  HIS  25           HE2      HIS  25  14.115  28.290  23.214
  178    H    CYS  26           H        CYS  26  18.169  24.379  28.333
  179    HA   CYS  26           HA       CYS  26  19.873  23.213  29.120
  180    HB2  CYS  26           HB2      CYS  26  17.909  21.556  29.155
  181    HB3  CYS  26           HB3      CYS  26  18.771  20.713  27.877
  182    H    LYS  27           H        LYS  27  20.269  24.257  26.315
  183    HA   LYS  27           HA       LYS  27  22.944  23.061  25.910
  184    HB2  LYS  27           HB2      LYS  27  22.610  23.115  23.442
  185    HB3  LYS  27           HB3      LYS  27  21.656  21.865  24.250
  186    HG2  LYS  27           HG2      LYS  27  19.620  23.091  23.952
  187    HG3  LYS  27           HG3      LYS  27  20.477  24.585  23.554
  188    HD2  LYS  27           HD2      LYS  27  19.475  23.580  21.584
  189    HD3  LYS  27           HD3      LYS  27  21.233  23.666  21.437
  190    HE2  LYS  27           HE2      LYS  27  21.458  21.279  21.941
  191    HE3  LYS  27           HE3      LYS  27  19.738  21.171  22.347
  192    HZ1  LYS  27           HZ1      LYS  27  20.824  21.745  19.640
  193    HZ2  LYS  27           HZ2      LYS  27  20.145  20.344  20.141
  194    HZ3  LYS  27           HZ3      LYS  27  19.221  21.701  20.038
  195    H    CYS  28           H        CYS  28  24.316  24.474  24.517
  196    HA   CYS  28           HA       CYS  28  24.158  27.287  25.036
  197    HB2  CYS  28           HB2      CYS  28  25.426  25.932  22.628
  198    HB3  CYS  28           HB3      CYS  28  25.845  27.491  23.321
  199    H    ILE  29           H        ILE  29  23.632  29.038  23.568
  200    HA   ILE  29           HA       ILE  29  21.357  28.633  21.835
  201    HB   ILE  29           HB       ILE  29  21.904  30.733  23.031
  202   HG12  ILE  29          HG12      ILE  29  21.499  31.238  20.083
  203   HG13  ILE  29          HG13      ILE  29  20.263  30.549  21.150
  204   HG21  ILE  29          HG21      ILE  29  24.347  30.768  22.366
  205   HG22  ILE  29          HG22      ILE  29  23.836  31.361  20.779
  206   HG23  ILE  29          HG23      ILE  29  23.494  32.310  22.244
  207   HD11  ILE  29          HD11      ILE  29  19.881  32.928  20.952
  208   HD12  ILE  29          HD12      ILE  29  20.391  32.548  22.609
  209   HD13  ILE  29          HD13      ILE  29  21.538  33.292  21.468
  210    HA   PRO  30           HA       PRO  30  22.774  26.240  19.080
  211    HB2  PRO  30           HB2      PRO  30  21.857  27.857  16.688
  212    HB3  PRO  30           HB3      PRO  30  21.703  26.090  16.986
  213    HG2  PRO  30           HG2      PRO  30  19.629  27.688  17.621
  214    HG3  PRO  30           HG3      PRO  30  20.172  26.466  18.815
  215    HD2  PRO  30           HD2      PRO  30  20.778  29.423  18.739
  216    HD3  PRO  30           HD3      PRO  30  20.315  28.393  20.121
  217    H    ARG  31           H        ARG  31  24.688  25.550  18.737
  218    HA   ARG  31           HA       ARG  31  26.819  27.102  17.381
  219    HB2  ARG  31           HB2      ARG  31  27.053  27.070  19.809
  220    HB3  ARG  31           HB3      ARG  31  26.730  25.332  19.875
  221    HG2  ARG  31           HG2      ARG  31  28.796  24.848  18.704
  222    HG3  ARG  31           HG3      ARG  31  29.103  26.576  18.462
  223    HD2  ARG  31           HD2      ARG  31  30.514  25.857  20.238
  224    HD3  ARG  31           HD3      ARG  31  29.241  26.840  20.966
  225    HE   ARG  31           HE       ARG  31  28.122  24.528  21.474
  226   HH11  ARG  31          HH11      ARG  31  31.659  25.029  21.718
  227   HH12  ARG  31          HH12      ARG  31  31.751  23.628  22.765
  228   HH21  ARG  31          HH21      ARG  31  28.462  22.944  22.844
  229   HH22  ARG  31          HH22      ARG  31  30.105  22.562  23.414
  Start of MODEL    8
    1    H1   GLY   1           H1       GLY   1  10.893  26.694  26.251
    2    H2   GLY   1           H2       GLY   1  11.314  25.571  25.100
    3    H3   GLY   1           H3       GLY   1  12.439  26.167  26.164
    4    HA2  GLY   1           HA2      GLY   1  10.123  24.520  26.892
    5    HA3  GLY   1           HA3      GLY   1  11.792  23.931  26.740
    6    H    SER   2           H        SER   2  12.650  23.615  28.702
    7    HA   SER   2           HA       SER   2  12.548  25.809  30.703
    8    HB2  SER   2           HB2      SER   2  12.223  24.332  32.539
    9    HB3  SER   2           HB3      SER   2  10.924  24.034  31.355
   10    HG   SER   2           HG       SER   2  11.659  22.100  32.028
   11    H    GLY   3           H        GLY   3  14.270  25.497  32.435
   12    HA2  GLY   3           HA2      GLY   3  16.823  25.268  31.020
   13    HA3  GLY   3           HA3      GLY   3  16.564  25.903  32.644
   14    H    CYS   4           H        CYS   4  18.723  24.445  32.341
   15    HA   CYS   4           HA       CYS   4  18.109  21.725  33.411
   16    HB2  CYS   4           HB2      CYS   4  20.001  22.645  31.351
   17    HB3  CYS   4           HB3      CYS   4  20.702  21.572  32.551
   18    H    MET   5           H        MET   5  21.254  23.356  33.766
   19    HA   MET   5           HA       MET   5  20.703  24.191  36.507
   20    HB2  MET   5           HB2      MET   5  22.784  22.054  35.855
   21    HB3  MET   5           HB3      MET   5  22.867  23.082  37.286
   22    HG2  MET   5           HG2      MET   5  20.630  22.276  37.994
   23    HG3  MET   5           HG3      MET   5  20.633  21.131  36.644
   24    HE1  MET   5           HE1      MET   5  21.830  18.897  36.583
   25    HE2  MET   5           HE2      MET   5  23.354  19.768  36.404
   26    HE3  MET   5           HE3      MET   5  23.213  18.465  37.583
   27    H    LYS   6           H        LYS   6  22.236  25.794  37.177
   28    HA   LYS   6           HA       LYS   6  23.263  27.441  35.033
   29    HB2  LYS   6           HB2      LYS   6  23.788  27.522  38.034
   30    HB3  LYS   6           HB3      LYS   6  24.286  28.762  36.876
   31    HG2  LYS   6           HG2      LYS   6  21.892  29.096  36.227
   32    HG3  LYS   6           HG3      LYS   6  21.403  27.968  37.503
   33    HD2  LYS   6           HD2      LYS   6  23.000  30.523  37.941
   34    HD3  LYS   6           HD3      LYS   6  21.251  30.394  38.141
   35    HE2  LYS   6           HE2      LYS   6  21.507  28.759  39.937
   36    HE3  LYS   6           HE3      LYS   6  23.260  28.713  39.713
   37    HZ1  LYS   6           HZ1      LYS   6  23.392  30.996  40.423
   38    HZ2  LYS   6           HZ2      LYS   6  21.756  31.139  40.504
   39    HZ3  LYS   6           HZ3      LYS   6  22.546  30.166  41.560
   40    H    GLU   7           H        GLU   7  24.928  25.385  37.431
   41    HA   GLU   7           HA       GLU   7  27.592  25.936  36.547
   42    HB2  GLU   7           HB2      GLU   7  26.414  23.470  37.909
   43    HB3  GLU   7           HB3      GLU   7  28.130  23.752  37.664
   44    HG2  GLU   7           HG2      GLU   7  27.710  24.379  39.896
   45    HG3  GLU   7           HG3      GLU   7  27.960  25.873  38.999
   46    H    TYR   8           H        TYR   8  25.300  23.399  35.538
   47    HA   TYR   8           HA       TYR   8  27.023  22.010  33.733
   48    HB2  TYR   8           HB2      TYR   8  24.918  21.103  34.597
   49    HB3  TYR   8           HB3      TYR   8  24.000  22.350  33.763
   50    HD1  TYR   8           HD2      TYR   8  25.951  19.260  33.373
   51    HD2  TYR   8           HD1      TYR   8  23.694  22.295  31.307
   52    HE1  TYR   8           HE2      TYR   8  25.744  17.757  31.389
   53    HE2  TYR   8           HE1      TYR   8  23.546  20.833  29.302
   54    HH   TYR   8           HH       TYR   8  24.906  17.498  29.294
   55    H    CYS   9           H        CYS   9  24.614  24.607  33.134
   56    HA   CYS   9           HA       CYS   9  25.123  24.846  30.332
   57    HB2  CYS   9           HB2      CYS   9  23.863  26.645  32.423
   58    HB3  CYS   9           HB3      CYS   9  23.988  27.122  30.732
   59    H    ALA  10           H        ALA  10  26.541  26.674  33.121
   60    HA   ALA  10           HA       ALA  10  28.119  28.439  31.539
   61    HB1  ALA  10           HB1      ALA  10  29.356  28.779  33.649
   62    HB2  ALA  10           HB2      ALA  10  27.602  28.776  33.928
   63    HB3  ALA  10           HB3      ALA  10  28.574  27.347  34.352
   64    H    GLY  11           H        GLY  11  28.761  25.071  32.566
   65    HA2  GLY  11           HA2      GLY  11  31.510  24.992  31.749
   66    HA3  GLY  11           HA3      GLY  11  30.429  23.606  31.924
   67    H    GLN  12           H        GLN  12  28.552  24.827  29.817
   68    HA   GLN  12           HA       GLN  12  30.178  24.085  27.421
   69    HB2  GLN  12           HB2      GLN  12  28.382  22.950  26.465
   70    HB3  GLN  12           HB3      GLN  12  28.720  22.279  28.059
   71    HG2  GLN  12           HG2      GLN  12  26.751  23.076  28.975
   72    HG3  GLN  12           HG3      GLN  12  26.597  24.395  27.829
   73   HE21  GLN  12          HE22      GLN  12  25.773  21.014  28.375
   74   HE22  GLN  12          HE21      GLN  12  24.819  20.891  26.897
   75    H    CYS  13           H        CYS  13  28.652  26.766  28.656
   76    HA   CYS  13           HA       CYS  13  28.482  28.010  25.983
   77    HB2  CYS  13           HB2      CYS  13  26.258  26.797  26.969
   78    HB3  CYS  13           HB3      CYS  13  26.100  28.357  27.761
   79    H    ARG  14           H        ARG  14  28.733  30.234  25.988
   80    HA   ARG  14           HA       ARG  14  29.091  31.676  28.597
   81    HB2  ARG  14           HB2      ARG  14  31.006  31.526  26.260
   82    HB3  ARG  14           HB3      ARG  14  31.199  32.592  27.647
   83    HG2  ARG  14           HG2      ARG  14  31.225  29.543  27.796
   84    HG3  ARG  14           HG3      ARG  14  32.667  30.554  27.726
   85    HD2  ARG  14           HD2      ARG  14  32.271  31.514  29.871
   86    HD3  ARG  14           HD3      ARG  14  30.601  30.984  29.896
   87    HE   ARG  14           HE       ARG  14  31.191  28.822  30.491
   88   HH11  ARG  14          HH11      ARG  14  34.210  30.563  29.935
   89   HH12  ARG  14          HH12      ARG  14  35.111  29.313  30.741
   90   HH21  ARG  14          HH21      ARG  14  32.343  27.536  31.727
   91   HH22  ARG  14          HH22      ARG  14  34.060  27.762  31.929
   92    H    GLY  15           H        GLY  15  29.280  33.930  28.524
   93    HA2  GLY  15           HA2      GLY  15  28.415  36.016  27.883
   94    HA3  GLY  15           HA3      GLY  15  27.891  35.360  26.330
   95    H    LYS  16           H        LYS  16  26.369  36.967  28.265
   96    HA   LYS  16           HA       LYS  16  24.747  35.481  30.051
   97    HB2  LYS  16           HB2      LYS  16  24.387  38.152  28.631
   98    HB3  LYS  16           HB3      LYS  16  23.158  37.503  29.726
   99    HG2  LYS  16           HG2      LYS  16  24.752  37.402  31.570
  100    HG3  LYS  16           HG3      LYS  16  26.040  38.048  30.533
  101    HD2  LYS  16           HD2      LYS  16  24.702  40.105  30.145
  102    HD3  LYS  16           HD3      LYS  16  23.411  39.465  31.165
  103    HE2  LYS  16           HE2      LYS  16  26.242  40.131  32.082
  104    HE3  LYS  16           HE3      LYS  16  24.803  41.136  32.319
  105    HZ1  LYS  16           HZ1      LYS  16  25.181  39.924  34.289
  106    HZ2  LYS  16           HZ2      LYS  16  23.841  39.238  33.601
  107    HZ3  LYS  16           HZ3      LYS  16  25.292  38.473  33.519
  108    H    VAL  17           H        VAL  17  24.125  36.287  26.635
  109    HA   VAL  17           HA       VAL  17  21.393  35.285  26.787
  110    HB   VAL  17           HB       VAL  17  22.137  37.156  25.323
  111   HG11  VAL  17          HG11      VAL  17  23.016  36.735  23.117
  112   HG12  VAL  17          HG12      VAL  17  24.163  36.074  24.290
  113   HG13  VAL  17          HG13      VAL  17  23.077  34.987  23.399
  114   HG21  VAL  17          HG21      VAL  17  20.555  36.634  23.558
  115   HG22  VAL  17          HG22      VAL  17  20.655  34.899  23.922
  116   HG23  VAL  17          HG23      VAL  17  19.948  36.024  25.105
  117    H    SER  18           H        SER  18  24.460  33.905  25.564
  118    HA   SER  18           HA       SER  18  23.407  31.529  24.453
  119    HB2  SER  18           HB2      SER  18  26.051  31.636  25.887
  120    HB3  SER  18           HB3      SER  18  25.654  30.935  24.320
  121    HG   SER  18           HG       SER  18  26.943  32.991  24.609
  122    H    GLN  19           H        GLN  19  24.798  32.227  27.729
  123    HA   GLN  19           HA       GLN  19  23.952  29.772  28.934
  124    HB2  GLN  19           HB2      GLN  19  24.429  32.557  30.055
  125    HB3  GLN  19           HB3      GLN  19  24.084  31.150  31.078
  126    HG2  GLN  19           HG2      GLN  19  26.018  29.949  30.248
  127    HG3  GLN  19           HG3      GLN  19  26.345  31.182  29.030
  128   HE21  GLN  19          HE22      GLN  19  28.413  30.545  30.430
  129   HE22  GLN  19          HE21      GLN  19  28.805  31.843  31.575
  130    H    ASP  20           H        ASP  20  22.059  32.838  28.614
  131    HA   ASP  20           HA       ASP  20  19.761  31.980  30.043
  132    HB2  ASP  20           HB2      ASP  20  20.149  34.294  29.409
  133    HB3  ASP  20           HB3      ASP  20  20.041  33.882  27.695
  134    H    TYR  21           H        TYR  21  20.561  31.563  26.543
  135    HA   TYR  21           HA       TYR  21  18.189  30.177  25.819
  136    HB2  TYR  21           HB2      TYR  21  20.074  31.009  24.321
  137    HB3  TYR  21           HB3      TYR  21  20.977  29.578  24.781
  138    HD1  TYR  21           HD2      TYR  21  20.211  27.296  24.023
  139    HD2  TYR  21           HD1      TYR  21  18.148  30.910  22.844
  140    HE1  TYR  21           HE2      TYR  21  19.039  26.066  22.210
  141    HE2  TYR  21           HE1      TYR  21  16.969  29.640  21.053
  142    HH   TYR  21           HH       TYR  21  16.717  27.583  20.002
  143    H    CYS  22           H        CYS  22  21.166  28.898  27.395
  144    HA   CYS  22           HA       CYS  22  20.275  26.129  27.293
  145    HB2  CYS  22           HB2      CYS  22  22.623  26.865  27.406
  146    HB3  CYS  22           HB3      CYS  22  22.360  27.496  29.033
  147    H    LEU  23           H        LEU  23  19.749  28.776  29.534
  148    HA   LEU  23           HA       LEU  23  18.298  27.168  31.498
  149    HB2  LEU  23           HB2      LEU  23  19.138  29.994  31.068
  150    HB3  LEU  23           HB3      LEU  23  17.646  29.762  31.972
  151    HG   LEU  23           HG       LEU  23  18.764  28.371  33.628
  152   HD11  LEU  23          HD11      LEU  23  21.321  28.772  32.020
  153   HD12  LEU  23          HD12      LEU  23  21.225  28.087  33.660
  154   HD13  LEU  23          HD13      LEU  23  20.486  27.229  32.308
  155   HD21  LEU  23          HD21      LEU  23  20.233  30.074  34.604
  156   HD22  LEU  23          HD22      LEU  23  20.382  30.880  33.021
  157   HD23  LEU  23          HD23      LEU  23  18.817  30.824  33.865
  158    H    LYS  24           H        LYS  24  17.412  28.280  28.405
  159    HA   LYS  24           HA       LYS  24  14.494  27.886  29.009
  160    HB2  LYS  24           HB2      LYS  24  15.994  29.131  26.673
  161    HB3  LYS  24           HB3      LYS  24  14.254  28.803  26.651
  162    HG2  LYS  24           HG2      LYS  24  13.905  30.268  28.556
  163    HG3  LYS  24           HG3      LYS  24  15.656  30.546  28.703
  164    HD2  LYS  24           HD2      LYS  24  15.753  31.724  26.607
  165    HD3  LYS  24           HD3      LYS  24  14.106  31.231  26.184
  166    HE2  LYS  24           HE2      LYS  24  14.109  33.557  26.880
  167    HE3  LYS  24           HE3      LYS  24  13.169  32.569  28.000
  168    HZ1  LYS  24           HZ1      LYS  24  15.961  33.476  28.480
  169    HZ2  LYS  24           HZ2      LYS  24  14.630  34.165  29.135
  170    HZ3  LYS  24           HZ3      LYS  24  15.028  32.635  29.550
  171    H    HIS  25           H        HIS  25  17.190  26.354  27.562
  172    HA   HIS  25           HA       HIS  25  15.452  24.312  26.194
  173    HB2  HIS  25           HB2      HIS  25  17.787  25.891  25.046
  174    HB3  HIS  25           HB3      HIS  25  17.000  24.567  24.228
  175    HD2  HIS  25           HD2      HIS  25  16.668  28.273  24.713
  176    HE1  HIS  25           HE1      HIS  25  13.113  27.050  22.715
  177    HE2  HIS  25           HE2      HIS  25  14.551  29.046  23.336
  178    H    CYS  26           H        CYS  26  18.078  24.368  28.422
  179    HA   CYS  26           HA       CYS  26  19.619  22.890  29.030
  180    HB2  CYS  26           HB2      CYS  26  17.682  20.980  27.723
  181    HB3  CYS  26           HB3      CYS  26  19.137  20.430  28.526
  182    H    LYS  27           H        LYS  27  19.919  24.074  26.200
  183    HA   LYS  27           HA       LYS  27  22.411  22.596  25.546
  184    HB2  LYS  27           HB2      LYS  27  21.876  22.865  23.101
  185    HB3  LYS  27           HB3      LYS  27  20.899  21.662  23.942
  186    HG2  LYS  27           HG2      LYS  27  18.971  23.107  23.965
  187    HG3  LYS  27           HG3      LYS  27  19.935  24.511  23.520
  188    HD2  LYS  27           HD2      LYS  27  18.627  23.845  21.634
  189    HD3  LYS  27           HD3      LYS  27  20.333  23.534  21.278
  190    HE2  LYS  27           HE2      LYS  27  19.973  21.119  21.789
  191    HE3  LYS  27           HE3      LYS  27  18.280  21.451  22.184
  192    HZ1  LYS  27           HZ1      LYS  27  19.537  21.966  19.542
  193    HZ2  LYS  27           HZ2      LYS  27  18.562  20.698  19.867
  194    HZ3  LYS  27           HZ3      LYS  27  17.951  22.228  19.909
  195    H    CYS  28           H        CYS  28  23.981  23.828  24.407
  196    HA   CYS  28           HA       CYS  28  23.860  26.696  24.859
  197    HB2  CYS  28           HB2      CYS  28  25.972  25.261  24.817
  198    HB3  CYS  28           HB3      CYS  28  25.805  25.265  23.052
  199    H    ILE  29           H        ILE  29  24.127  28.288  23.123
  200    HA   ILE  29           HA       ILE  29  21.668  28.097  21.687
  201    HB   ILE  29           HB       ILE  29  22.287  30.056  22.910
  202   HG12  ILE  29          HG12      ILE  29  21.917  30.704  19.968
  203   HG13  ILE  29          HG13      ILE  29  20.639  30.125  21.048
  204   HG21  ILE  29          HG21      ILE  29  24.304  30.779  20.769
  205   HG22  ILE  29          HG22      ILE  29  23.930  31.669  22.246
  206   HG23  ILE  29          HG23      ILE  29  24.744  30.103  22.346
  207   HD11  ILE  29          HD11      ILE  29  20.464  32.528  20.817
  208   HD12  ILE  29          HD12      ILE  29  20.957  32.151  22.476
  209   HD13  ILE  29          HD13      ILE  29  22.151  32.758  21.308
  210    HA   PRO  30           HA       PRO  30  23.487  26.991  17.714
  211    HB2  PRO  30           HB2      PRO  30  21.219  26.570  16.272
  212    HB3  PRO  30           HB3      PRO  30  21.783  25.438  17.547
  213    HG2  PRO  30           HG2      PRO  30  19.654  27.589  17.761
  214    HG3  PRO  30           HG3      PRO  30  19.592  25.899  18.348
  215    HD2  PRO  30           HD2      PRO  30  20.249  28.051  19.939
  216    HD3  PRO  30           HD3      PRO  30  20.883  26.406  20.225
  217    H    ARG  31           H        ARG  31  24.425  28.520  16.563
  218    HA   ARG  31           HA       ARG  31  22.799  30.652  15.246
  219    HB2  ARG  31           HB2      ARG  31  25.622  31.013  16.310
  220    HB3  ARG  31           HB3      ARG  31  24.725  32.157  15.298
  221    HG2  ARG  31           HG2      ARG  31  22.953  32.232  17.150
  222    HG3  ARG  31           HG3      ARG  31  24.112  31.353  18.167
  223    HD2  ARG  31           HD2      ARG  31  25.801  33.193  17.594
  224    HD3  ARG  31           HD3      ARG  31  24.484  34.087  16.847
  225    HE   ARG  31           HE       ARG  31  24.957  33.630  19.721
  226   HH11  ARG  31          HH12      ARG  31  22.648  35.038  17.395
  227   HH12  ARG  31          HH11      ARG  31  21.810  35.831  18.693
  228   HH21  ARG  31          HH21      ARG  31  23.876  34.749  21.179
  229   HH22  ARG  31          HH22      ARG  31  22.445  35.688  20.701
  Start of MODEL    9
    1    H1   GLY   1           H1       GLY   1   9.541  26.590  35.663
    2    H2   GLY   1           H2       GLY   1  10.215  25.543  36.735
    3    H3   GLY   1           H3       GLY   1   9.116  24.996  35.638
    4    HA2  GLY   1           HA2      GLY   1  11.356  24.356  35.036
    5    HA3  GLY   1           HA3      GLY   1  10.591  25.402  33.827
    6    H    SER   2           H        SER   2  13.789  27.097  34.211
    7    HA   SER   2           HA       SER   2  12.586  24.693  32.899
    8    HB2  SER   2           HB2      SER   2  13.041  27.355  31.498
    9    HB3  SER   2           HB3      SER   2  12.430  25.860  30.759
   10    HG   SER   2           HG       SER   2  11.021  27.742  31.838
   11    H    GLY   3           H        GLY   3  15.296  25.776  34.161
   12    HA2  GLY   3           HA2      GLY   3  17.182  25.154  31.966
   13    HA3  GLY   3           HA3      GLY   3  17.589  25.788  33.555
   14    H    CYS   4           H        CYS   4  18.932  23.706  32.326
   15    HA   CYS   4           HA       CYS   4  17.992  21.120  33.396
   16    HB2  CYS   4           HB2      CYS   4  19.592  22.114  31.193
   17    HB3  CYS   4           HB3      CYS   4  20.538  20.961  32.084
   18    H    MET   5           H        MET   5  20.978  23.035  33.529
   19    HA   MET   5           HA       MET   5  21.121  23.112  36.358
   20    HB2  MET   5           HB2      MET   5  23.107  21.360  34.856
   21    HB3  MET   5           HB3      MET   5  23.638  22.308  36.256
   22    HG2  MET   5           HG2      MET   5  21.792  21.203  37.559
   23    HG3  MET   5           HG3      MET   5  21.594  20.080  36.214
   24    HE1  MET   5           HE1      MET   5  23.033  18.054  35.707
   25    HE2  MET   5           HE2      MET   5  24.257  19.181  35.081
   26    HE3  MET   5           HE3      MET   5  24.732  17.877  36.191
   27    H    LYS   6           H        LYS   6  21.947  25.040  36.830
   28    HA   LYS   6           HA       LYS   6  22.812  26.929  34.837
   29    HB2  LYS   6           HB2      LYS   6  23.136  26.972  37.866
   30    HB3  LYS   6           HB3      LYS   6  23.335  28.366  36.798
   31    HG2  LYS   6           HG2      LYS   6  20.966  28.204  36.102
   32    HG3  LYS   6           HG3      LYS   6  20.733  26.796  37.133
   33    HD2  LYS   6           HD2      LYS   6  21.368  29.624  38.043
   34    HD3  LYS   6           HD3      LYS   6  19.827  28.781  38.193
   35    HE2  LYS   6           HE2      LYS   6  22.429  28.131  39.641
   36    HE3  LYS   6           HE3      LYS   6  20.955  28.810  40.333
   37    HZ1  LYS   6           HZ1      LYS   6  21.242  26.065  39.238
   38    HZ2  LYS   6           HZ2      LYS   6  21.080  26.469  40.794
   39    HZ3  LYS   6           HZ3      LYS   6  19.819  26.687  39.747
   40    H    GLU   7           H        GLU   7  24.636  25.019  37.238
   41    HA   GLU   7           HA       GLU   7  27.205  26.147  36.649
   42    HB2  GLU   7           HB2      GLU   7  26.513  23.371  37.745
   43    HB3  GLU   7           HB3      GLU   7  28.103  24.098  37.727
   44    HG2  GLU   7           HG2      GLU   7  27.386  24.390  39.906
   45    HG3  GLU   7           HG3      GLU   7  27.208  25.980  39.173
   46    H    TYR   8           H        TYR   8  25.568  23.295  35.361
   47    HA   TYR   8           HA       TYR   8  27.608  22.174  33.749
   48    HB2  TYR   8           HB2      TYR   8  25.501  21.085  34.439
   49    HB3  TYR   8           HB3      TYR   8  24.583  22.242  33.489
   50    HD1  TYR   8           HD2      TYR   8  27.368  19.757  32.922
   51    HD2  TYR   8           HD1      TYR   8  23.659  21.464  31.518
   52    HE1  TYR   8           HE2      TYR   8  27.327  18.142  31.024
   53    HE2  TYR   8           HE1      TYR   8  23.601  19.837  29.647
   54    HH   TYR   8           HH       TYR   8  24.736  18.159  28.565
   55    H    CYS   9           H        CYS   9  25.123  24.625  32.984
   56    HA   CYS   9           HA       CYS   9  26.042  24.960  30.227
   57    HB2  CYS   9           HB2      CYS   9  23.739  25.394  30.775
   58    HB3  CYS   9           HB3      CYS   9  24.190  26.590  31.999
   59    H    ALA  10           H        ALA  10  26.328  27.071  33.190
   60    HA   ALA  10           HA       ALA  10  27.794  29.058  31.831
   61    HB1  ALA  10           HB1      ALA  10  26.561  29.394  33.946
   62    HB2  ALA  10           HB2      ALA  10  27.742  28.380  34.806
   63    HB3  ALA  10           HB3      ALA  10  28.248  29.927  34.094
   64    H    GLY  11           H        GLY  11  29.028  26.129  33.439
   65    HA2  GLY  11           HA2      GLY  11  31.809  26.918  33.357
   66    HA3  GLY  11           HA3      GLY  11  31.167  25.290  33.608
   67    H    GLN  12           H        GLN  12  29.694  25.704  30.847
   68    HA   GLN  12           HA       GLN  12  32.045  24.829  29.187
   69    HB2  GLN  12           HB2      GLN  12  29.115  24.010  29.056
   70    HB3  GLN  12           HB3      GLN  12  30.385  23.439  27.983
   71    HG2  GLN  12           HG2      GLN  12  30.250  22.958  30.997
   72    HG3  GLN  12           HG3      GLN  12  29.857  21.789  29.746
   73   HE21  GLN  12          HE22      GLN  12  31.932  21.664  31.893
   74   HE22  GLN  12          HE21      GLN  12  33.420  21.322  31.002
   75    H    CYS  13           H        CYS  13  29.151  26.877  29.200
   76    HA   CYS  13           HA       CYS  13  29.842  27.916  26.495
   77    HB2  CYS  13           HB2      CYS  13  27.123  27.293  27.675
   78    HB3  CYS  13           HB3      CYS  13  27.410  28.038  26.099
   79    H    ARG  14           H        ARG  14  29.761  30.073  26.206
   80    HA   ARG  14           HA       ARG  14  29.080  31.802  28.560
   81    HB2  ARG  14           HB2      ARG  14  31.583  32.036  26.893
   82    HB3  ARG  14           HB3      ARG  14  31.117  32.958  28.334
   83    HG2  ARG  14           HG2      ARG  14  31.193  30.813  29.661
   84    HG3  ARG  14           HG3      ARG  14  31.887  30.001  28.254
   85    HD2  ARG  14           HD2      ARG  14  33.115  32.408  29.666
   86    HD3  ARG  14           HD3      ARG  14  33.551  30.739  29.991
   87    HE   ARG  14           HE       ARG  14  34.325  32.361  27.653
   88   HH11  ARG  14          HH11      ARG  14  34.373  29.046  28.944
   89   HH12  ARG  14          HH12      ARG  14  35.704  28.635  27.887
   90   HH21  ARG  14          HH21      ARG  14  35.980  31.766  26.527
   91   HH22  ARG  14          HH22      ARG  14  36.678  30.153  26.665
   92    H    GLY  15           H        GLY  15  29.324  34.115  28.099
   93    HA2  GLY  15           HA2      GLY  15  28.463  35.978  26.931
   94    HA3  GLY  15           HA3      GLY  15  27.892  34.937  25.620
   95    H    LYS  16           H        LYS  16  26.618  36.902  27.643
   96    HA   LYS  16           HA       LYS  16  24.922  35.619  29.503
   97    HB2  LYS  16           HB2      LYS  16  25.475  38.078  29.273
   98    HB3  LYS  16           HB3      LYS  16  24.340  38.158  27.923
   99    HG2  LYS  16           HG2      LYS  16  22.502  37.431  29.504
  100    HG3  LYS  16           HG3      LYS  16  23.692  37.458  30.827
  101    HD2  LYS  16           HD2      LYS  16  24.125  39.879  30.305
  102    HD3  LYS  16           HD3      LYS  16  22.845  39.803  29.074
  103    HE2  LYS  16           HE2      LYS  16  21.217  39.170  30.863
  104    HE3  LYS  16           HE3      LYS  16  22.500  39.377  32.068
  105    HZ1  LYS  16           HZ1      LYS  16  21.412  41.495  30.277
  106    HZ2  LYS  16           HZ2      LYS  16  21.172  41.401  31.881
  107    HZ3  LYS  16           HZ3      LYS  16  22.667  41.739  31.294
  108    H    VAL  17           H        VAL  17  24.470  36.000  26.020
  109    HA   VAL  17           HA       VAL  17  21.670  35.215  26.081
  110    HB   VAL  17           HB       VAL  17  22.713  36.684  24.353
  111   HG11  VAL  17          HG11      VAL  17  23.822  35.803  22.446
  112   HG12  VAL  17          HG12      VAL  17  24.729  35.218  23.847
  113   HG13  VAL  17          HG13      VAL  17  23.628  34.128  22.982
  114   HG21  VAL  17          HG21      VAL  17  21.117  34.261  23.459
  115   HG22  VAL  17          HG22      VAL  17  20.499  35.809  24.039
  116   HG23  VAL  17          HG23      VAL  17  21.355  35.722  22.486
  117    H    SER  18           H        SER  18  24.719  33.389  25.515
  118    HA   SER  18           HA       SER  18  23.284  30.935  24.822
  119    HB2  SER  18           HB2      SER  18  25.720  31.475  24.240
  120    HB3  SER  18           HB3      SER  18  26.118  31.086  25.923
  121    HG   SER  18           HG       SER  18  26.116  29.376  24.145
  122    H    GLN  19           H        GLN  19  24.942  32.191  27.798
  123    HA   GLN  19           HA       GLN  19  23.889  30.264  29.592
  124    HB2  GLN  19           HB2      GLN  19  24.842  33.121  29.916
  125    HB3  GLN  19           HB3      GLN  19  24.309  32.130  31.274
  126    HG2  GLN  19           HG2      GLN  19  25.963  30.371  30.684
  127    HG3  GLN  19           HG3      GLN  19  26.486  31.320  29.292
  128   HE21  GLN  19          HE22      GLN  19  28.583  30.849  30.466
  129   HE22  GLN  19          HE21      GLN  19  29.100  32.153  31.549
  130    H    ASP  20           H        ASP  20  22.007  32.698  28.063
  131    HA   ASP  20           HA       ASP  20  19.745  32.368  29.973
  132    HB2  ASP  20           HB2      ASP  20  19.958  34.547  29.203
  133    HB3  ASP  20           HB3      ASP  20  20.212  34.055  27.524
  134    H    TYR  21           H        TYR  21  20.484  31.657  26.515
  135    HA   TYR  21           HA       TYR  21  18.081  30.340  25.891
  136    HB2  TYR  21           HB2      TYR  21  20.061  31.050  24.403
  137    HB3  TYR  21           HB3      TYR  21  20.802  29.506  24.817
  138    HD1  TYR  21           HD2      TYR  21  19.557  27.354  24.145
  139    HD2  TYR  21           HD1      TYR  21  18.373  31.251  22.784
  140    HE1  TYR  21           HE2      TYR  21  18.133  26.308  22.392
  141    HE2  TYR  21           HE1      TYR  21  17.011  30.213  20.991
  142    HH   TYR  21           HH       TYR  21  16.559  26.676  20.783
  143    H    CYS  22           H        CYS  22  21.029  28.973  27.455
  144    HA   CYS  22           HA       CYS  22  20.055  26.246  27.400
  145    HB2  CYS  22           HB2      CYS  22  21.884  25.776  28.902
  146    HB3  CYS  22           HB3      CYS  22  22.421  26.847  27.603
  147    H    LEU  23           H        LEU  23  19.483  28.944  29.580
  148    HA   LEU  23           HA       LEU  23  18.214  27.297  31.656
  149    HB2  LEU  23           HB2      LEU  23  19.022  30.113  31.177
  150    HB3  LEU  23           HB3      LEU  23  17.531  29.923  32.097
  151    HG   LEU  23           HG       LEU  23  18.625  28.588  33.792
  152   HD11  LEU  23          HD11      LEU  23  21.193  28.878  32.172
  153   HD12  LEU  23          HD12      LEU  23  21.066  28.209  33.811
  154   HD13  LEU  23          HD13      LEU  23  20.318  27.353  32.476
  155   HD21  LEU  23          HD21      LEU  23  20.185  30.296  34.663
  156   HD22  LEU  23          HD22      LEU  23  20.268  31.045  33.047
  157   HD23  LEU  23          HD23      LEU  23  18.741  31.049  33.957
  158    H    LYS  24           H        LYS  24  17.201  28.335  28.628
  159    HA   LYS  24           HA       LYS  24  14.286  28.002  29.265
  160    HB2  LYS  24           HB2      LYS  24  15.813  29.258  26.964
  161    HB3  LYS  24           HB3      LYS  24  14.068  28.968  26.911
  162    HG2  LYS  24           HG2      LYS  24  13.644  30.509  28.665
  163    HG3  LYS  24           HG3      LYS  24  15.341  30.548  29.157
  164    HD2  LYS  24           HD2      LYS  24  15.996  31.705  27.152
  165    HD3  LYS  24           HD3      LYS  24  14.360  31.575  26.471
  166    HE2  LYS  24           HE2      LYS  24  13.461  33.035  28.207
  167    HE3  LYS  24           HE3      LYS  24  15.018  33.073  29.044
  168    HZ1  LYS  24           HZ1      LYS  24  14.678  34.096  26.275
  169    HZ2  LYS  24           HZ2      LYS  24  14.592  35.061  27.581
  170    HZ3  LYS  24           HZ3      LYS  24  15.990  34.247  27.249
  171    H    HIS  25           H        HIS  25  16.972  26.487  27.760
  172    HA   HIS  25           HA       HIS  25  15.254  24.416  26.411
  173    HB2  HIS  25           HB2      HIS  25  17.508  26.038  25.205
  174    HB3  HIS  25           HB3      HIS  25  16.803  24.622  24.450
  175    HD2  HIS  25           HD2      HIS  25  16.070  28.308  25.013
  176    HE1  HIS  25           HE1      HIS  25  12.645  26.694  23.053
  177    HE2  HIS  25           HE2      HIS  25  13.739  28.831  23.893
  178    H    CYS  26           H        CYS  26  17.915  24.474  28.599
  179    HA   CYS  26           HA       CYS  26  19.476  22.996  29.168
  180    HB2  CYS  26           HB2      CYS  26  17.513  21.373  28.907
  181    HB3  CYS  26           HB3      CYS  26  18.239  20.914  27.370
  182    H    LYS  27           H        LYS  27  19.399  24.192  26.090
  183    HA   LYS  27           HA       LYS  27  21.882  22.803  25.140
  184    HB2  LYS  27           HB2      LYS  27  19.917  24.448  23.542
  185    HB3  LYS  27           HB3      LYS  27  21.203  23.444  22.901
  186    HG2  LYS  27           HG2      LYS  27  20.024  21.414  23.358
  187    HG3  LYS  27           HG3      LYS  27  18.868  22.219  24.419
  188    HD2  LYS  27           HD2      LYS  27  18.173  23.649  22.404
  189    HD3  LYS  27           HD3      LYS  27  19.116  22.513  21.422
  190    HE2  LYS  27           HE2      LYS  27  17.671  20.665  22.157
  191    HE3  LYS  27           HE3      LYS  27  16.811  21.741  23.276
  192    HZ1  LYS  27           HZ1      LYS  27  16.039  23.026  21.367
  193    HZ2  LYS  27           HZ2      LYS  27  16.897  22.104  20.336
  194    HZ3  LYS  27           HZ3      LYS  27  15.627  21.428  21.150
  195    H    CYS  28           H        CYS  28  23.597  24.004  24.387
  196    HA   CYS  28           HA       CYS  28  23.714  26.886  25.005
  197    HB2  CYS  28           HB2      CYS  28  25.735  25.184  23.528
  198    HB3  CYS  28           HB3      CYS  28  25.962  26.809  24.180
  199    H    ILE  29           H        ILE  29  23.854  28.552  23.450
  200    HA   ILE  29           HA       ILE  29  21.626  28.232  21.820
  201    HB   ILE  29           HB       ILE  29  22.164  30.232  23.023
  202   HG12  ILE  29          HG12      ILE  29  21.804  30.796  20.059
  203   HG13  ILE  29          HG13      ILE  29  20.551  30.195  21.154
  204   HG21  ILE  29          HG21      ILE  29  24.116  31.050  20.854
  205   HG22  ILE  29          HG22      ILE  29  23.761  31.856  22.397
  206   HG23  ILE  29          HG23      ILE  29  24.640  30.326  22.378
  207   HD11  ILE  29          HD11      ILE  29  20.787  32.244  22.531
  208   HD12  ILE  29          HD12      ILE  29  21.946  32.892  21.339
  209   HD13  ILE  29          HD13      ILE  29  20.268  32.574  20.869
  210    HA   PRO  30           HA       PRO  30  23.521  27.569  17.739
  211    HB2  PRO  30           HB2      PRO  30  21.365  26.699  16.383
  212    HB3  PRO  30           HB3      PRO  30  22.164  25.698  17.630
  213    HG2  PRO  30           HG2      PRO  30  19.646  27.340  17.867
  214    HG3  PRO  30           HG3      PRO  30  19.964  25.700  18.505
  215    HD2  PRO  30           HD2      PRO  30  20.173  28.086  19.969
  216    HD3  PRO  30           HD3      PRO  30  21.003  26.558  20.386
  217    H    ARG  31           H        ARG  31  23.906  29.006  16.173
  218    HA   ARG  31           HA       ARG  31  22.028  30.902  15.042
  219    HB2  ARG  31           HB2      ARG  31  23.376  32.927  15.794
  220    HB3  ARG  31           HB3      ARG  31  22.301  32.201  16.978
  221    HG2  ARG  31           HG2      ARG  31  24.197  31.049  18.058
  222    HG3  ARG  31           HG3      ARG  31  25.319  31.768  16.881
  223    HD2  ARG  31           HD2      ARG  31  24.730  34.011  17.703
  224    HD3  ARG  31           HD3      ARG  31  23.531  33.298  18.809
  225    HE   ARG  31           HE       ARG  31  25.969  32.046  19.394
  226   HH11  ARG  31          HH11      ARG  31  24.730  35.336  19.620
  227   HH12  ARG  31          HH12      ARG  31  25.880  35.710  20.928
  228   HH21  ARG  31          HH21      ARG  31  27.333  32.663  21.055
  229   HH22  ARG  31          HH22      ARG  31  27.253  34.331  21.632
  Start of MODEL   10
    1    H1   GLY   1           H1       GLY   1  11.325  25.975  25.974
    2    H2   GLY   1           H2       GLY   1  11.812  24.774  24.959
    3    H3   GLY   1           H3       GLY   1  12.821  25.268  26.165
    4    HA2  GLY   1           HA2      GLY   1  10.199  23.968  26.563
    5    HA3  GLY   1           HA3      GLY   1  11.754  23.125  26.634
    6    H    SER   2           H        SER   2  12.822  23.053  28.554
    7    HA   SER   2           HA       SER   2  12.549  25.243  30.488
    8    HB2  SER   2           HB2      SER   2  12.090  23.840  32.417
    9    HB3  SER   2           HB3      SER   2  10.774  23.769  31.246
   10    HG   SER   2           HG       SER   2  10.988  21.742  31.426
   11    H    GLY   3           H        GLY   3  14.140  25.180  32.209
   12    HA2  GLY   3           HA2      GLY   3  16.695  24.787  30.963
   13    HA3  GLY   3           HA3      GLY   3  16.394  25.498  32.536
   14    H    CYS   4           H        CYS   4  18.573  23.889  31.855
   15    HA   CYS   4           HA       CYS   4  18.124  21.275  33.192
   16    HB2  CYS   4           HB2      CYS   4  19.968  22.211  31.084
   17    HB3  CYS   4           HB3      CYS   4  20.654  21.112  32.275
   18    H    MET   5           H        MET   5  21.174  23.126  33.374
   19    HA   MET   5           HA       MET   5  20.711  23.819  36.186
   20    HB2  MET   5           HB2      MET   5  22.852  21.803  35.372
   21    HB3  MET   5           HB3      MET   5  22.967  22.798  36.830
   22    HG2  MET   5           HG2      MET   5  20.740  21.900  37.558
   23    HG3  MET   5           HG3      MET   5  20.824  20.741  36.233
   24    HE1  MET   5           HE1      MET   5  23.778  19.668  36.100
   25    HE2  MET   5           HE2      MET   5  23.647  18.329  37.265
   26    HE3  MET   5           HE3      MET   5  22.310  18.661  36.160
   27    H    LYS   6           H        LYS   6  21.762  25.612  36.736
   28    HA   LYS   6           HA       LYS   6  22.934  27.359  34.863
   29    HB2  LYS   6           HB2      LYS   6  21.895  27.785  37.183
   30    HB3  LYS   6           HB3      LYS   6  23.465  27.349  37.861
   31    HG2  LYS   6           HG2      LYS   6  24.454  29.231  36.407
   32    HG3  LYS   6           HG3      LYS   6  22.777  29.681  36.012
   33    HD2  LYS   6           HD2      LYS   6  22.392  29.770  38.574
   34    HD3  LYS   6           HD3      LYS   6  24.133  29.598  38.741
   35    HE2  LYS   6           HE2      LYS   6  23.809  31.884  38.909
   36    HE3  LYS   6           HE3      LYS   6  24.354  31.684  37.239
   37    HZ1  LYS   6           HZ1      LYS   6  22.411  33.176  37.640
   38    HZ2  LYS   6           HZ2      LYS   6  22.081  32.035  36.503
   39    HZ3  LYS   6           HZ3      LYS   6  21.488  31.870  38.029
   40    H    GLU   7           H        GLU   7  24.589  25.164  37.155
   41    HA   GLU   7           HA       GLU   7  27.263  25.875  36.475
   42    HB2  GLU   7           HB2      GLU   7  26.132  23.229  37.513
   43    HB3  GLU   7           HB3      GLU   7  27.834  23.665  37.429
   44    HG2  GLU   7           HG2      GLU   7  27.460  24.185  39.588
   45    HG3  GLU   7           HG3      GLU   7  27.150  25.756  38.860
   46    H    TYR   8           H        TYR   8  25.066  23.511  34.908
   47    HA   TYR   8           HA       TYR   8  27.155  22.475  33.137
   48    HB2  TYR   8           HB2      TYR   8  25.085  21.207  33.742
   49    HB3  TYR   8           HB3      TYR   8  24.128  22.365  32.828
   50    HD1  TYR   8           HD2      TYR   8  27.000  19.975  32.513
   51    HD2  TYR   8           HD1      TYR   8  23.827  22.044  30.455
   52    HE1  TYR   8           HE2      TYR   8  27.470  18.647  30.459
   53    HE2  TYR   8           HE1      TYR   8  24.305  20.718  28.401
   54    HH   TYR   8           HH       TYR   8  26.877  18.207  28.309
   55    H    CYS   9           H        CYS   9  24.536  24.891  32.860
   56    HA   CYS   9           HA       CYS   9  25.076  25.681  30.186
   57    HB2  CYS   9           HB2      CYS   9  23.873  27.256  32.491
   58    HB3  CYS   9           HB3      CYS   9  23.762  27.687  30.791
   59    H    ALA  10           H        ALA  10  26.472  26.989  33.253
   60    HA   ALA  10           HA       ALA  10  28.231  28.854  31.884
   61    HB1  ALA  10           HB1      ALA  10  28.346  27.647  34.686
   62    HB2  ALA  10           HB2      ALA  10  29.293  29.034  34.103
   63    HB3  ALA  10           HB3      ALA  10  27.534  29.163  34.229
   64    H    GLY  11           H        GLY  11  28.485  25.422  32.780
   65    HA2  GLY  11           HA2      GLY  11  31.268  25.063  32.351
   66    HA3  GLY  11           HA3      GLY  11  30.014  23.823  32.213
   67    H    GLN  12           H        GLN  12  28.502  24.681  30.101
   68    HA   GLN  12           HA       GLN  12  30.302  24.085  27.835
   69    HB2  GLN  12           HB2      GLN  12  27.269  24.103  28.127
   70    HB3  GLN  12           HB3      GLN  12  28.149  23.545  26.711
   71    HG2  GLN  12           HG2      GLN  12  28.180  22.270  29.475
   72    HG3  GLN  12           HG3      GLN  12  27.384  21.670  28.024
   73   HE21  GLN  12          HE22      GLN  12  29.119  21.562  26.019
   74   HE22  GLN  12          HE21      GLN  12  30.523  20.619  26.495
   75    H    CYS  13           H        CYS  13  27.882  26.633  28.651
   76    HA   CYS  13           HA       CYS  13  28.174  27.719  25.919
   77    HB2  CYS  13           HB2      CYS  13  26.163  28.640  27.939
   78    HB3  CYS  13           HB3      CYS  13  26.086  28.685  26.181
   79    H    ARG  14           H        ARG  14  28.503  29.995  25.507
   80    HA   ARG  14           HA       ARG  14  29.449  31.654  27.817
   81    HB2  ARG  14           HB2      ARG  14  30.826  31.179  25.155
   82    HB3  ARG  14           HB3      ARG  14  31.203  32.496  26.264
   83    HG2  ARG  14           HG2      ARG  14  32.818  31.070  26.872
   84    HG3  ARG  14           HG3      ARG  14  31.582  30.639  28.044
   85    HD2  ARG  14           HD2      ARG  14  31.040  28.629  26.571
   86    HD3  ARG  14           HD3      ARG  14  32.358  29.129  25.512
   87    HE   ARG  14           HE       ARG  14  33.870  28.202  26.976
   88   HH11  ARG  14          HH21      ARG  14  30.875  28.623  28.802
   89   HH12  ARG  14          HH22      ARG  14  31.532  27.890  30.225
   90   HH21  ARG  14          HH11      ARG  14  34.724  27.556  28.946
   91   HH22  ARG  14          HH12      ARG  14  33.651  27.322  30.302
   92    H    GLY  15           H        GLY  15  29.257  33.758  27.742
   93    HA2  GLY  15           HA2      GLY  15  28.392  35.835  26.962
   94    HA3  GLY  15           HA3      GLY  15  27.557  35.011  25.643
   95    H    LYS  16           H        LYS  16  26.643  36.766  27.923
   96    HA   LYS  16           HA       LYS  16  25.289  35.265  29.920
   97    HB2  LYS  16           HB2      LYS  16  25.766  38.013  29.294
   98    HB3  LYS  16           HB3      LYS  16  24.021  37.862  29.390
   99    HG2  LYS  16           HG2      LYS  16  26.023  37.048  31.540
  100    HG3  LYS  16           HG3      LYS  16  25.040  38.515  31.524
  101    HD2  LYS  16           HD2      LYS  16  22.976  37.091  31.573
  102    HD3  LYS  16           HD3      LYS  16  23.993  35.659  31.786
  103    HE2  LYS  16           HE2      LYS  16  23.814  38.063  33.663
  104    HE3  LYS  16           HE3      LYS  16  23.080  36.480  33.916
  105    HZ1  LYS  16           HZ1      LYS  16  25.964  37.142  33.971
  106    HZ2  LYS  16           HZ2      LYS  16  25.064  36.517  35.145
  107    HZ3  LYS  16           HZ3      LYS  16  25.425  35.568  33.862
  108    H    VAL  17           H        VAL  17  24.297  35.922  26.656
  109    HA   VAL  17           HA       VAL  17  21.454  35.252  27.152
  110    HB   VAL  17           HB       VAL  17  22.880  35.709  24.511
  111   HG11  VAL  17          HG11      VAL  17  20.587  36.250  23.704
  112   HG12  VAL  17          HG12      VAL  17  20.708  34.573  24.241
  113   HG13  VAL  17          HG13      VAL  17  19.929  35.782  25.286
  114   HG21  VAL  17          HG21      VAL  17  21.417  37.650  26.340
  115   HG22  VAL  17          HG22      VAL  17  23.128  37.711  25.865
  116   HG23  VAL  17          HG23      VAL  17  21.878  38.001  24.653
  117    H    SER  18           H        SER  18  24.357  33.738  25.622
  118    HA   SER  18           HA       SER  18  23.151  31.351  24.741
  119    HB2  SER  18           HB2      SER  18  25.962  31.591  25.848
  120    HB3  SER  18           HB3      SER  18  25.393  30.642  24.477
  121    HG   SER  18           HG       SER  18  26.588  32.803  24.295
  122    H    GLN  19           H        GLN  19  25.001  32.042  27.785
  123    HA   GLN  19           HA       GLN  19  24.354  29.614  29.128
  124    HB2  GLN  19           HB2      GLN  19  24.900  32.424  30.168
  125    HB3  GLN  19           HB3      GLN  19  24.809  30.983  31.198
  126    HG2  GLN  19           HG2      GLN  19  26.626  29.912  29.952
  127    HG3  GLN  19           HG3      GLN  19  26.738  31.279  28.848
  128   HE21  GLN  19          HE22      GLN  19  29.018  30.588  29.938
  129   HE22  GLN  19          HE21      GLN  19  29.474  31.801  31.143
  130    H    ASP  20           H        ASP  20  22.270  32.468  28.710
  131    HA   ASP  20           HA       ASP  20  20.238  31.491  30.582
  132    HB2  ASP  20           HB2      ASP  20  20.586  33.851  30.328
  133    HB3  ASP  20           HB3      ASP  20  20.343  33.763  28.585
  134    H    TYR  21           H        TYR  21  20.645  31.429  26.998
  135    HA   TYR  21           HA       TYR  21  18.137  30.261  26.346
  136    HB2  TYR  21           HB2      TYR  21  19.772  31.168  24.741
  137    HB3  TYR  21           HB3      TYR  21  20.880  29.859  25.101
  138    HD1  TYR  21           HD1      TYR  21  20.487  27.569  24.250
  139    HD2  TYR  21           HD2      TYR  21  17.801  30.814  23.290
  140    HE1  TYR  21           HE1      TYR  21  19.579  26.272  22.353
  141    HE2  TYR  21           HE2      TYR  21  16.873  29.472  21.404
  142    HH   TYR  21           HH       TYR  21  16.977  27.436  20.227
  143    H    CYS  22           H        CYS  22  21.077  28.785  27.671
  144    HA   CYS  22           HA       CYS  22  20.153  26.024  27.428
  145    HB2  CYS  22           HB2      CYS  22  22.463  26.513  27.501
  146    HB3  CYS  22           HB3      CYS  22  22.323  27.454  28.976
  147    H    LEU  23           H        LEU  23  19.558  28.546  29.766
  148    HA   LEU  23           HA       LEU  23  18.174  26.853  31.715
  149    HB2  LEU  23           HB2      LEU  23  19.115  29.621  31.411
  150    HB3  LEU  23           HB3      LEU  23  17.472  29.569  32.015
  151    HG   LEU  23           HG       LEU  23  18.152  28.164  33.905
  152   HD11  LEU  23          HD11      LEU  23  20.043  26.891  32.964
  153   HD12  LEU  23          HD12      LEU  23  20.970  28.393  32.739
  154   HD13  LEU  23          HD13      LEU  23  20.578  27.806  34.372
  155   HD21  LEU  23          HD21      LEU  23  19.578  29.895  34.989
  156   HD22  LEU  23          HD22      LEU  23  19.875  30.603  33.377
  157   HD23  LEU  23          HD23      LEU  23  18.233  30.591  34.059
  158    H    LYS  24           H        LYS  24  17.321  28.159  28.668
  159    HA   LYS  24           HA       LYS  24  14.392  27.792  29.193
  160    HB2  LYS  24           HB2      LYS  24  15.938  28.973  26.864
  161    HB3  LYS  24           HB3      LYS  24  14.183  28.741  26.883
  162    HG2  LYS  24           HG2      LYS  24  13.961  30.299  28.745
  163    HG3  LYS  24           HG3      LYS  24  15.731  30.466  28.856
  164    HD2  LYS  24           HD2      LYS  24  15.878  31.525  26.719
  165    HD3  LYS  24           HD3      LYS  24  14.204  31.122  26.324
  166    HE2  LYS  24           HE2      LYS  24  14.345  33.472  26.819
  167    HE3  LYS  24           HE3      LYS  24  13.367  32.650  28.037
  168    HZ1  LYS  24           HZ1      LYS  24  15.273  32.739  29.547
  169    HZ2  LYS  24           HZ2      LYS  24  16.205  33.500  28.433
  170    HZ3  LYS  24           HZ3      LYS  24  14.889  34.246  29.017
  171    H    HIS  25           H        HIS  25  17.112  26.332  27.549
  172    HA   HIS  25           HA       HIS  25  15.323  24.291  26.284
  173    HB2  HIS  25           HB2      HIS  25  17.595  25.874  25.035
  174    HB3  HIS  25           HB3      HIS  25  16.671  24.623  24.227
  175    HD2  HIS  25           HD2      HIS  25  16.643  28.291  24.817
  176    HE1  HIS  25           HE1      HIS  25  12.784  27.394  23.260
  177    HE2  HIS  25           HE2      HIS  25  14.442  29.268  23.767
  178    H    CYS  26           H        CYS  26  17.935  24.187  28.438
  179    HA   CYS  26           HA       CYS  26  19.421  22.616  28.972
  180    HB2  CYS  26           HB2      CYS  26  17.374  20.941  27.549
  181    HB3  CYS  26           HB3      CYS  26  18.833  20.205  28.172
  182    H    LYS  27           H        LYS  27  19.636  23.816  26.021
  183    HA   LYS  27           HA       LYS  27  22.275  22.538  25.596
  184    HB2  LYS  27           HB2      LYS  27  21.980  22.497  23.206
  185    HB3  LYS  27           HB3      LYS  27  20.758  21.493  23.978
  186    HG2  LYS  27           HG2      LYS  27  19.054  23.298  23.605
  187    HG3  LYS  27           HG3      LYS  27  20.330  24.315  22.903
  188    HD2  LYS  27           HD2      LYS  27  20.755  22.479  21.231
  189    HD3  LYS  27           HD3      LYS  27  19.282  21.689  21.800
  190    HE2  LYS  27           HE2      LYS  27  17.885  23.260  20.806
  191    HE3  LYS  27           HE3      LYS  27  19.050  24.582  20.998
  192    HZ1  LYS  27           HZ1      LYS  27  20.354  23.709  19.225
  193    HZ2  LYS  27           HZ2      LYS  27  19.433  22.365  19.081
  194    HZ3  LYS  27           HZ3      LYS  27  18.806  23.821  18.639
  195    H    CYS  28           H        CYS  28  23.725  23.855  24.314
  196    HA   CYS  28           HA       CYS  28  23.522  26.711  24.937
  197    HB2  CYS  28           HB2      CYS  28  25.556  25.218  23.262
  198    HB3  CYS  28           HB3      CYS  28  25.687  26.894  23.798
  199    H    ILE  29           H        ILE  29  23.732  28.428  23.355
  200    HA   ILE  29           HA       ILE  29  21.526  28.190  21.584
  201    HB   ILE  29           HB       ILE  29  22.016  30.077  23.068
  202   HG12  ILE  29          HG12      ILE  29  21.570  30.885  20.177
  203   HG13  ILE  29          HG13      ILE  29  20.355  30.186  21.256
  204   HG21  ILE  29          HG21      ILE  29  24.474  30.294  22.438
  205   HG22  ILE  29          HG22      ILE  29  23.918  31.115  20.963
  206   HG23  ILE  29          HG23      ILE  29  23.559  31.805  22.548
  207   HD11  ILE  29          HD11      ILE  29  20.668  32.136  22.812
  208   HD12  ILE  29          HD12      ILE  29  21.722  32.883  21.588
  209   HD13  ILE  29          HD13      ILE  29  20.022  32.564  21.214
  210    HA   PRO  30           HA       PRO  30  23.521  27.200  17.712
  211    HB2  PRO  30           HB2      PRO  30  21.220  28.754  16.522
  212    HB3  PRO  30           HB3      PRO  30  21.873  27.158  16.047
  213    HG2  PRO  30           HG2      PRO  30  19.624  27.303  17.536
  214    HG3  PRO  30           HG3      PRO  30  20.894  26.107  17.963
  215    HD2  PRO  30           HD2      PRO  30  20.372  28.828  19.194
  216    HD3  PRO  30           HD3      PRO  30  20.688  27.253  19.987
  217    H    ARG  31           H        ARG  31  24.297  28.164  15.675
  218    HA   ARG  31           HA       ARG  31  25.009  31.057  15.741
  219    HB2  ARG  31           HB2      ARG  31  27.406  30.418  15.315
  220    HB3  ARG  31           HB3      ARG  31  26.831  30.105  16.946
  221    HG2  ARG  31           HG2      ARG  31  26.611  27.722  16.500
  222    HG3  ARG  31           HG3      ARG  31  27.030  27.944  14.790
  223    HD2  ARG  31           HD2      ARG  31  29.269  28.461  15.269
  224    HD3  ARG  31           HD3      ARG  31  28.905  28.901  16.938
  225    HE   ARG  31           HE       ARG  31  28.877  26.102  15.873
  226   HH11  ARG  31          HH21      ARG  31  29.667  28.251  18.563
  227   HH12  ARG  31          HH22      ARG  31  29.869  26.902  19.660
  228   HH21  ARG  31          HH11      ARG  31  29.396  24.501  17.251
  229   HH22  ARG  31          HH12      ARG  31  29.722  24.831  18.928
  Start of MODEL   11
    1    H1   GLY   1           H1       GLY   1  14.171  31.072  37.803
    2    H2   GLY   1           H2       GLY   1  15.477  30.998  36.799
    3    H3   GLY   1           H3       GLY   1  15.673  30.829  38.429
    4    HA2  GLY   1           HA2      GLY   1  14.493  28.777  38.459
    5    HA3  GLY   1           HA3      GLY   1  14.181  28.949  36.722
    6    H    SER   2           H        SER   2  15.572  26.744  38.004
    7    HA   SER   2           HA       SER   2  18.436  27.095  37.568
    8    HB2  SER   2           HB2      SER   2  18.547  24.688  38.160
    9    HB3  SER   2           HB3      SER   2  17.704  25.684  39.354
   10    HG   SER   2           HG       SER   2  16.504  23.872  39.047
   11    H    GLY   3           H        GLY   3  15.853  26.320  35.421
   12    HA2  GLY   3           HA2      GLY   3  15.810  25.635  33.199
   13    HA3  GLY   3           HA3      GLY   3  17.475  26.196  33.130
   14    H    CYS   4           H        CYS   4  18.653  24.658  32.182
   15    HA   CYS   4           HA       CYS   4  18.352  21.827  32.619
   16    HB2  CYS   4           HB2      CYS   4  19.474  23.177  30.691
   17    HB3  CYS   4           HB3      CYS   4  20.924  23.133  31.696
   18    H    MET   5           H        MET   5  21.250  23.716  33.545
   19    HA   MET   5           HA       MET   5  20.741  23.668  36.341
   20    HB2  MET   5           HB2      MET   5  23.248  22.160  35.431
   21    HB3  MET   5           HB3      MET   5  22.887  22.686  37.064
   22    HG2  MET   5           HG2      MET   5  20.860  21.170  37.012
   23    HG3  MET   5           HG3      MET   5  21.466  20.554  35.465
   24    HE1  MET   5           HE1      MET   5  21.849  20.725  39.285
   25    HE2  MET   5           HE2      MET   5  23.320  19.784  39.611
   26    HE3  MET   5           HE3      MET   5  23.438  21.409  38.903
   27    H    LYS   6           H        LYS   6  21.952  25.464  37.262
   28    HA   LYS   6           HA       LYS   6  22.911  27.406  35.392
   29    HB2  LYS   6           HB2      LYS   6  23.353  27.193  38.399
   30    HB3  LYS   6           HB3      LYS   6  23.865  28.560  37.401
   31    HG2  LYS   6           HG2      LYS   6  21.466  28.869  36.679
   32    HG3  LYS   6           HG3      LYS   6  20.999  27.655  37.886
   33    HD2  LYS   6           HD2      LYS   6  22.035  29.062  39.678
   34    HD3  LYS   6           HD3      LYS   6  22.544  30.230  38.450
   35    HE2  LYS   6           HE2      LYS   6  20.101  30.494  37.811
   36    HE3  LYS   6           HE3      LYS   6  19.678  29.542  39.245
   37    HZ1  LYS   6           HZ1      LYS   6  20.608  31.278  40.637
   38    HZ2  LYS   6           HZ2      LYS   6  21.352  31.991  39.372
   39    HZ3  LYS   6           HZ3      LYS   6  19.733  32.064  39.494
   40    H    GLU   7           H        GLU   7  24.819  25.219  37.468
   41    HA   GLU   7           HA       GLU   7  27.396  26.115  36.600
   42    HB2  GLU   7           HB2      GLU   7  26.297  23.690  38.019
   43    HB3  GLU   7           HB3      GLU   7  27.875  23.554  37.300
   44    HG2  GLU   7           HG2      GLU   7  28.282  24.121  39.490
   45    HG3  GLU   7           HG3      GLU   7  28.674  25.528  38.534
   46    H    TYR   8           H        TYR   8  25.272  23.573  35.286
   47    HA   TYR   8           HA       TYR   8  27.164  22.467  33.409
   48    HB2  TYR   8           HB2      TYR   8  25.106  21.295  34.100
   49    HB3  TYR   8           HB3      TYR   8  24.118  22.546  33.352
   50    HD1  TYR   8           HD1      TYR   8  26.768  20.026  32.534
   51    HD2  TYR   8           HD2      TYR   8  23.376  22.272  31.111
   52    HE1  TYR   8           HE1      TYR   8  26.796  18.729  30.418
   53    HE2  TYR   8           HE2      TYR   8  23.391  20.954  28.998
   54    HH   TYR   8           HH       TYR   8  25.875  18.430  28.367
   55    H    CYS   9           H        CYS   9  24.568  24.928  33.051
   56    HA   CYS   9           HA       CYS   9  25.188  25.545  30.323
   57    HB2  CYS   9           HB2      CYS   9  23.748  27.110  32.495
   58    HB3  CYS   9           HB3      CYS   9  23.796  27.580  30.799
   59    H    ALA  10           H        ALA  10  26.400  27.028  33.393
   60    HA   ALA  10           HA       ALA  10  28.017  29.020  32.114
   61    HB1  ALA  10           HB1      ALA  10  28.332  27.631  34.810
   62    HB2  ALA  10           HB2      ALA  10  29.114  29.147  34.316
   63    HB3  ALA  10           HB3      ALA  10  27.353  29.078  34.490
   64    H    GLY  11           H        GLY  11  28.668  25.606  32.905
   65    HA2  GLY  11           HA2      GLY  11  31.476  25.641  32.250
   66    HA3  GLY  11           HA3      GLY  11  30.434  24.223  32.444
   67    H    GLN  12           H        GLN  12  28.587  24.468  30.407
   68    HA   GLN  12           HA       GLN  12  30.214  23.785  28.074
   69    HB2  GLN  12           HB2      GLN  12  27.217  23.827  28.604
   70    HB3  GLN  12           HB3      GLN  12  27.917  23.315  27.073
   71    HG2  GLN  12           HG2      GLN  12  28.568  22.013  29.756
   72    HG3  GLN  12           HG3      GLN  12  27.334  21.446  28.640
   73   HE21  GLN  12          HE22      GLN  12  29.337  19.666  29.365
   74   HE22  GLN  12          HE21      GLN  12  30.300  19.382  27.920
   75    H    CYS  13           H        CYS  13  27.958  26.454  28.855
   76    HA   CYS  13           HA       CYS  13  28.369  27.561  26.136
   77    HB2  CYS  13           HB2      CYS  13  26.112  28.177  28.035
   78    HB3  CYS  13           HB3      CYS  13  26.207  28.518  26.319
   79    H    ARG  14           H        ARG  14  28.151  29.983  25.955
   80    HA   ARG  14           HA       ARG  14  29.424  31.482  28.226
   81    HB2  ARG  14           HB2      ARG  14  30.346  31.392  25.327
   82    HB3  ARG  14           HB3      ARG  14  30.988  32.489  26.545
   83    HG2  ARG  14           HG2      ARG  14  31.240  29.472  26.663
   84    HG3  ARG  14           HG3      ARG  14  32.481  30.611  26.153
   85    HD2  ARG  14           HD2      ARG  14  32.478  31.674  28.382
   86    HD3  ARG  14           HD3      ARG  14  31.252  30.545  28.954
   87    HE   ARG  14           HE       ARG  14  34.096  30.083  28.675
   88   HH11  ARG  14          HH11      ARG  14  31.010  28.388  28.903
   89   HH12  ARG  14          HH12      ARG  14  31.808  26.862  29.203
   90   HH21  ARG  14          HH21      ARG  14  34.965  28.104  29.231
   91   HH22  ARG  14          HH22      ARG  14  33.981  26.669  29.177
   92    H    GLY  15           H        GLY  15  29.832  33.879  27.151
   93    HA2  GLY  15           HA2      GLY  15  29.000  35.863  26.448
   94    HA3  GLY  15           HA3      GLY  15  27.935  34.934  25.408
   95    H    LYS  16           H        LYS  16  27.253  34.225  28.534
   96    HA   LYS  16           HA       LYS  16  25.577  34.379  29.965
   97    HB2  LYS  16           HB2      LYS  16  26.534  36.647  30.287
   98    HB3  LYS  16           HB3      LYS  16  25.292  37.286  29.216
   99    HG2  LYS  16           HG2      LYS  16  23.529  36.517  30.784
  100    HG3  LYS  16           HG3      LYS  16  24.736  35.647  31.745
  101    HD2  LYS  16           HD2      LYS  16  25.862  37.873  32.205
  102    HD3  LYS  16           HD3      LYS  16  24.463  38.672  31.482
  103    HE2  LYS  16           HE2      LYS  16  24.287  36.682  33.792
  104    HE3  LYS  16           HE3      LYS  16  24.516  38.413  34.046
  105    HZ1  LYS  16           HZ1      LYS  16  22.169  37.756  34.178
  106    HZ2  LYS  16           HZ2      LYS  16  22.420  38.836  32.962
  107    HZ3  LYS  16           HZ3      LYS  16  22.184  37.263  32.620
  108    H    VAL  17           H        VAL  17  24.860  35.586  26.808
  109    HA   VAL  17           HA       VAL  17  22.029  35.016  26.773
  110    HB   VAL  17           HB       VAL  17  24.099  35.422  24.588
  111   HG11  VAL  17          HG11      VAL  17  22.155  36.008  23.133
  112   HG12  VAL  17          HG12      VAL  17  22.142  34.304  23.599
  113   HG13  VAL  17          HG13      VAL  17  21.055  35.455  24.408
  114   HG21  VAL  17          HG21      VAL  17  23.822  37.407  26.057
  115   HG22  VAL  17          HG22      VAL  17  23.134  37.703  24.459
  116   HG23  VAL  17          HG23      VAL  17  22.063  37.331  25.818
  117    H    SER  18           H        SER  18  24.911  33.105  25.585
  118    HA   SER  18           HA       SER  18  23.194  30.952  24.624
  119    HB2  SER  18           HB2      SER  18  25.532  31.417  23.820
  120    HB3  SER  18           HB3      SER  18  26.131  30.817  25.372
  121    HG   SER  18           HG       SER  18  26.157  29.130  24.077
  122    H    GLN  19           H        GLN  19  25.005  31.581  27.643
  123    HA   GLN  19           HA       GLN  19  24.139  29.333  29.169
  124    HB2  GLN  19           HB2      GLN  19  24.781  32.217  29.870
  125    HB3  GLN  19           HB3      GLN  19  24.420  31.005  31.105
  126    HG2  GLN  19           HG2      GLN  19  26.324  29.737  30.656
  127    HG3  GLN  19           HG3      GLN  19  26.551  30.403  29.044
  128   HE21  GLN  19          HE22      GLN  19  28.833  30.359  30.156
  129   HE22  GLN  19          HE21      GLN  19  29.281  31.967  30.725
  130    H    ASP  20           H        ASP  20  22.401  32.456  28.569
  131    HA   ASP  20           HA       ASP  20  20.133  31.832  30.202
  132    HB2  ASP  20           HB2      ASP  20  20.687  34.106  29.578
  133    HB3  ASP  20           HB3      ASP  20  20.490  33.746  27.864
  134    H    TYR  21           H        TYR  21  20.670  31.451  26.651
  135    HA   TYR  21           HA       TYR  21  18.206  30.160  26.092
  136    HB2  TYR  21           HB2      TYR  21  20.129  30.996  24.543
  137    HB3  TYR  21           HB3      TYR  21  20.805  29.388  24.745
  138    HD1  TYR  21           HD1      TYR  21  17.940  31.386  23.551
  139    HD2  TYR  21           HD2      TYR  21  19.723  27.458  23.570
  140    HE1  TYR  21           HE1      TYR  21  16.375  30.682  21.755
  141    HE2  TYR  21           HE2      TYR  21  18.149  26.757  21.748
  142    HH   TYR  21           HH       TYR  21  15.731  29.038  20.389
  143    H    CYS  22           H        CYS  22  21.266  28.754  27.328
  144    HA   CYS  22           HA       CYS  22  20.360  26.011  27.278
  145    HB2  CYS  22           HB2      CYS  22  22.677  26.596  27.310
  146    HB3  CYS  22           HB3      CYS  22  22.520  27.477  28.817
  147    H    LEU  23           H        LEU  23  19.963  28.612  29.622
  148    HA   LEU  23           HA       LEU  23  18.623  27.035  31.634
  149    HB2  LEU  23           HB2      LEU  23  19.507  29.784  31.130
  150    HB3  LEU  23           HB3      LEU  23  17.915  29.774  31.829
  151    HG   LEU  23           HG       LEU  23  18.688  28.554  33.793
  152   HD11  LEU  23          HD11      LEU  23  21.418  28.508  32.431
  153   HD12  LEU  23          HD12      LEU  23  21.116  28.110  34.138
  154   HD13  LEU  23          HD13      LEU  23  20.433  27.093  32.876
  155   HD21  LEU  23          HD21      LEU  23  20.563  30.819  32.979
  156   HD22  LEU  23          HD22      LEU  23  18.946  31.005  33.701
  157   HD23  LEU  23          HD23      LEU  23  20.257  30.281  34.652
  158    H    LYS  24           H        LYS  24  17.552  28.126  28.597
  159    HA   LYS  24           HA       LYS  24  14.660  27.746  29.291
  160    HB2  LYS  24           HB2      LYS  24  16.064  28.966  26.884
  161    HB3  LYS  24           HB3      LYS  24  14.320  28.699  26.991
  162    HG2  LYS  24           HG2      LYS  24  14.182  30.212  28.914
  163    HG3  LYS  24           HG3      LYS  24  15.938  30.462  28.865
  164    HD2  LYS  24           HD2      LYS  24  15.837  31.529  26.713
  165    HD3  LYS  24           HD3      LYS  24  14.160  31.036  26.473
  166    HE2  LYS  24           HE2      LYS  24  14.150  33.357  26.975
  167    HE3  LYS  24           HE3      LYS  24  13.446  32.496  28.349
  168    HZ1  LYS  24           HZ1      LYS  24  15.466  32.836  29.579
  169    HZ2  LYS  24           HZ2      LYS  24  16.289  33.373  28.275
  170    HZ3  LYS  24           HZ3      LYS  24  15.110  34.298  28.882
  171    H    HIS  25           H        HIS  25  17.289  26.262  27.596
  172    HA   HIS  25           HA       HIS  25  15.468  24.231  26.329
  173    HB2  HIS  25           HB2      HIS  25  17.669  25.897  25.042
  174    HB3  HIS  25           HB3      HIS  25  16.866  24.542  24.263
  175    HD2  HIS  25           HD2      HIS  25  16.409  28.221  24.811
  176    HE1  HIS  25           HE1      HIS  25  12.723  26.787  23.238
  177    HE2  HIS  25           HE2      HIS  25  14.056  28.873  23.786
  178    H    CYS  26           H        CYS  26  18.168  24.236  28.374
  179    HA   CYS  26           HA       CYS  26  19.906  22.842  28.734
  180    HB2  CYS  26           HB2      CYS  26  17.829  20.979  27.676
  181    HB3  CYS  26           HB3      CYS  26  19.455  20.361  27.798
  182    H    LYS  27           H        LYS  27  19.831  24.183  25.922
  183    HA   LYS  27           HA       LYS  27  22.332  22.849  24.994
  184    HB2  LYS  27           HB2      LYS  27  21.661  23.073  22.664
  185    HB3  LYS  27           HB3      LYS  27  20.545  22.053  23.557
  186    HG2  LYS  27           HG2      LYS  27  19.089  24.225  23.799
  187    HG3  LYS  27           HG3      LYS  27  20.154  24.918  22.583
  188    HD2  LYS  27           HD2      LYS  27  18.154  24.130  21.519
  189    HD3  LYS  27           HD3      LYS  27  19.486  23.078  21.009
  190    HE2  LYS  27           HE2      LYS  27  18.777  21.334  22.558
  191    HE3  LYS  27           HE3      LYS  27  17.600  22.412  23.319
  192    HZ1  LYS  27           HZ1      LYS  27  17.457  21.467  20.506
  193    HZ2  LYS  27           HZ2      LYS  27  16.593  20.865  21.723
  194    HZ3  LYS  27           HZ3      LYS  27  16.332  22.428  21.280
  195    H    CYS  28           H        CYS  28  23.756  24.138  23.810
  196    HA   CYS  28           HA       CYS  28  23.765  26.977  24.602
  197    HB2  CYS  28           HB2      CYS  28  25.651  25.484  22.753
  198    HB3  CYS  28           HB3      CYS  28  25.879  27.095  23.396
  199    H    ILE  29           H        ILE  29  23.727  28.733  23.060
  200    HA   ILE  29           HA       ILE  29  21.297  28.438  21.685
  201    HB   ILE  29           HB       ILE  29  21.970  30.385  22.924
  202   HG12  ILE  29          HG12      ILE  29  21.181  31.105  20.089
  203   HG13  ILE  29          HG13      ILE  29  20.104  30.430  21.315
  204   HG21  ILE  29          HG21      ILE  29  23.452  32.063  22.173
  205   HG22  ILE  29          HG22      ILE  29  24.323  30.542  21.994
  206   HG23  ILE  29          HG23      ILE  29  23.625  31.315  20.563
  207   HD11  ILE  29          HD11      ILE  29  21.503  33.128  21.454
  208   HD12  ILE  29          HD12      ILE  29  19.771  32.816  21.226
  209   HD13  ILE  29          HD13      ILE  29  20.542  32.419  22.770
  210    HA   PRO  30           HA       PRO  30  22.505  27.465  17.451
  211    HB2  PRO  30           HB2      PRO  30  19.875  28.796  16.818
  212    HB3  PRO  30           HB3      PRO  30  20.536  27.247  16.203
  213    HG2  PRO  30           HG2      PRO  30  18.657  27.225  18.145
  214    HG3  PRO  30           HG3      PRO  30  20.089  26.152  18.292
  215    HD2  PRO  30           HD2      PRO  30  19.629  28.853  19.593
  216    HD3  PRO  30           HD3      PRO  30  20.208  27.317  20.320
  217    H    ARG  31           H        ARG  31  23.139  28.523  15.526
  218    HA   ARG  31           HA       ARG  31  23.026  31.501  15.397
  219    HB2  ARG  31           HB2      ARG  31  25.365  31.535  14.622
  220    HB3  ARG  31           HB3      ARG  31  25.187  31.050  16.308
  221    HG2  ARG  31           HG2      ARG  31  25.594  28.694  15.740
  222    HG3  ARG  31           HG3      ARG  31  25.614  29.087  14.015
  223    HD2  ARG  31           HD2      ARG  31  27.542  30.669  14.501
  224    HD3  ARG  31           HD3      ARG  31  27.586  30.016  16.147
  225    HE   ARG  31           HE       ARG  31  27.777  27.756  14.572
  226   HH11  ARG  31          HH11      ARG  31  29.703  30.695  14.759
  227   HH12  ARG  31          HH12      ARG  31  31.048  29.918  13.947
  228   HH21  ARG  31          HH21      ARG  31  29.617  26.861  13.753
  229   HH22  ARG  31          HH22      ARG  31  31.028  27.876  13.447
  Start of MODEL   12
    1    H1   GLY   1           H1       GLY   1  15.651  23.664  40.110
    2    H2   GLY   1           H2       GLY   1  15.040  24.880  41.015
    3    H3   GLY   1           H3       GLY   1  16.247  23.934  41.623
    4    HA2  GLY   1           HA2      GLY   1  17.083  26.100  40.942
    5    HA3  GLY   1           HA3      GLY   1  17.805  24.769  40.014
    6    H    SER   2           H        SER   2  17.633  27.504  39.162
    7    HA   SER   2           HA       SER   2  15.547  27.750  37.123
    8    HB2  SER   2           HB2      SER   2  18.150  29.242  37.585
    9    HB3  SER   2           HB3      SER   2  17.076  29.548  36.208
   10    HG   SER   2           HG       SER   2  16.000  30.755  37.459
   11    H    GLY   3           H        GLY   3  15.469  26.824  35.228
   12    HA2  GLY   3           HA2      GLY   3  15.974  25.609  33.362
   13    HA3  GLY   3           HA3      GLY   3  17.591  26.310  33.451
   14    H    CYS   4           H        CYS   4  18.055  24.252  32.402
   15    HA   CYS   4           HA       CYS   4  17.810  21.746  33.532
   16    HB2  CYS   4           HB2      CYS   4  18.539  22.663  31.186
   17    HB3  CYS   4           HB3      CYS   4  20.179  22.479  31.798
   18    H    MET   5           H        MET   5  20.805  23.736  33.675
   19    HA   MET   5           HA       MET   5  20.949  23.749  36.402
   20    HB2  MET   5           HB2      MET   5  22.579  21.517  35.248
   21    HB3  MET   5           HB3      MET   5  23.519  22.683  36.187
   22    HG2  MET   5           HG2      MET   5  21.625  22.505  37.943
   23    HG3  MET   5           HG3      MET   5  21.218  20.993  37.132
   24    HE1  MET   5           HE1      MET   5  22.095  21.358  40.287
   25    HE2  MET   5           HE2      MET   5  21.539  19.847  39.530
   26    HE3  MET   5           HE3      MET   5  23.055  19.871  40.453
   27    H    LYS   6           H        LYS   6  22.208  25.533  36.990
   28    HA   LYS   6           HA       LYS   6  23.149  27.251  34.850
   29    HB2  LYS   6           HB2      LYS   6  23.662  27.421  37.848
   30    HB3  LYS   6           HB3      LYS   6  23.906  28.717  36.671
   31    HG2  LYS   6           HG2      LYS   6  21.449  28.625  36.114
   32    HG3  LYS   6           HG3      LYS   6  21.226  27.443  37.409
   33    HD2  LYS   6           HD2      LYS   6  22.211  30.304  37.723
   34    HD3  LYS   6           HD3      LYS   6  20.609  29.669  38.148
   35    HE2  LYS   6           HE2      LYS   6  21.647  28.159  39.828
   36    HE3  LYS   6           HE3      LYS   6  23.248  28.802  39.408
   37    HZ1  LYS   6           HZ1      LYS   6  21.009  30.368  40.543
   38    HZ2  LYS   6           HZ2      LYS   6  22.387  29.953  41.331
   39    HZ3  LYS   6           HZ3      LYS   6  22.446  31.010  40.063
   40    H    GLU   7           H        GLU   7  24.825  25.222  37.219
   41    HA   GLU   7           HA       GLU   7  27.507  25.904  36.546
   42    HB2  GLU   7           HB2      GLU   7  26.261  23.345  37.660
   43    HB3  GLU   7           HB3      GLU   7  27.993  23.598  37.510
   44    HG2  GLU   7           HG2      GLU   7  27.384  24.091  39.774
   45    HG3  GLU   7           HG3      GLU   7  27.898  25.568  38.971
   46    H    TYR   8           H        TYR   8  25.361  23.438  35.166
   47    HA   TYR   8           HA       TYR   8  27.274  22.226  33.404
   48    HB2  TYR   8           HB2      TYR   8  25.215  21.120  34.078
   49    HB3  TYR   8           HB3      TYR   8  24.238  22.415  33.415
   50    HD1  TYR   8           HD2      TYR   8  27.097  20.400  31.994
   51    HD2  TYR   8           HD1      TYR   8  22.977  21.627  31.637
   52    HE1  TYR   8           HE2      TYR   8  26.906  19.163  29.831
   53    HE2  TYR   8           HE1      TYR   8  22.794  20.394  29.475
   54    HH   TYR   8           HH       TYR   8  23.808  18.932  28.053
   55    H    CYS   9           H        CYS   9  24.719  24.700  32.811
   56    HA   CYS   9           HA       CYS   9  25.411  25.242  30.121
   57    HB2  CYS   9           HB2      CYS   9  24.126  26.980  32.257
   58    HB3  CYS   9           HB3      CYS   9  24.209  27.416  30.551
   59    H    ALA  10           H        ALA  10  26.638  26.894  33.109
   60    HA   ALA  10           HA       ALA  10  28.365  28.664  31.607
   61    HB1  ALA  10           HB1      ALA  10  29.172  29.309  33.841
   62    HB2  ALA  10           HB2      ALA  10  27.400  29.229  33.811
   63    HB3  ALA  10           HB3      ALA  10  28.336  27.917  34.563
   64    H    GLY  11           H        GLY  11  28.832  25.389  32.853
   65    HA2  GLY  11           HA2      GLY  11  31.712  25.287  32.565
   66    HA3  GLY  11           HA3      GLY  11  30.583  23.923  32.569
   67    H    GLN  12           H        GLN  12  28.999  24.310  30.421
   68    HA   GLN  12           HA       GLN  12  30.698  23.552  28.235
   69    HB2  GLN  12           HB2      GLN  12  27.718  24.137  28.411
   70    HB3  GLN  12           HB3      GLN  12  28.503  23.466  26.982
   71    HG2  GLN  12           HG2      GLN  12  28.569  22.096  29.714
   72    HG3  GLN  12           HG3      GLN  12  27.353  21.791  28.481
   73   HE21  GLN  12          HE22      GLN  12  27.911  20.499  26.620
   74   HE22  GLN  12          HE21      GLN  12  29.538  19.886  26.384
   75    H    CYS  13           H        CYS  13  28.711  26.546  28.718
   76    HA   CYS  13           HA       CYS  13  30.027  27.771  26.331
   77    HB2  CYS  13           HB2      CYS  13  27.064  27.533  26.919
   78    HB3  CYS  13           HB3      CYS  13  27.748  28.415  25.556
   79    H    ARG  14           H        ARG  14  29.735  30.037  26.056
   80    HA   ARG  14           HA       ARG  14  28.639  31.602  28.319
   81    HB2  ARG  14           HB2      ARG  14  31.449  32.130  27.324
   82    HB3  ARG  14           HB3      ARG  14  30.555  33.010  28.577
   83    HG2  ARG  14           HG2      ARG  14  30.523  30.918  29.976
   84    HG3  ARG  14           HG3      ARG  14  31.592  30.165  28.787
   85    HD2  ARG  14           HD2      ARG  14  32.171  32.661  30.434
   86    HD3  ARG  14           HD3      ARG  14  32.839  31.052  30.710
   87    HE   ARG  14           HE       ARG  14  33.692  33.009  28.723
   88   HH11  ARG  14          HH11      ARG  14  33.822  29.560  29.487
   89   HH12  ARG  14          HH12      ARG  14  35.272  29.368  28.544
   90   HH21  ARG  14          HH21      ARG  14  35.117  32.532  27.180
   91   HH22  ARG  14          HH22      ARG  14  35.826  30.946  27.058
   92    H    GLY  15           H        GLY  15  29.062  34.031  27.785
   93    HA2  GLY  15           HA2      GLY  15  28.183  35.725  26.271
   94    HA3  GLY  15           HA3      GLY  15  27.524  34.439  25.250
   95    H    LYS  16           H        LYS  16  26.572  36.648  27.471
   96    HA   LYS  16           HA       LYS  16  25.115  35.368  29.495
   97    HB2  LYS  16           HB2      LYS  16  24.388  37.879  27.912
   98    HB3  LYS  16           HB3      LYS  16  23.598  37.348  29.397
   99    HG2  LYS  16           HG2      LYS  16  25.742  37.569  30.632
  100    HG3  LYS  16           HG3      LYS  16  26.504  38.198  29.174
  101    HD2  LYS  16           HD2      LYS  16  24.883  40.070  29.097
  102    HD3  LYS  16           HD3      LYS  16  24.101  39.446  30.564
  103    HE2  LYS  16           HE2      LYS  16  26.235  39.741  31.808
  104    HE3  LYS  16           HE3      LYS  16  26.985  40.421  30.353
  105    HZ1  LYS  16           HZ1      LYS  16  25.429  42.254  30.440
  106    HZ2  LYS  16           HZ2      LYS  16  24.573  41.578  31.668
  107    HZ3  LYS  16           HZ3      LYS  16  26.089  42.134  31.923
  108    H    VAL  17           H        VAL  17  24.153  35.868  26.133
  109    HA   VAL  17           HA       VAL  17  21.443  34.859  26.582
  110    HB   VAL  17           HB       VAL  17  22.833  35.726  24.032
  111   HG11  VAL  17          HG11      VAL  17  20.888  34.301  23.557
  112   HG12  VAL  17          HG12      VAL  17  19.891  35.251  24.670
  113   HG13  VAL  17          HG13      VAL  17  20.513  35.979  23.169
  114   HG21  VAL  17          HG21      VAL  17  21.519  37.803  24.351
  115   HG22  VAL  17          HG22      VAL  17  20.895  37.180  25.896
  116   HG23  VAL  17          HG23      VAL  17  22.617  37.553  25.710
  117    H    SER  18           H        SER  18  24.458  33.488  25.211
  118    HA   SER  18           HA       SER  18  23.290  31.008  24.376
  119    HB2  SER  18           HB2      SER  18  25.673  31.795  23.900
  120    HB3  SER  18           HB3      SER  18  26.078  31.326  25.558
  121    HG   SER  18           HG       SER  18  26.397  29.711  23.850
  122    H    GLN  19           H        GLN  19  24.732  31.969  27.578
  123    HA   GLN  19           HA       GLN  19  23.859  29.604  28.934
  124    HB2  GLN  19           HB2      GLN  19  24.503  32.429  29.823
  125    HB3  GLN  19           HB3      GLN  19  23.984  31.171  30.973
  126    HG2  GLN  19           HG2      GLN  19  25.853  29.732  30.328
  127    HG3  GLN  19           HG3      GLN  19  26.336  30.858  29.062
  128   HE21  GLN  19          HE22      GLN  19  28.417  30.537  30.291
  129   HE22  GLN  19          HE21      GLN  19  28.744  31.773  31.517
  130    H    ASP  20           H        ASP  20  21.979  32.577  28.170
  131    HA   ASP  20           HA       ASP  20  19.742  31.905  29.853
  132    HB2  ASP  20           HB2      ASP  20  20.311  34.162  28.888
  133    HB3  ASP  20           HB3      ASP  20  19.725  33.594  27.323
  134    H    TYR  21           H        TYR  21  20.333  31.312  26.347
  135    HA   TYR  21           HA       TYR  21  17.913  29.891  25.825
  136    HB2  TYR  21           HB2      TYR  21  19.858  30.777  24.293
  137    HB3  TYR  21           HB3      TYR  21  20.557  29.199  24.534
  138    HD1  TYR  21           HD2      TYR  21  19.210  27.134  23.663
  139    HD2  TYR  21           HD1      TYR  21  18.076  31.224  22.860
  140    HE1  TYR  21           HE2      TYR  21  17.822  26.373  21.730
  141    HE2  TYR  21           HE1      TYR  21  16.662  30.454  20.940
  142    HH   TYR  21           HH       TYR  21  16.376  26.997  20.069
  143    H    CYS  22           H        CYS  22  21.008  28.834  27.208
  144    HA   CYS  22           HA       CYS  22  20.305  26.001  27.297
  145    HB2  CYS  22           HB2      CYS  22  22.605  26.844  27.172
  146    HB3  CYS  22           HB3      CYS  22  22.439  27.614  28.745
  147    H    LEU  23           H        LEU  23  19.913  28.676  29.586
  148    HA   LEU  23           HA       LEU  23  18.748  27.059  31.666
  149    HB2  LEU  23           HB2      LEU  23  19.129  29.914  30.965
  150    HB3  LEU  23           HB3      LEU  23  17.667  29.596  31.883
  151    HG   LEU  23           HG       LEU  23  18.897  28.612  33.715
  152   HD11  LEU  23          HD11      LEU  23  21.380  28.548  33.781
  153   HD12  LEU  23          HD12      LEU  23  20.736  27.434  32.576
  154   HD13  LEU  23          HD13      LEU  23  21.433  28.985  32.067
  155   HD21  LEU  23          HD21      LEU  23  20.310  31.127  32.739
  156   HD22  LEU  23          HD22      LEU  23  18.754  31.082  33.599
  157   HD23  LEU  23          HD23      LEU  23  20.234  30.552  34.422
  158    H    LYS  24           H        LYS  24  17.356  28.336  28.670
  159    HA   LYS  24           HA       LYS  24  14.605  27.598  29.518
  160    HB2  LYS  24           HB2      LYS  24  15.821  28.804  27.011
  161    HB3  LYS  24           HB3      LYS  24  14.104  28.368  27.132
  162    HG2  LYS  24           HG2      LYS  24  13.785  29.881  28.991
  163    HG3  LYS  24           HG3      LYS  24  15.521  30.254  29.049
  164    HD2  LYS  24           HD2      LYS  24  15.456  31.335  26.913
  165    HD3  LYS  24           HD3      LYS  24  13.801  30.779  26.594
  166    HE2  LYS  24           HE2      LYS  24  13.817  33.140  27.220
  167    HE3  LYS  24           HE3      LYS  24  12.936  32.168  28.409
  168    HZ1  LYS  24           HZ1      LYS  24  15.745  33.075  28.739
  169    HZ2  LYS  24           HZ2      LYS  24  14.443  33.789  29.425
  170    HZ3  LYS  24           HZ3      LYS  24  14.826  32.274  29.872
  171    H    HIS  25           H        HIS  25  17.079  26.269  27.444
  172    HA   HIS  25           HA       HIS  25  15.232  24.043  26.578
  173    HB2  HIS  25           HB2      HIS  25  17.280  25.596  24.949
  174    HB3  HIS  25           HB3      HIS  25  16.364  24.221  24.370
  175    HD2  HIS  25           HD2      HIS  25  16.038  27.955  24.959
  176    HE1  HIS  25           HE1      HIS  25  12.324  26.673  23.310
  177    HE2  HIS  25           HE2      HIS  25  13.715  28.699  23.945
  178    H    CYS  26           H        CYS  26  17.946  24.360  28.438
  179    HA   CYS  26           HA       CYS  26  19.668  23.119  29.040
  180    HB2  CYS  26           HB2      CYS  26  17.797  21.344  29.051
  181    HB3  CYS  26           HB3      CYS  26  18.585  20.707  27.608
  182    H    LYS  27           H        LYS  27  19.456  24.222  26.097
  183    HA   LYS  27           HA       LYS  27  21.969  22.998  25.002
  184    HB2  LYS  27           HB2      LYS  27  19.668  24.203  23.474
  185    HB3  LYS  27           HB3      LYS  27  21.081  23.442  22.781
  186    HG2  LYS  27           HG2      LYS  27  20.365  21.271  23.259
  187    HG3  LYS  27           HG3      LYS  27  19.303  21.780  24.570
  188    HD2  LYS  27           HD2      LYS  27  17.850  22.959  22.883
  189    HD3  LYS  27           HD3      LYS  27  18.862  22.286  21.602
  190    HE2  LYS  27           HE2      LYS  27  16.789  21.004  21.888
  191    HE3  LYS  27           HE3      LYS  27  18.200  19.999  22.244
  192    HZ1  LYS  27           HZ1      LYS  27  17.675  19.949  24.469
  193    HZ2  LYS  27           HZ2      LYS  27  16.839  21.349  24.498
  194    HZ3  LYS  27           HZ3      LYS  27  16.170  19.996  23.834
  195    H    CYS  28           H        CYS  28  23.447  24.369  24.140
  196    HA   CYS  28           HA       CYS  28  23.411  27.197  24.878
  197    HB2  CYS  28           HB2      CYS  28  25.315  25.702  23.033
  198    HB3  CYS  28           HB3      CYS  28  25.570  27.285  23.773
  199    H    ILE  29           H        ILE  29  23.441  28.979  23.358
  200    HA   ILE  29           HA       ILE  29  21.201  28.658  21.649
  201    HB   ILE  29           HB       ILE  29  21.730  30.690  22.915
  202   HG12  ILE  29          HG12      ILE  29  21.305  31.285  19.974
  203   HG13  ILE  29          HG13      ILE  29  20.094  30.528  21.013
  204   HG21  ILE  29          HG21      ILE  29  24.180  30.848  22.195
  205   HG22  ILE  29          HG22      ILE  29  23.595  31.510  20.669
  206   HG23  ILE  29          HG23      ILE  29  23.260  32.361  22.191
  207   HD11  ILE  29          HD11      ILE  29  20.132  32.461  22.528
  208   HD12  ILE  29          HD12      ILE  29  21.263  33.293  21.425
  209   HD13  ILE  29          HD13      ILE  29  19.624  32.888  20.880
  210    HA   PRO  30           HA       PRO  30  23.395  27.664  17.825
  211    HB2  PRO  30           HB2      PRO  30  21.318  27.553  16.084
  212    HB3  PRO  30           HB3      PRO  30  21.572  26.307  17.342
  213    HG2  PRO  30           HG2      PRO  30  19.700  28.689  17.478
  214    HG3  PRO  30           HG3      PRO  30  19.339  26.968  17.835
  215    HD2  PRO  30           HD2      PRO  30  19.973  28.749  19.789
  216    HD3  PRO  30           HD3      PRO  30  20.500  27.048  19.881
  217    H    ARG  31           H        ARG  31  24.421  29.011  16.450
  218    HA   ARG  31           HA       ARG  31  23.295  31.705  15.756
  219    HB2  ARG  31           HB2      ARG  31  26.188  31.041  16.415
  220    HB3  ARG  31           HB3      ARG  31  25.575  32.627  15.979
  221    HG2  ARG  31           HG2      ARG  31  24.783  31.139  18.531
  222    HG3  ARG  31           HG3      ARG  31  26.123  32.255  18.400
  223    HD2  ARG  31           HD2      ARG  31  24.317  33.404  19.403
  224    HD3  ARG  31           HD3      ARG  31  24.586  34.100  17.800
  225    HE   ARG  31           HE       ARG  31  22.569  32.096  17.604
  226   HH11  ARG  31          HH11      ARG  31  22.740  35.121  19.394
  227   HH12  ARG  31          HH12      ARG  31  21.123  35.577  18.912
  228   HH21  ARG  31          HH21      ARG  31  20.560  32.696  17.076
  229   HH22  ARG  31          HH22      ARG  31  19.920  34.233  17.598
  Start of MODEL   13
    1    H1   GLY   1           H1       GLY   1  13.452  23.697  40.289
    2    H2   GLY   1           H2       GLY   1  13.348  25.335  40.136
    3    H3   GLY   1           H3       GLY   1  14.762  24.647  40.611
    4    HA2  GLY   1           HA2      GLY   1  14.958  23.510  38.476
    5    HA3  GLY   1           HA3      GLY   1  13.495  24.377  37.966
    6    H    SER   2           H        SER   2  16.933  24.541  38.359
    7    HA   SER   2           HA       SER   2  17.112  27.466  38.291
    8    HB2  SER   2           HB2      SER   2  19.534  27.039  38.241
    9    HB3  SER   2           HB3      SER   2  18.741  26.163  39.556
   10    HG   SER   2           HG       SER   2  20.192  24.816  38.426
   11    H    GLY   3           H        GLY   3  17.402  24.797  36.031
   12    HA2  GLY   3           HA2      GLY   3  17.006  24.893  33.676
   13    HA3  GLY   3           HA3      GLY   3  17.318  26.613  33.686
   14    H    CYS   4           H        CYS   4  20.316  24.588  32.356
   15    HA   CYS   4           HA       CYS   4  17.815  23.113  32.880
   16    HB2  CYS   4           HB2      CYS   4  19.336  22.957  30.837
   17    HB3  CYS   4           HB3      CYS   4  20.482  22.092  31.851
   18    H    MET   5           H        MET   5  21.306  22.640  33.647
   19    HA   MET   5           HA       MET   5  20.582  23.490  36.342
   20    HB2  MET   5           HB2      MET   5  22.889  21.583  35.775
   21    HB3  MET   5           HB3      MET   5  22.494  22.316  37.334
   22    HG2  MET   5           HG2      MET   5  20.748  20.349  35.809
   23    HG3  MET   5           HG3      MET   5  21.804  19.942  37.138
   24    HE1  MET   5           HE1      MET   5  21.440  21.987  39.412
   25    HE2  MET   5           HE2      MET   5  20.028  21.350  40.278
   26    HE3  MET   5           HE3      MET   5  21.262  20.235  39.655
   27    H    LYS   6           H        LYS   6  21.785  25.205  37.022
   28    HA   LYS   6           HA       LYS   6  22.602  26.949  34.985
   29    HB2  LYS   6           HB2      LYS   6  21.660  27.273  37.410
   30    HB3  LYS   6           HB3      LYS   6  23.329  27.319  37.921
   31    HG2  LYS   6           HG2      LYS   6  21.942  29.181  35.937
   32    HG3  LYS   6           HG3      LYS   6  22.255  29.517  37.627
   33    HD2  LYS   6           HD2      LYS   6  24.317  29.360  35.408
   34    HD3  LYS   6           HD3      LYS   6  23.783  30.774  36.315
   35    HE2  LYS   6           HE2      LYS   6  24.634  29.574  38.434
   36    HE3  LYS   6           HE3      LYS   6  25.407  28.420  37.336
   37    HZ1  LYS   6           HZ1      LYS   6  26.032  31.274  37.712
   38    HZ2  LYS   6           HZ2      LYS   6  27.038  29.960  37.689
   39    HZ3  LYS   6           HZ3      LYS   6  26.417  30.554  36.290
   40    H    GLU   7           H        GLU   7  24.621  25.119  37.270
   41    HA   GLU   7           HA       GLU   7  27.114  26.350  36.448
   42    HB2  GLU   7           HB2      GLU   7  26.915  23.672  37.851
   43    HB3  GLU   7           HB3      GLU   7  28.182  24.871  37.900
   44    HG2  GLU   7           HG2      GLU   7  27.262  25.200  39.956
   45    HG3  GLU   7           HG3      GLU   7  26.385  26.417  39.043
   46    H    TYR   8           H        TYR   8  25.421  23.340  35.493
   47    HA   TYR   8           HA       TYR   8  27.400  22.362  33.668
   48    HB2  TYR   8           HB2      TYR   8  25.346  21.158  34.534
   49    HB3  TYR   8           HB3      TYR   8  24.368  22.114  33.445
   50    HD1  TYR   8           HD1      TYR   8  27.253  19.751  33.556
   51    HD2  TYR   8           HD2      TYR   8  23.999  21.315  31.211
   52    HE1  TYR   8           HE1      TYR   8  27.627  17.970  31.846
   53    HE2  TYR   8           HE2      TYR   8  24.386  19.557  29.493
   54    HH   TYR   8           HH       TYR   8  25.591  17.666  28.917
   55    H    CYS   9           H        CYS   9  24.608  24.592  33.165
   56    HA   CYS   9           HA       CYS   9  25.092  25.029  30.402
   57    HB2  CYS   9           HB2      CYS   9  23.646  26.567  32.559
   58    HB3  CYS   9           HB3      CYS   9  23.821  27.239  30.941
   59    H    ALA  10           H        ALA  10  26.630  26.664  33.204
   60    HA   ALA  10           HA       ALA  10  28.092  28.536  31.543
   61    HB1  ALA  10           HB1      ALA  10  28.621  27.547  34.375
   62    HB2  ALA  10           HB2      ALA  10  29.322  28.991  33.613
   63    HB3  ALA  10           HB3      ALA  10  27.578  28.915  33.926
   64    H    GLY  11           H        GLY  11  28.675  25.177  32.409
   65    HA2  GLY  11           HA2      GLY  11  31.445  25.087  31.435
   66    HA3  GLY  11           HA3      GLY  11  30.390  23.727  31.830
   67    H    GLN  12           H        GLN  12  28.208  24.573  30.073
   68    HA   GLN  12           HA       GLN  12  29.191  23.548  27.501
   69    HB2  GLN  12           HB2      GLN  12  26.463  24.298  28.646
   70    HB3  GLN  12           HB3      GLN  12  26.663  23.774  26.977
   71    HG2  GLN  12           HG2      GLN  12  27.540  22.134  29.376
   72    HG3  GLN  12           HG3      GLN  12  25.992  21.944  28.546
   73   HE21  GLN  12          HE22      GLN  12  29.172  20.737  28.604
   74   HE22  GLN  12          HE21      GLN  12  29.290  20.241  26.912
   75    H    CYS  13           H        CYS  13  28.179  26.683  28.716
   76    HA   CYS  13           HA       CYS  13  28.446  27.909  26.012
   77    HB2  CYS  13           HB2      CYS  13  26.098  26.875  26.884
   78    HB3  CYS  13           HB3      CYS  13  26.007  28.434  27.686
   79    H    ARG  14           H        ARG  14  28.786  30.181  25.994
   80    HA   ARG  14           HA       ARG  14  28.648  31.698  28.526
   81    HB2  ARG  14           HB2      ARG  14  30.927  32.500  28.410
   82    HB3  ARG  14           HB3      ARG  14  30.831  30.757  28.653
   83    HG2  ARG  14           HG2      ARG  14  31.381  30.366  26.260
   84    HG3  ARG  14           HG3      ARG  14  31.418  32.111  25.980
   85    HD2  ARG  14           HD2      ARG  14  33.674  31.178  26.189
   86    HD3  ARG  14           HD3      ARG  14  33.338  32.375  27.433
   87    HE   ARG  14           HE       ARG  14  33.202  29.401  27.873
   88   HH11  ARG  14          HH11      ARG  14  34.135  32.552  29.176
   89   HH12  ARG  14          HH12      ARG  14  34.706  31.829  30.666
   90   HH21  ARG  14          HH21      ARG  14  33.938  28.617  29.786
   91   HH22  ARG  14          HH22      ARG  14  34.810  29.653  30.902
   92    H    GLY  15           H        GLY  15  29.142  33.981  28.334
   93    HA2  GLY  15           HA2      GLY  15  28.244  35.973  27.397
   94    HA3  GLY  15           HA3      GLY  15  27.622  35.068  26.012
   95    H    LYS  16           H        LYS  16  26.357  36.749  28.262
   96    HA   LYS  16           HA       LYS  16  24.911  34.993  30.025
   97    HB2  LYS  16           HB2      LYS  16  25.535  37.387  30.428
   98    HB3  LYS  16           HB3      LYS  16  24.275  37.876  29.287
   99    HG2  LYS  16           HG2      LYS  16  22.532  36.942  30.712
  100    HG3  LYS  16           HG3      LYS  16  23.733  36.149  31.736
  101    HD2  LYS  16           HD2      LYS  16  22.895  38.069  32.896
  102    HD3  LYS  16           HD3      LYS  16  24.584  38.358  32.469
  103    HE2  LYS  16           HE2      LYS  16  23.894  39.774  30.568
  104    HE3  LYS  16           HE3      LYS  16  22.191  39.410  30.899
  105    HZ1  LYS  16           HZ1      LYS  16  24.019  40.860  32.727
  106    HZ2  LYS  16           HZ2      LYS  16  22.763  41.512  31.851
  107    HZ3  LYS  16           HZ3      LYS  16  22.458  40.455  33.068
  108    H    VAL  17           H        VAL  17  24.143  36.205  26.821
  109    HA   VAL  17           HA       VAL  17  21.322  35.411  26.859
  110    HB   VAL  17           HB       VAL  17  23.100  35.997  24.471
  111   HG11  VAL  17          HG11      VAL  17  20.960  36.565  23.359
  112   HG12  VAL  17          HG12      VAL  17  21.031  34.865  23.804
  113   HG13  VAL  17          HG13      VAL  17  20.069  35.997  24.783
  114   HG21  VAL  17          HG21      VAL  17  23.074  37.944  25.976
  115   HG22  VAL  17          HG22      VAL  17  22.085  38.256  24.552
  116   HG23  VAL  17          HG23      VAL  17  21.301  37.848  26.091
  117    H    SER  18           H        SER  18  24.415  34.016  25.670
  118    HA   SER  18           HA       SER  18  23.404  31.644  24.546
  119    HB2  SER  18           HB2      SER  18  26.030  31.637  25.985
  120    HB3  SER  18           HB3      SER  18  25.617  31.091  24.357
  121    HG   SER  18           HG       SER  18  26.971  33.047  24.774
  122    H    GLN  19           H        GLN  19  24.706  32.262  27.892
  123    HA   GLN  19           HA       GLN  19  23.862  29.724  28.933
  124    HB2  GLN  19           HB2      GLN  19  24.449  32.398  30.243
  125    HB3  GLN  19           HB3      GLN  19  24.028  30.939  31.164
  126    HG2  GLN  19           HG2      GLN  19  25.925  29.713  30.234
  127    HG3  GLN  19           HG3      GLN  19  26.323  31.056  29.162
  128   HE21  GLN  19          HE22      GLN  19  28.462  30.529  30.343
  129   HE22  GLN  19          HE21      GLN  19  28.764  31.667  31.665
  130    H    ASP  20           H        ASP  20  22.040  32.849  28.767
  131    HA   ASP  20           HA       ASP  20  19.726  31.988  30.157
  132    HB2  ASP  20           HB2      ASP  20  20.009  34.277  29.658
  133    HB3  ASP  20           HB3      ASP  20  20.212  33.962  27.936
  134    H    TYR  21           H        TYR  21  20.532  31.624  26.651
  135    HA   TYR  21           HA       TYR  21  18.179  30.181  25.936
  136    HB2  TYR  21           HB2      TYR  21  19.963  31.097  24.378
  137    HB3  TYR  21           HB3      TYR  21  20.966  29.730  24.818
  138    HD1  TYR  21           HD1      TYR  21  20.390  27.434  24.078
  139    HD2  TYR  21           HD2      TYR  21  17.938  30.808  22.995
  140    HE1  TYR  21           HE1      TYR  21  19.153  26.022  22.442
  141    HE2  TYR  21           HE2      TYR  21  16.734  29.403  21.333
  142    HH   TYR  21           HH       TYR  21  16.497  27.318  20.416
  143    H    CYS  22           H        CYS  22  21.265  28.962  27.366
  144    HA   CYS  22           HA       CYS  22  20.449  26.174  27.223
  145    HB2  CYS  22           HB2      CYS  22  22.777  26.923  27.304
  146    HB3  CYS  22           HB3      CYS  22  22.547  27.565  28.928
  147    H    LEU  23           H        LEU  23  20.076  28.703  29.689
  148    HA   LEU  23           HA       LEU  23  18.817  27.052  31.682
  149    HB2  LEU  23           HB2      LEU  23  19.243  29.946  31.073
  150    HB3  LEU  23           HB3      LEU  23  17.872  29.538  32.105
  151    HG   LEU  23           HG       LEU  23  19.267  28.516  33.750
  152   HD11  LEU  23          HD11      LEU  23  21.688  28.492  33.688
  153   HD12  LEU  23          HD12      LEU  23  21.091  27.589  32.307
  154   HD13  LEU  23          HD13      LEU  23  21.713  29.243  32.077
  155   HD21  LEU  23          HD21      LEU  23  20.502  30.486  34.504
  156   HD22  LEU  23          HD22      LEU  23  20.414  31.189  32.871
  157   HD23  LEU  23          HD23      LEU  23  18.930  30.938  33.823
  158    H    LYS  24           H        LYS  24  17.635  28.228  28.670
  159    HA   LYS  24           HA       LYS  24  14.772  27.721  29.371
  160    HB2  LYS  24           HB2      LYS  24  16.210  29.041  27.047
  161    HB3  LYS  24           HB3      LYS  24  14.495  28.598  26.958
  162    HG2  LYS  24           HG2      LYS  24  13.891  30.021  28.695
  163    HG3  LYS  24           HG3      LYS  24  15.558  30.217  29.271
  164    HD2  LYS  24           HD2      LYS  24  16.142  31.556  27.328
  165    HD3  LYS  24           HD3      LYS  24  14.503  31.353  26.654
  166    HE2  LYS  24           HE2      LYS  24  13.496  32.519  28.490
  167    HE3  LYS  24           HE3      LYS  24  14.966  32.441  29.461
  168    HZ1  LYS  24           HZ1      LYS  24  16.013  34.012  28.039
  169    HZ2  LYS  24           HZ2      LYS  24  14.770  34.000  26.957
  170    HZ3  LYS  24           HZ3      LYS  24  14.529  34.628  28.450
  171    H    HIS  25           H        HIS  25  17.387  26.408  27.477
  172    HA   HIS  25           HA       HIS  25  15.562  24.322  26.304
  173    HB2  HIS  25           HB2      HIS  25  17.779  25.959  25.035
  174    HB3  HIS  25           HB3      HIS  25  16.935  24.653  24.236
  175    HD2  HIS  25           HD2      HIS  25  16.601  28.326  24.932
  176    HE1  HIS  25           HE1      HIS  25  12.921  27.145  23.154
  177    HE2  HIS  25           HE2      HIS  25  14.385  29.131  23.777
  178    H    CYS  26           H        CYS  26  18.268  24.345  28.316
  179    HA   CYS  26           HA       CYS  26  19.783  22.807  28.882
  180    HB2  CYS  26           HB2      CYS  26  17.949  20.834  27.509
  181    HB3  CYS  26           HB3      CYS  26  19.244  20.416  28.619
  182    H    LYS  27           H        LYS  27  20.014  23.969  26.007
  183    HA   LYS  27           HA       LYS  27  22.607  22.616  25.618
  184    HB2  LYS  27           HB2      LYS  27  22.346  22.478  23.201
  185    HB3  LYS  27           HB3      LYS  27  21.149  21.488  24.021
  186    HG2  LYS  27           HG2      LYS  27  19.436  23.313  23.631
  187    HG3  LYS  27           HG3      LYS  27  20.677  24.231  22.756
  188    HD2  LYS  27           HD2      LYS  27  20.941  22.303  21.189
  189    HD3  LYS  27           HD3      LYS  27  19.614  21.479  22.032
  190    HE2  LYS  27           HE2      LYS  27  18.064  23.291  21.433
  191    HE3  LYS  27           HE3      LYS  27  19.379  24.202  20.667
  192    HZ1  LYS  27           HZ1      LYS  27  18.389  21.549  19.799
  193    HZ2  LYS  27           HZ2      LYS  27  18.093  22.966  19.013
  194    HZ3  LYS  27           HZ3      LYS  27  19.616  22.385  19.073
  195    H    CYS  28           H        CYS  28  24.110  23.870  24.348
  196    HA   CYS  28           HA       CYS  28  23.899  26.721  24.810
  197    HB2  CYS  28           HB2      CYS  28  26.037  25.311  24.671
  198    HB3  CYS  28           HB3      CYS  28  25.829  25.395  22.917
  199    H    ILE  29           H        ILE  29  24.020  28.354  23.179
  200    HA   ILE  29           HA       ILE  29  21.579  28.250  21.795
  201    HB   ILE  29           HB       ILE  29  22.380  30.169  22.969
  202   HG12  ILE  29          HG12      ILE  29  21.917  30.889  20.059
  203   HG13  ILE  29          HG13      ILE  29  20.650  30.337  21.166
  204   HG21  ILE  29          HG21      ILE  29  24.098  31.675  22.134
  205   HG22  ILE  29          HG22      ILE  29  24.790  30.062  22.341
  206   HG23  ILE  29          HG23      ILE  29  24.362  30.641  20.719
  207   HD11  ILE  29          HD11      ILE  29  20.597  32.754  21.028
  208   HD12  ILE  29          HD12      ILE  29  21.112  32.281  22.656
  209   HD13  ILE  29          HD13      ILE  29  22.304  32.883  21.482
  210    HA   PRO  30           HA       PRO  30  22.834  26.799  17.786
  211    HB2  PRO  30           HB2      PRO  30  20.307  28.127  16.831
  212    HB3  PRO  30           HB3      PRO  30  20.916  26.477  16.482
  213    HG2  PRO  30           HG2      PRO  30  18.957  26.853  18.317
  214    HG3  PRO  30           HG3      PRO  30  20.315  25.729  18.678
  215    HD2  PRO  30           HD2      PRO  30  19.965  28.604  19.585
  216    HD3  PRO  30           HD3      PRO  30  20.458  27.150  20.511
  217    H    ARG  31           H        ARG  31  24.162  27.539  16.343
  218    HA   ARG  31           HA       ARG  31  24.179  30.306  15.256
  219    HB2  ARG  31           HB2      ARG  31  26.514  30.583  15.985
  220    HB3  ARG  31           HB3      ARG  31  25.374  30.473  17.320
  221    HG2  ARG  31           HG2      ARG  31  26.016  28.015  17.585
  222    HG3  ARG  31           HG3      ARG  31  27.280  28.287  16.381
  223    HD2  ARG  31           HD2      ARG  31  26.937  29.782  19.021
  224    HD3  ARG  31           HD3      ARG  31  28.059  28.444  18.769
  225    HE   ARG  31           HE       ARG  31  28.356  31.223  17.890
  226   HH11  ARG  31          HH11      ARG  31  29.464  27.951  17.175
  227   HH12  ARG  31          HH12      ARG  31  30.782  28.553  16.197
  228   HH21  ARG  31          HH21      ARG  31  30.283  31.854  17.050
  229   HH22  ARG  31          HH22      ARG  31  31.338  30.661  16.292
  Start of MODEL   14
    1    H1   GLY   1           H1       GLY   1   9.731  25.886  26.007
    2    H2   GLY   1           H2       GLY   1  10.746  27.037  26.607
    3    H3   GLY   1           H3       GLY   1   9.441  26.546  27.490
    4    HA2  GLY   1           HA2      GLY   1  10.371  24.308  27.634
    5    HA3  GLY   1           HA3      GLY   1  11.811  24.941  26.807
    6    H    SER   2           H        SER   2  11.975  23.744  29.342
    7    HA   SER   2           HA       SER   2  12.512  26.056  31.149
    8    HB2  SER   2           HB2      SER   2  12.142  24.712  33.042
    9    HB3  SER   2           HB3      SER   2  10.752  24.504  31.973
   10    HG   SER   2           HG       SER   2  11.900  22.615  33.044
   11    H    GLY   3           H        GLY   3  14.293  25.944  32.573
   12    HA2  GLY   3           HA2      GLY   3  16.726  25.226  31.161
   13    HA3  GLY   3           HA3      GLY   3  16.593  26.078  32.702
   14    H    CYS   4           H        CYS   4  18.517  24.174  32.067
   15    HA   CYS   4           HA       CYS   4  17.867  21.755  33.650
   16    HB2  CYS   4           HB2      CYS   4  19.785  22.466  31.495
   17    HB3  CYS   4           HB3      CYS   4  20.404  21.377  32.724
   18    H    MET   5           H        MET   5  21.079  23.286  33.672
   19    HA   MET   5           HA       MET   5  20.667  24.388  36.367
   20    HB2  MET   5           HB2      MET   5  22.718  22.203  35.799
   21    HB3  MET   5           HB3      MET   5  22.823  23.324  37.166
   22    HG2  MET   5           HG2      MET   5  20.534  22.553  37.885
   23    HG3  MET   5           HG3      MET   5  20.638  21.282  36.683
   24    HE1  MET   5           HE1      MET   5  22.373  19.269  36.764
   25    HE2  MET   5           HE2      MET   5  23.770  20.374  36.870
   26    HE3  MET   5           HE3      MET   5  23.589  19.056  38.041
   27    H    LYS   6           H        LYS   6  21.945  26.085  36.779
   28    HA   LYS   6           HA       LYS   6  23.222  27.624  34.724
   29    HB2  LYS   6           HB2      LYS   6  23.425  27.647  37.756
   30    HB3  LYS   6           HB3      LYS   6  24.115  28.897  36.726
   31    HG2  LYS   6           HG2      LYS   6  22.001  29.673  36.004
   32    HG3  LYS   6           HG3      LYS   6  21.140  28.254  36.606
   33    HD2  LYS   6           HD2      LYS   6  22.605  30.180  38.459
   34    HD3  LYS   6           HD3      LYS   6  20.916  30.386  37.986
   35    HE2  LYS   6           HE2      LYS   6  20.379  28.116  38.852
   36    HE3  LYS   6           HE3      LYS   6  22.048  27.947  39.408
   37    HZ1  LYS   6           HZ1      LYS   6  21.682  29.887  40.844
   38    HZ2  LYS   6           HZ2      LYS   6  20.104  29.985  40.364
   39    HZ3  LYS   6           HZ3      LYS   6  20.619  28.679  41.191
   40    H    GLU   7           H        GLU   7  24.643  25.506  37.266
   41    HA   GLU   7           HA       GLU   7  27.354  25.880  36.614
   42    HB2  GLU   7           HB2      GLU   7  25.914  23.370  37.621
   43    HB3  GLU   7           HB3      GLU   7  27.652  23.556  37.561
   44    HG2  GLU   7           HG2      GLU   7  27.434  24.241  39.692
   45    HG3  GLU   7           HG3      GLU   7  27.068  25.809  38.970
   46    H    TYR   8           H        TYR   8  25.142  23.470  35.166
   47    HA   TYR   8           HA       TYR   8  27.123  22.294  33.401
   48    HB2  TYR   8           HB2      TYR   8  25.094  21.130  34.125
   49    HB3  TYR   8           HB3      TYR   8  24.078  22.359  33.413
   50    HD1  TYR   8           HD1      TYR   8  26.758  19.893  32.427
   51    HD2  TYR   8           HD2      TYR   8  23.178  22.008  31.275
   52    HE1  TYR   8           HE1      TYR   8  26.587  18.493  30.370
   53    HE2  TYR   8           HE2      TYR   8  23.014  20.609  29.235
   54    HH   TYR   8           HH       TYR   8  23.933  18.903  28.004
   55    H    CYS   9           H        CYS   9  24.543  24.734  32.989
   56    HA   CYS   9           HA       CYS   9  25.006  25.255  30.241
   57    HB2  CYS   9           HB2      CYS   9  23.709  26.852  32.476
   58    HB3  CYS   9           HB3      CYS   9  23.686  27.360  30.792
   59    H    ALA  10           H        ALA  10  26.559  26.791  33.104
   60    HA   ALA  10           HA       ALA  10  27.880  28.791  31.470
   61    HB1  ALA  10           HB1      ALA  10  28.315  27.918  34.355
   62    HB2  ALA  10           HB2      ALA  10  28.960  29.392  33.604
   63    HB3  ALA  10           HB3      ALA  10  27.210  29.196  33.804
   64    H    GLY  11           H        GLY  11  28.636  25.491  32.136
   65    HA2  GLY  11           HA2      GLY  11  31.481  25.724  31.306
   66    HA3  GLY  11           HA3      GLY  11  30.583  24.247  31.675
   67    H    GLN  12           H        GLN  12  28.397  24.332  30.046
   68    HA   GLN  12           HA       GLN  12  29.492  23.636  27.472
   69    HB2  GLN  12           HB2      GLN  12  26.661  23.941  28.556
   70    HB3  GLN  12           HB3      GLN  12  26.997  23.358  26.927
   71    HG2  GLN  12           HG2      GLN  12  28.123  22.043  29.430
   72    HG3  GLN  12           HG3      GLN  12  26.606  21.565  28.666
   73   HE21  GLN  12          HE22      GLN  12  29.931  20.753  28.705
   74   HE22  GLN  12          HE21      GLN  12  30.036  20.208  27.027
   75    H    CYS  13           H        CYS  13  28.001  26.614  28.616
   76    HA   CYS  13           HA       CYS  13  28.303  27.810  25.896
   77    HB2  CYS  13           HB2      CYS  13  25.958  26.776  26.684
   78    HB3  CYS  13           HB3      CYS  13  25.829  28.322  27.509
   79    H    ARG  14           H        ARG  14  28.637  30.030  25.803
   80    HA   ARG  14           HA       ARG  14  29.263  31.412  28.412
   81    HB2  ARG  14           HB2      ARG  14  30.932  31.294  25.895
   82    HB3  ARG  14           HB3      ARG  14  31.326  32.177  27.368
   83    HG2  ARG  14           HG2      ARG  14  31.205  29.139  27.060
   84    HG3  ARG  14           HG3      ARG  14  32.659  30.122  27.159
   85    HD2  ARG  14           HD2      ARG  14  30.612  29.775  29.389
   86    HD3  ARG  14           HD3      ARG  14  32.189  28.990  29.286
   87    HE   ARG  14           HE       ARG  14  32.780  31.706  29.110
   88   HH11  ARG  14          HH12      ARG  14  31.201  29.763  31.624
   89   HH12  ARG  14          HH11      ARG  14  31.696  30.959  32.827
   90   HH21  ARG  14          HH21      ARG  14  33.392  32.958  30.728
   91   HH22  ARG  14          HH22      ARG  14  32.921  32.559  32.392
   92    H    GLY  15           H        GLY  15  29.232  33.588  28.521
   93    HA2  GLY  15           HA2      GLY  15  28.583  35.767  27.877
   94    HA3  GLY  15           HA3      GLY  15  27.984  35.178  26.323
   95    H    LYS  16           H        LYS  16  26.594  36.829  28.304
   96    HA   LYS  16           HA       LYS  16  25.056  35.383  30.176
   97    HB2  LYS  16           HB2      LYS  16  25.581  37.866  30.080
   98    HB3  LYS  16           HB3      LYS  16  24.295  38.040  28.887
   99    HG2  LYS  16           HG2      LYS  16  22.646  37.216  30.571
  100    HG3  LYS  16           HG3      LYS  16  23.966  37.006  31.738
  101    HD2  LYS  16           HD2      LYS  16  24.479  39.508  31.373
  102    HD3  LYS  16           HD3      LYS  16  22.931  39.619  30.541
  103    HE2  LYS  16           HE2      LYS  16  23.334  38.656  33.415
  104    HE3  LYS  16           HE3      LYS  16  22.945  40.319  32.973
  105    HZ1  LYS  16           HZ1      LYS  16  20.955  39.072  33.603
  106    HZ2  LYS  16           HZ2      LYS  16  20.847  39.535  32.040
  107    HZ3  LYS  16           HZ3      LYS  16  21.216  37.966  32.447
  108    H    VAL  17           H        VAL  17  24.222  36.247  26.854
  109    HA   VAL  17           HA       VAL  17  21.465  35.346  27.001
  110    HB   VAL  17           HB       VAL  17  22.229  37.108  25.484
  111   HG11  VAL  17          HG11      VAL  17  23.340  36.661  23.389
  112   HG12  VAL  17          HG12      VAL  17  24.391  36.114  24.699
  113   HG13  VAL  17          HG13      VAL  17  23.472  34.935  23.742
  114   HG21  VAL  17          HG21      VAL  17  20.118  35.847  25.054
  115   HG22  VAL  17          HG22      VAL  17  20.876  36.460  23.571
  116   HG23  VAL  17          HG23      VAL  17  21.008  34.750  23.981
  117    H    SER  18           H        SER  18  24.504  33.897  25.893
  118    HA   SER  18           HA       SER  18  23.447  31.602  24.653
  119    HB2  SER  18           HB2      SER  18  26.163  31.658  25.934
  120    HB3  SER  18           HB3      SER  18  25.689  31.127  24.316
  121    HG   SER  18           HG       SER  18  26.918  33.123  24.530
  122    H    GLN  19           H        GLN  19  24.950  32.124  27.883
  123    HA   GLN  19           HA       GLN  19  24.173  29.665  29.111
  124    HB2  GLN  19           HB2      GLN  19  24.436  32.505  30.182
  125    HB3  GLN  19           HB3      GLN  19  24.229  31.077  31.216
  126    HG2  GLN  19           HG2      GLN  19  26.270  30.083  30.424
  127    HG3  GLN  19           HG3      GLN  19  26.493  31.303  29.176
  128   HE21  GLN  19          HE22      GLN  19  28.544  30.762  30.825
  129   HE22  GLN  19          HE21      GLN  19  28.775  32.118  31.944
  130    H    ASP  20           H        ASP  20  22.244  32.674  28.682
  131    HA   ASP  20           HA       ASP  20  19.962  31.814  30.147
  132    HB2  ASP  20           HB2      ASP  20  20.472  34.135  29.645
  133    HB3  ASP  20           HB3      ASP  20  20.249  33.850  27.921
  134    H    TYR  21           H        TYR  21  20.760  31.412  26.665
  135    HA   TYR  21           HA       TYR  21  18.359  30.126  25.845
  136    HB2  TYR  21           HB2      TYR  21  20.416  30.812  24.448
  137    HB3  TYR  21           HB3      TYR  21  21.141  29.290  24.932
  138    HD1  TYR  21           HD1      TYR  21  18.468  30.951  23.065
  139    HD2  TYR  21           HD2      TYR  21  20.261  27.095  23.906
  140    HE1  TYR  21           HE1      TYR  21  17.064  29.904  21.310
  141    HE2  TYR  21           HE2      TYR  21  18.867  26.089  22.117
  142    HH   TYR  21           HH       TYR  21  16.488  27.988  20.244
  143    H    CYS  22           H        CYS  22  21.277  28.685  27.359
  144    HA   CYS  22           HA       CYS  22  20.280  25.976  27.320
  145    HB2  CYS  22           HB2      CYS  22  22.634  26.574  27.432
  146    HB3  CYS  22           HB3      CYS  22  22.407  27.355  28.985
  147    H    LEU  23           H        LEU  23  19.854  28.623  29.577
  148    HA   LEU  23           HA       LEU  23  18.407  27.133  31.598
  149    HB2  LEU  23           HB2      LEU  23  19.223  29.906  30.962
  150    HB3  LEU  23           HB3      LEU  23  17.691  29.767  31.798
  151    HG   LEU  23           HG       LEU  23  18.684  28.617  33.670
  152   HD11  LEU  23          HD11      LEU  23  21.139  28.337  33.869
  153   HD12  LEU  23          HD12      LEU  23  20.462  27.302  32.611
  154   HD13  LEU  23          HD13      LEU  23  21.329  28.792  32.161
  155   HD21  LEU  23          HD21      LEU  23  20.108  30.459  34.476
  156   HD22  LEU  23          HD22      LEU  23  20.345  31.022  32.803
  157   HD23  LEU  23          HD23      LEU  23  18.735  31.093  33.552
  158    H    LYS  24           H        LYS  24  17.440  27.780  28.450
  159    HA   LYS  24           HA       LYS  24  14.594  27.207  29.266
  160    HB2  LYS  24           HB2      LYS  24  15.535  28.764  26.823
  161    HB3  LYS  24           HB3      LYS  24  13.855  28.324  27.209
  162    HG2  LYS  24           HG2      LYS  24  14.212  29.538  29.439
  163    HG3  LYS  24           HG3      LYS  24  15.708  30.173  28.722
  164    HD2  LYS  24           HD2      LYS  24  14.499  31.402  27.051
  165    HD3  LYS  24           HD3      LYS  24  12.992  30.551  27.452
  166    HE2  LYS  24           HE2      LYS  24  13.196  31.490  29.817
  167    HE3  LYS  24           HE3      LYS  24  14.543  32.481  29.241
  168    HZ1  LYS  24           HZ1      LYS  24  13.004  33.485  27.641
  169    HZ2  LYS  24           HZ2      LYS  24  11.763  32.574  28.214
  170    HZ3  LYS  24           HZ3      LYS  24  12.486  33.705  29.192
  171    H    HIS  25           H        HIS  25  17.288  26.084  27.566
  172    HA   HIS  25           HA       HIS  25  15.640  23.977  26.168
  173    HB2  HIS  25           HB2      HIS  25  17.925  25.655  25.065
  174    HB3  HIS  25           HB3      HIS  25  17.198  24.288  24.241
  175    HD2  HIS  25           HD2      HIS  25  16.623  27.972  24.877
  176    HE1  HIS  25           HE1      HIS  25  13.705  26.642  22.085
  177    HE2  HIS  25           HE2      HIS  25  14.765  28.691  23.160
  178    H    CYS  26           H        CYS  26  18.132  24.185  28.451
  179    HA   CYS  26           HA       CYS  26  19.751  22.855  29.161
  180    HB2  CYS  26           HB2      CYS  26  17.709  21.266  28.987
  181    HB3  CYS  26           HB3      CYS  26  18.578  20.537  27.643
  182    H    LYS  27           H        LYS  27  19.912  23.851  26.131
  183    HA   LYS  27           HA       LYS  27  22.535  22.543  25.532
  184    HB2  LYS  27           HB2      LYS  27  22.030  22.527  23.188
  185    HB3  LYS  27           HB3      LYS  27  20.796  21.603  24.040
  186    HG2  LYS  27           HG2      LYS  27  19.245  23.521  23.854
  187    HG3  LYS  27           HG3      LYS  27  20.479  24.475  23.048
  188    HD2  LYS  27           HD2      LYS  27  19.147  21.973  22.003
  189    HD3  LYS  27           HD3      LYS  27  18.905  23.618  21.439
  190    HE2  LYS  27           HE2      LYS  27  21.543  22.077  21.226
  191    HE3  LYS  27           HE3      LYS  27  20.331  22.165  19.947
  192    HZ1  LYS  27           HZ1      LYS  27  22.064  23.797  19.579
  193    HZ2  LYS  27           HZ2      LYS  27  20.625  24.544  19.865
  194    HZ3  LYS  27           HZ3      LYS  27  21.754  24.550  21.014
  195    H    CYS  28           H        CYS  28  23.854  23.818  23.960
  196    HA   CYS  28           HA       CYS  28  23.834  26.637  24.732
  197    HB2  CYS  28           HB2      CYS  28  25.887  25.190  24.365
  198    HB3  CYS  28           HB3      CYS  28  25.589  25.359  22.635
  199    H    ILE  29           H        ILE  29  24.037  28.348  23.064
  200    HA   ILE  29           HA       ILE  29  21.477  28.556  21.810
  201    HB   ILE  29           HB       ILE  29  22.549  30.281  23.130
  202   HG12  ILE  29          HG12      ILE  29  22.089  31.366  20.335
  203   HG13  ILE  29          HG13      ILE  29  20.809  30.909  21.475
  204   HG21  ILE  29          HG21      ILE  29  24.883  29.938  22.411
  205   HG22  ILE  29          HG22      ILE  29  24.501  30.646  20.829
  206   HG23  ILE  29          HG23      ILE  29  24.417  31.625  22.309
  207   HD11  ILE  29          HD11      ILE  29  21.693  32.583  23.105
  208   HD12  ILE  29          HD12      ILE  29  22.827  33.142  21.849
  209   HD13  ILE  29          HD13      ILE  29  21.085  33.282  21.589
  210    HA   PRO  30           HA       PRO  30  21.904  27.044  17.912
  211    HB2  PRO  30           HB2      PRO  30  20.701  29.528  16.694
  212    HB3  PRO  30           HB3      PRO  30  20.321  27.804  16.363
  213    HG2  PRO  30           HG2      PRO  30  18.755  29.180  18.056
  214    HG3  PRO  30           HG3      PRO  30  19.320  27.544  18.533
  215    HD2  PRO  30           HD2      PRO  30  20.442  30.231  19.314
  216    HD3  PRO  30           HD3      PRO  30  20.070  28.828  20.359
  217    H    ARG  31           H        ARG  31  23.610  26.586  16.757
  218    HA   ARG  31           HA       ARG  31  24.843  28.452  14.896
  219    HB2  ARG  31           HB2      ARG  31  27.158  28.161  15.712
  220    HB3  ARG  31           HB3      ARG  31  26.126  29.100  16.776
  221    HG2  ARG  31           HG2      ARG  31  25.835  26.981  18.202
  222    HG3  ARG  31           HG3      ARG  31  27.119  26.266  17.214
  223    HD2  ARG  31           HD2      ARG  31  28.587  28.222  17.857
  224    HD3  ARG  31           HD3      ARG  31  27.280  28.786  18.917
  225    HE   ARG  31           HE       ARG  31  28.335  26.029  19.279
  226   HH11  ARG  31          HH21      ARG  31  28.201  29.255  20.669
  227   HH12  ARG  31          HH22      ARG  31  28.792  28.674  22.210
  228   HH21  ARG  31          HH11      ARG  31  29.084  25.418  21.150
  229   HH22  ARG  31          HH12      ARG  31  29.476  26.567  22.424
  Start of MODEL   15
    1    H1   GLY   1           H1       GLY   1  17.712  19.445  37.859
    2    H2   GLY   1           H2       GLY   1  17.813  20.362  36.493
    3    H3   GLY   1           H3       GLY   1  16.395  20.267  37.322
    4    HA2  GLY   1           HA2      GLY   1  17.370  21.379  39.223
    5    HA3  GLY   1           HA3      GLY   1  18.877  21.493  38.285
    6    H    SER   2           H        SER   2  18.775  23.782  38.493
    7    HA   SER   2           HA       SER   2  16.546  25.364  37.583
    8    HB2  SER   2           HB2      SER   2  19.455  26.102  38.041
    9    HB3  SER   2           HB3      SER   2  18.133  27.251  37.741
   10    HG   SER   2           HG       SER   2  18.433  27.039  39.923
   11    H    GLY   3           H        GLY   3  15.870  25.407  35.540
   12    HA2  GLY   3           HA2      GLY   3  15.865  25.626  33.205
   13    HA3  GLY   3           HA3      GLY   3  17.582  26.043  33.262
   14    H    CYS   4           H        CYS   4  19.059  24.283  33.681
   15    HA   CYS   4           HA       CYS   4  18.051  21.538  33.402
   16    HB2  CYS   4           HB2      CYS   4  19.190  22.485  31.218
   17    HB3  CYS   4           HB3      CYS   4  20.689  22.119  32.066
   18    H    MET   5           H        MET   5  21.275  23.030  33.786
   19    HA   MET   5           HA       MET   5  20.772  23.453  36.588
   20    HB2  MET   5           HB2      MET   5  23.384  22.065  35.837
   21    HB3  MET   5           HB3      MET   5  22.929  22.676  37.421
   22    HG2  MET   5           HG2      MET   5  21.111  20.987  37.538
   23    HG3  MET   5           HG3      MET   5  21.615  20.364  35.959
   24    HE1  MET   5           HE1      MET   5  21.771  17.982  36.825
   25    HE2  MET   5           HE2      MET   5  22.672  17.472  38.268
   26    HE3  MET   5           HE3      MET   5  21.243  18.514  38.439
   27    H    LYS   6           H        LYS   6  21.958  25.370  37.264
   28    HA   LYS   6           HA       LYS   6  22.844  27.135  35.166
   29    HB2  LYS   6           HB2      LYS   6  21.954  27.898  37.357
   30    HB3  LYS   6           HB3      LYS   6  23.412  27.281  38.157
   31    HG2  LYS   6           HG2      LYS   6  24.817  28.866  36.901
   32    HG3  LYS   6           HG3      LYS   6  23.426  29.380  35.937
   33    HD2  LYS   6           HD2      LYS   6  23.946  31.045  37.614
   34    HD3  LYS   6           HD3      LYS   6  22.359  30.334  37.947
   35    HE2  LYS   6           HE2      LYS   6  23.404  28.875  39.681
   36    HE3  LYS   6           HE3      LYS   6  24.983  29.604  39.339
   37    HZ1  LYS   6           HZ1      LYS   6  24.123  31.728  40.071
   38    HZ2  LYS   6           HZ2      LYS   6  22.608  31.100  40.316
   39    HZ3  LYS   6           HZ3      LYS   6  23.867  30.620  41.243
   40    H    GLU   7           H        GLU   7  24.703  25.104  37.457
   41    HA   GLU   7           HA       GLU   7  27.306  25.871  36.598
   42    HB2  GLU   7           HB2      GLU   7  26.292  23.229  37.749
   43    HB3  GLU   7           HB3      GLU   7  27.979  23.697  37.590
   44    HG2  GLU   7           HG2      GLU   7  27.573  24.194  39.797
   45    HG3  GLU   7           HG3      GLU   7  27.416  25.766  39.026
   46    H    TYR   8           H        TYR   8  25.212  23.226  35.409
   47    HA   TYR   8           HA       TYR   8  26.974  22.138  33.453
   48    HB2  TYR   8           HB2      TYR   8  24.911  21.085  34.308
   49    HB3  TYR   8           HB3      TYR   8  23.932  22.316  33.533
   50    HD1  TYR   8           HD1      TYR   8  23.602  22.330  31.071
   51    HD2  TYR   8           HD2      TYR   8  25.867  19.251  33.072
   52    HE1  TYR   8           HE1      TYR   8  23.284  20.827  29.110
   53    HE2  TYR   8           HE2      TYR   8  25.534  17.744  31.101
   54    HH   TYR   8           HH       TYR   8  23.655  18.725  28.207
   55    H    CYS   9           H        CYS   9  24.379  24.629  33.083
   56    HA   CYS   9           HA       CYS   9  24.968  25.174  30.340
   57    HB2  CYS   9           HB2      CYS   9  23.486  26.666  32.527
   58    HB3  CYS   9           HB3      CYS   9  23.615  27.291  30.883
   59    H    ALA  10           H        ALA  10  26.241  26.738  33.316
   60    HA   ALA  10           HA       ALA  10  27.628  28.825  31.936
   61    HB1  ALA  10           HB1      ALA  10  28.144  27.553  34.664
   62    HB2  ALA  10           HB2      ALA  10  28.795  29.107  34.096
   63    HB3  ALA  10           HB3      ALA  10  27.050  28.917  34.327
   64    H    GLY  11           H        GLY  11  28.627  25.509  32.835
   65    HA2  GLY  11           HA2      GLY  11  31.364  25.752  31.934
   66    HA3  GLY  11           HA3      GLY  11  30.465  24.254  32.210
   67    H    GLN  12           H        GLN  12  28.458  24.243  30.422
   68    HA   GLN  12           HA       GLN  12  29.750  23.513  27.987
   69    HB2  GLN  12           HB2      GLN  12  26.825  23.966  28.691
   70    HB3  GLN  12           HB3      GLN  12  27.352  23.247  27.181
   71    HG2  GLN  12           HG2      GLN  12  28.109  22.042  29.888
   72    HG3  GLN  12           HG3      GLN  12  26.596  21.678  29.070
   73   HE21  GLN  12          HE22      GLN  12  27.902  19.499  29.510
   74   HE22  GLN  12          HE21      GLN  12  28.611  18.881  28.025
   75    H    CYS  13           H        CYS  13  27.882  26.479  28.799
   76    HA   CYS  13           HA       CYS  13  28.403  27.541  26.046
   77    HB2  CYS  13           HB2      CYS  13  25.989  28.114  27.768
   78    HB3  CYS  13           HB3      CYS  13  26.189  28.402  26.045
   79    H    ARG  14           H        ARG  14  28.610  29.876  25.831
   80    HA   ARG  14           HA       ARG  14  28.723  31.524  28.249
   81    HB2  ARG  14           HB2      ARG  14  31.053  32.227  27.965
   82    HB3  ARG  14           HB3      ARG  14  30.830  30.561  28.469
   83    HG2  ARG  14           HG2      ARG  14  31.350  29.754  26.194
   84    HG3  ARG  14           HG3      ARG  14  31.474  31.416  25.610
   85    HD2  ARG  14           HD2      ARG  14  33.679  30.412  25.973
   86    HD3  ARG  14           HD3      ARG  14  33.421  31.825  27.006
   87    HE   ARG  14           HE       ARG  14  32.755  29.342  28.383
   88   HH11  ARG  14          HH11      ARG  14  35.618  31.152  27.332
   89   HH12  ARG  14          HH12      ARG  14  36.482  30.704  28.793
   90   HH21  ARG  14          HH21      ARG  14  34.125  28.785  30.202
   91   HH22  ARG  14          HH22      ARG  14  35.761  29.429  30.162
   92    H    GLY  15           H        GLY  15  29.300  33.681  27.982
   93    HA2  GLY  15           HA2      GLY  15  28.545  35.725  27.001
   94    HA3  GLY  15           HA3      GLY  15  27.832  34.826  25.649
   95    H    LYS  16           H        LYS  16  26.717  36.612  27.961
   96    HA   LYS  16           HA       LYS  16  25.335  34.937  29.798
   97    HB2  LYS  16           HB2      LYS  16  25.822  37.352  30.151
   98    HB3  LYS  16           HB3      LYS  16  24.652  37.771  28.902
   99    HG2  LYS  16           HG2      LYS  16  23.688  38.117  31.086
  100    HG3  LYS  16           HG3      LYS  16  22.816  36.819  30.275
  101    HD2  LYS  16           HD2      LYS  16  24.114  35.138  31.615
  102    HD3  LYS  16           HD3      LYS  16  24.951  36.459  32.437
  103    HE2  LYS  16           HE2      LYS  16  21.957  35.839  32.520
  104    HE3  LYS  16           HE3      LYS  16  23.136  35.516  33.797
  105    HZ1  LYS  16           HZ1      LYS  16  22.065  37.528  34.369
  106    HZ2  LYS  16           HZ2      LYS  16  23.541  37.971  33.847
  107    HZ3  LYS  16           HZ3      LYS  16  22.219  38.171  32.865
  108    H    VAL  17           H        VAL  17  24.278  36.138  26.633
  109    HA   VAL  17           HA       VAL  17  21.528  35.205  26.911
  110    HB   VAL  17           HB       VAL  17  23.092  35.934  24.408
  111   HG11  VAL  17          HG11      VAL  17  21.119  34.660  23.786
  112   HG12  VAL  17          HG12      VAL  17  20.115  35.608  24.906
  113   HG13  VAL  17          HG13      VAL  17  20.812  36.362  23.454
  114   HG21  VAL  17          HG21      VAL  17  22.944  37.821  26.004
  115   HG22  VAL  17          HG22      VAL  17  21.895  38.098  24.611
  116   HG23  VAL  17          HG23      VAL  17  21.192  37.557  26.154
  117    H    SER  18           H        SER  18  24.552  33.778  25.617
  118    HA   SER  18           HA       SER  18  23.428  31.428  24.525
  119    HB2  SER  18           HB2      SER  18  26.125  31.554  25.875
  120    HB3  SER  18           HB3      SER  18  25.643  30.722  24.399
  121    HG   SER  18           HG       SER  18  26.974  32.694  24.302
  122    H    GLN  19           H        GLN  19  24.741  32.129  27.813
  123    HA   GLN  19           HA       GLN  19  23.957  29.595  28.944
  124    HB2  GLN  19           HB2      GLN  19  24.555  32.339  30.105
  125    HB3  GLN  19           HB3      GLN  19  24.213  30.908  31.107
  126    HG2  GLN  19           HG2      GLN  19  26.101  29.711  30.236
  127    HG3  GLN  19           HG3      GLN  19  26.385  30.898  28.970
  128   HE21  GLN  19          HE22      GLN  19  28.538  30.285  30.294
  129   HE22  GLN  19          HE21      GLN  19  28.994  31.601  31.385
  130    H    ASP  20           H        ASP  20  22.180  32.741  28.834
  131    HA   ASP  20           HA       ASP  20  19.918  31.903  30.323
  132    HB2  ASP  20           HB2      ASP  20  20.573  34.216  29.825
  133    HB3  ASP  20           HB3      ASP  20  20.185  33.970  28.117
  134    H    TYR  21           H        TYR  21  20.570  31.576  26.812
  135    HA   TYR  21           HA       TYR  21  18.086  30.310  26.112
  136    HB2  TYR  21           HB2      TYR  21  19.840  31.176  24.538
  137    HB3  TYR  21           HB3      TYR  21  20.869  29.824  24.984
  138    HD1  TYR  21           HD2      TYR  21  17.812  30.864  23.235
  139    HD2  TYR  21           HD1      TYR  21  20.343  27.514  24.178
  140    HE1  TYR  21           HE2      TYR  21  16.735  29.552  21.419
  141    HE2  TYR  21           HE1      TYR  21  19.255  26.186  22.387
  142    HH   TYR  21           HH       TYR  21  16.725  27.611  20.271
  143    H    CYS  22           H        CYS  22  21.136  28.964  27.475
  144    HA   CYS  22           HA       CYS  22  20.280  26.199  27.238
  145    HB2  CYS  22           HB2      CYS  22  22.616  26.850  27.315
  146    HB3  CYS  22           HB3      CYS  22  22.426  27.525  28.929
  147    H    LEU  23           H        LEU  23  19.876  28.704  29.719
  148    HA   LEU  23           HA       LEU  23  18.581  27.036  31.658
  149    HB2  LEU  23           HB2      LEU  23  19.027  29.916  31.112
  150    HB3  LEU  23           HB3      LEU  23  17.522  29.572  31.948
  151    HG   LEU  23           HG       LEU  23  18.694  28.436  33.760
  152   HD11  LEU  23          HD11      LEU  23  20.598  27.404  32.595
  153   HD12  LEU  23          HD12      LEU  23  21.270  29.009  32.231
  154   HD13  LEU  23          HD13      LEU  23  21.173  28.431  33.908
  155   HD21  LEU  23          HD21      LEU  23  20.063  31.058  33.032
  156   HD22  LEU  23          HD22      LEU  23  18.484  30.904  33.836
  157   HD23  LEU  23          HD23      LEU  23  19.954  30.348  34.662
  158    H    LYS  24           H        LYS  24  17.407  27.987  28.563
  159    HA   LYS  24           HA       LYS  24  14.624  27.125  29.308
  160    HB2  LYS  24           HB2      LYS  24  15.724  28.506  26.835
  161    HB3  LYS  24           HB3      LYS  24  14.076  27.927  26.997
  162    HG2  LYS  24           HG2      LYS  24  15.355  30.012  28.814
  163    HG3  LYS  24           HG3      LYS  24  14.366  30.380  27.400
  164    HD2  LYS  24           HD2      LYS  24  12.444  29.176  28.432
  165    HD3  LYS  24           HD3      LYS  24  13.425  28.877  29.879
  166    HE2  LYS  24           HE2      LYS  24  13.699  31.308  30.216
  167    HE3  LYS  24           HE3      LYS  24  12.701  31.623  28.778
  168    HZ1  LYS  24           HZ1      LYS  24  11.401  31.725  30.859
  169    HZ2  LYS  24           HZ2      LYS  24  10.861  30.483  29.903
  170    HZ3  LYS  24           HZ3      LYS  24  11.794  30.164  31.189
  171    H    HIS  25           H        HIS  25  17.431  26.177  27.497
  172    HA   HIS  25           HA       HIS  25  15.890  23.908  26.264
  173    HB2  HIS  25           HB2      HIS  25  18.041  25.764  25.193
  174    HB3  HIS  25           HB3      HIS  25  17.579  24.288  24.368
  175    HD2  HIS  25           HD2      HIS  25  16.528  27.863  24.671
  176    HE1  HIS  25           HE1      HIS  25  13.196  25.900  22.881
  177    HE2  HIS  25           HE2      HIS  25  14.200  28.159  23.444
  178    H    CYS  26           H        CYS  26  18.424  24.160  28.493
  179    HA   CYS  26           HA       CYS  26  20.194  22.923  29.069
  180    HB2  CYS  26           HB2      CYS  26  18.263  21.223  29.154
  181    HB3  CYS  26           HB3      CYS  26  18.974  20.524  27.704
  182    H    LYS  27           H        LYS  27  20.119  24.019  26.149
  183    HA   LYS  27           HA       LYS  27  22.582  22.646  25.119
  184    HB2  LYS  27           HB2      LYS  27  20.205  23.660  23.514
  185    HB3  LYS  27           HB3      LYS  27  21.677  22.972  22.831
  186    HG2  LYS  27           HG2      LYS  27  21.146  20.766  23.696
  187    HG3  LYS  27           HG3      LYS  27  19.795  21.396  24.631
  188    HD2  LYS  27           HD2      LYS  27  18.968  22.280  22.226
  189    HD3  LYS  27           HD3      LYS  27  20.028  20.990  21.656
  190    HE2  LYS  27           HE2      LYS  27  17.856  20.019  21.844
  191    HE3  LYS  27           HE3      LYS  27  18.774  19.416  23.230
  192    HZ1  LYS  27           HZ1      LYS  27  16.633  20.137  23.996
  193    HZ2  LYS  27           HZ2      LYS  27  17.705  21.236  24.552
  194    HZ3  LYS  27           HZ3      LYS  27  16.769  21.588  23.240
  195    H    CYS  28           H        CYS  28  23.921  24.042  23.779
  196    HA   CYS  28           HA       CYS  28  23.804  26.851  24.562
  197    HB2  CYS  28           HB2      CYS  28  25.639  25.539  22.546
  198    HB3  CYS  28           HB3      CYS  28  25.824  27.133  23.291
  199    H    ILE  29           H        ILE  29  23.806  28.642  23.070
  200    HA   ILE  29           HA       ILE  29  21.332  28.542  21.676
  201    HB   ILE  29           HB       ILE  29  22.029  30.407  23.043
  202   HG12  ILE  29          HG12      ILE  29  21.511  31.262  20.168
  203   HG13  ILE  29          HG13      ILE  29  20.293  30.646  21.286
  204   HG21  ILE  29          HG21      ILE  29  23.651  32.079  22.312
  205   HG22  ILE  29          HG22      ILE  29  24.439  30.516  22.413
  206   HG23  ILE  29          HG23      ILE  29  23.982  31.174  20.826
  207   HD11  ILE  29          HD11      ILE  29  21.860  33.237  21.528
  208   HD12  ILE  29          HD12      ILE  29  20.121  33.032  21.285
  209   HD13  ILE  29          HD13      ILE  29  20.856  32.562  22.837
  210    HA   PRO  30           HA       PRO  30  22.816  28.330  17.368
  211    HB2  PRO  30           HB2      PRO  30  19.964  28.978  16.762
  212    HB3  PRO  30           HB3      PRO  30  20.989  27.668  16.123
  213    HG2  PRO  30           HG2      PRO  30  19.017  27.174  17.942
  214    HG3  PRO  30           HG3      PRO  30  20.592  26.321  18.039
  215    HD2  PRO  30           HD2      PRO  30  19.707  28.791  19.576
  216    HD3  PRO  30           HD3      PRO  30  20.454  27.275  20.188
  217    H    ARG  31           H        ARG  31  23.990  30.122  16.972
  218    HA   ARG  31           HA       ARG  31  22.717  32.751  16.516
  219    HB2  ARG  31           HB2      ARG  31  24.127  33.967  17.973
  220    HB3  ARG  31           HB3      ARG  31  23.404  32.698  18.946
  221    HG2  ARG  31           HG2      ARG  31  25.502  31.397  18.872
  222    HG3  ARG  31           HG3      ARG  31  26.227  32.567  17.756
  223    HD2  ARG  31           HD2      ARG  31  25.938  34.352  19.518
  224    HD3  ARG  31           HD3      ARG  31  25.398  33.094  20.626
  225    HE   ARG  31           HE       ARG  31  27.586  32.347  20.880
  226   HH11  ARG  31          HH21      ARG  31  27.627  34.563  18.090
  227   HH12  ARG  31          HH22      ARG  31  29.402  34.546  18.130
  228   HH21  ARG  31          HH11      ARG  31  29.777  32.566  20.812
  229   HH22  ARG  31          HH12      ARG  31  30.508  33.436  19.465
  Start of MODEL   16
    1    H1   GLY   1           H1       GLY   1  11.233  24.472  27.592
    2    H2   GLY   1           H2       GLY   1  12.646  25.227  28.006
    3    H3   GLY   1           H3       GLY   1  11.201  25.963  28.279
    4    HA2  GLY   1           HA2      GLY   1  10.570  24.316  29.880
    5    HA3  GLY   1           HA3      GLY   1  12.136  23.516  29.607
    6    H    SER   2           H        SER   2  11.460  24.274  32.121
    7    HA   SER   2           HA       SER   2  12.263  26.948  32.826
    8    HB2  SER   2           HB2      SER   2  11.794  24.564  34.631
    9    HB3  SER   2           HB3      SER   2  11.763  26.277  35.084
   10    HG   SER   2           HG       SER   2   9.703  25.241  34.655
   11    H    GLY   3           H        GLY   3  14.467  25.618  31.512
   12    HA2  GLY   3           HA2      GLY   3  16.734  25.478  31.636
   13    HA3  GLY   3           HA3      GLY   3  16.674  26.067  33.292
   14    H    CYS   4           H        CYS   4  18.458  24.596  33.545
   15    HA   CYS   4           HA       CYS   4  17.711  21.806  34.187
   16    HB2  CYS   4           HB2      CYS   4  19.503  22.645  31.940
   17    HB3  CYS   4           HB3      CYS   4  20.146  21.404  33.000
   18    H    MET   5           H        MET   5  20.928  23.292  33.993
   19    HA   MET   5           HA       MET   5  20.911  24.187  36.763
   20    HB2  MET   5           HB2      MET   5  22.873  22.054  35.798
   21    HB3  MET   5           HB3      MET   5  23.200  23.143  37.143
   22    HG2  MET   5           HG2      MET   5  21.145  22.277  38.288
   23    HG3  MET   5           HG3      MET   5  20.972  21.102  36.980
   24    HE1  MET   5           HE1      MET   5  24.234  22.427  38.962
   25    HE2  MET   5           HE2      MET   5  22.910  22.234  40.128
   26    HE3  MET   5           HE3      MET   5  24.317  21.160  40.193
   27    H    LYS   6           H        LYS   6  22.034  26.107  36.825
   28    HA   LYS   6           HA       LYS   6  23.265  27.136  34.446
   29    HB2  LYS   6           HB2      LYS   6  23.674  29.129  35.646
   30    HB3  LYS   6           HB3      LYS   6  22.090  28.490  36.050
   31    HG2  LYS   6           HG2      LYS   6  23.146  27.564  38.212
   32    HG3  LYS   6           HG3      LYS   6  24.602  28.471  37.775
   33    HD2  LYS   6           HD2      LYS   6  23.358  29.878  39.271
   34    HD3  LYS   6           HD3      LYS   6  23.140  30.557  37.650
   35    HE2  LYS   6           HE2      LYS   6  20.972  29.068  37.571
   36    HE3  LYS   6           HE3      LYS   6  21.186  28.911  39.316
   37    HZ1  LYS   6           HZ1      LYS   6  21.031  31.321  39.478
   38    HZ2  LYS   6           HZ2      LYS   6  20.899  31.466  37.826
   39    HZ3  LYS   6           HZ3      LYS   6  19.716  30.725  38.693
   40    H    GLU   7           H        GLU   7  24.712  25.513  37.199
   41    HA   GLU   7           HA       GLU   7  27.470  25.933  36.536
   42    HB2  GLU   7           HB2      GLU   7  26.145  23.467  37.773
   43    HB3  GLU   7           HB3      GLU   7  27.861  23.834  37.749
   44    HG2  GLU   7           HG2      GLU   7  27.384  24.524  39.849
   45    HG3  GLU   7           HG3      GLU   7  27.182  26.047  38.989
   46    H    TYR   8           H        TYR   8  25.155  23.446  35.372
   47    HA   TYR   8           HA       TYR   8  27.089  22.097  33.685
   48    HB2  TYR   8           HB2      TYR   8  25.076  20.984  34.558
   49    HB3  TYR   8           HB3      TYR   8  24.049  22.115  33.695
   50    HD1  TYR   8           HD1      TYR   8  27.106  20.232  32.505
   51    HD2  TYR   8           HD2      TYR   8  22.849  20.851  32.132
   52    HE1  TYR   8           HE1      TYR   8  27.064  18.737  30.531
   53    HE2  TYR   8           HE2      TYR   8  22.811  19.314  30.166
   54    HH   TYR   8           HH       TYR   8  25.818  17.787  28.924
   55    H    CYS   9           H        CYS   9  24.521  24.510  33.093
   56    HA   CYS   9           HA       CYS   9  25.022  24.865  30.316
   57    HB2  CYS   9           HB2      CYS   9  23.800  26.582  32.478
   58    HB3  CYS   9           HB3      CYS   9  23.956  27.173  30.830
   59    H    ALA  10           H        ALA  10  26.648  26.491  33.102
   60    HA   ALA  10           HA       ALA  10  28.307  28.158  31.472
   61    HB1  ALA  10           HB1      ALA  10  29.644  28.379  33.540
   62    HB2  ALA  10           HB2      ALA  10  27.911  28.565  33.857
   63    HB3  ALA  10           HB3      ALA  10  28.733  27.044  34.277
   64    H    GLY  11           H        GLY  11  28.551  24.730  32.282
   65    HA2  GLY  11           HA2      GLY  11  31.279  24.351  31.336
   66    HA3  GLY  11           HA3      GLY  11  30.048  23.115  31.620
   67    H    GLN  12           H        GLN  12  28.138  24.564  29.760
   68    HA   GLN  12           HA       GLN  12  29.169  23.476  27.184
   69    HB2  GLN  12           HB2      GLN  12  26.384  24.323  28.084
   70    HB3  GLN  12           HB3      GLN  12  26.794  23.708  26.481
   71    HG2  GLN  12           HG2      GLN  12  27.583  21.574  27.551
   72    HG3  GLN  12           HG3      GLN  12  26.973  22.175  29.099
   73   HE21  GLN  12          HE22      GLN  12  24.652  22.163  29.433
   74   HE22  GLN  12          HE21      GLN  12  23.544  21.553  28.208
   75    H    CYS  13           H        CYS  13  28.277  26.552  28.637
   76    HA   CYS  13           HA       CYS  13  28.534  28.012  26.052
   77    HB2  CYS  13           HB2      CYS  13  26.197  26.832  26.829
   78    HB3  CYS  13           HB3      CYS  13  26.068  28.332  27.723
   79    H    ARG  14           H        ARG  14  28.894  30.244  26.244
   80    HA   ARG  14           HA       ARG  14  28.459  31.609  28.812
   81    HB2  ARG  14           HB2      ARG  14  30.706  32.524  28.940
   82    HB3  ARG  14           HB3      ARG  14  30.652  30.778  29.170
   83    HG2  ARG  14           HG2      ARG  14  31.548  30.363  26.946
   84    HG3  ARG  14           HG3      ARG  14  31.390  32.069  26.524
   85    HD2  ARG  14           HD2      ARG  14  33.691  31.646  26.976
   86    HD3  ARG  14           HD3      ARG  14  33.059  32.648  28.295
   87    HE   ARG  14           HE       ARG  14  32.841  29.966  29.157
   88   HH11  ARG  14          HH11      ARG  14  35.475  32.180  28.418
   89   HH12  ARG  14          HH12      ARG  14  36.644  31.157  29.212
   90   HH21  ARG  14          HH21      ARG  14  34.309  28.819  30.218
   91   HH22  ARG  14          HH22      ARG  14  35.995  29.323  30.298
   92    H    GLY  15           H        GLY  15  28.867  33.889  28.781
   93    HA2  GLY  15           HA2      GLY  15  28.283  35.968  27.743
   94    HA3  GLY  15           HA3      GLY  15  27.749  35.112  26.294
   95    H    LYS  16           H        LYS  16  26.291  36.960  28.067
   96    HA   LYS  16           HA       LYS  16  24.611  35.761  29.998
   97    HB2  LYS  16           HB2      LYS  16  25.040  38.202  29.715
   98    HB3  LYS  16           HB3      LYS  16  24.134  38.170  28.202
   99    HG2  LYS  16           HG2      LYS  16  22.093  37.432  29.564
  100    HG3  LYS  16           HG3      LYS  16  23.059  37.715  31.017
  101    HD2  LYS  16           HD2      LYS  16  21.659  39.644  30.599
  102    HD3  LYS  16           HD3      LYS  16  23.338  40.115  30.287
  103    HE2  LYS  16           HE2      LYS  16  22.988  39.850  27.857
  104    HE3  LYS  16           HE3      LYS  16  21.358  39.214  28.138
  105    HZ1  LYS  16           HZ1      LYS  16  22.243  41.973  28.756
  106    HZ2  LYS  16           HZ2      LYS  16  21.304  41.498  27.479
  107    HZ3  LYS  16           HZ3      LYS  16  20.734  41.380  29.020
  108    H    VAL  17           H        VAL  17  23.990  36.307  26.533
  109    HA   VAL  17           HA       VAL  17  21.223  35.374  26.660
  110    HB   VAL  17           HB       VAL  17  22.932  36.010  24.238
  111   HG11  VAL  17          HG11      VAL  17  20.754  36.449  23.142
  112   HG12  VAL  17          HG12      VAL  17  20.886  34.763  23.640
  113   HG13  VAL  17          HG13      VAL  17  19.906  35.899  24.600
  114   HG21  VAL  17          HG21      VAL  17  22.880  37.968  25.655
  115   HG22  VAL  17          HG22      VAL  17  21.712  38.219  24.362
  116   HG23  VAL  17          HG23      VAL  17  21.141  37.753  25.977
  117    H    SER  18           H        SER  18  24.371  34.094  25.565
  118    HA   SER  18           HA       SER  18  23.534  31.647  24.484
  119    HB2  SER  18           HB2      SER  18  26.068  31.955  26.083
  120    HB3  SER  18           HB3      SER  18  25.800  31.142  24.535
  121    HG   SER  18           HG       SER  18  26.980  33.222  24.648
  122    H    GLN  19           H        GLN  19  24.619  32.380  27.889
  123    HA   GLN  19           HA       GLN  19  23.809  29.817  28.920
  124    HB2  GLN  19           HB2      GLN  19  24.365  32.541  30.132
  125    HB3  GLN  19           HB3      GLN  19  23.880  31.150  31.132
  126    HG2  GLN  19           HG2      GLN  19  25.755  29.825  30.373
  127    HG3  GLN  19           HG3      GLN  19  26.202  31.028  29.166
  128   HE21  GLN  19          HE22      GLN  19  28.178  30.263  30.684
  129   HE22  GLN  19          HE21      GLN  19  28.583  31.583  31.796
  130    H    ASP  20           H        ASP  20  21.982  32.901  28.651
  131    HA   ASP  20           HA       ASP  20  19.652  32.081  30.042
  132    HB2  ASP  20           HB2      ASP  20  20.010  34.362  29.452
  133    HB3  ASP  20           HB3      ASP  20  20.129  33.974  27.736
  134    H    TYR  21           H        TYR  21  20.500  31.616  26.556
  135    HA   TYR  21           HA       TYR  21  18.160  30.146  25.833
  136    HB2  TYR  21           HB2      TYR  21  19.973  31.069  24.313
  137    HB3  TYR  21           HB3      TYR  21  20.969  29.697  24.779
  138    HD1  TYR  21           HD1      TYR  21  20.324  27.374  24.068
  139    HD2  TYR  21           HD2      TYR  21  18.126  30.854  22.783
  140    HE1  TYR  21           HE1      TYR  21  19.187  26.015  22.312
  141    HE2  TYR  21           HE2      TYR  21  16.991  29.505  21.046
  142    HH   TYR  21           HH       TYR  21  16.743  27.474  20.111
  143    H    CYS  22           H        CYS  22  21.172  29.029  27.449
  144    HA   CYS  22           HA       CYS  22  20.383  26.223  27.329
  145    HB2  CYS  22           HB2      CYS  22  22.715  27.040  27.433
  146    HB3  CYS  22           HB3      CYS  22  22.442  27.611  29.077
  147    H    LEU  23           H        LEU  23  19.870  28.827  29.665
  148    HA   LEU  23           HA       LEU  23  18.416  27.141  31.545
  149    HB2  LEU  23           HB2      LEU  23  19.152  30.002  31.169
  150    HB3  LEU  23           HB3      LEU  23  17.674  29.674  32.082
  151    HG   LEU  23           HG       LEU  23  18.814  28.324  33.689
  152   HD11  LEU  23          HD11      LEU  23  20.543  27.202  32.369
  153   HD12  LEU  23          HD12      LEU  23  21.377  28.752  32.085
  154   HD13  LEU  23          HD13      LEU  23  21.282  28.052  33.717
  155   HD21  LEU  23          HD21      LEU  23  20.354  30.006  34.667
  156   HD22  LEU  23          HD22      LEU  23  20.407  30.858  33.102
  157   HD23  LEU  23          HD23      LEU  23  18.890  30.755  34.027
  158    H    LYS  24           H        LYS  24  17.568  28.074  28.488
  159    HA   LYS  24           HA       LYS  24  14.630  27.722  29.022
  160    HB2  LYS  24           HB2      LYS  24  16.216  28.819  26.681
  161    HB3  LYS  24           HB3      LYS  24  14.487  28.487  26.594
  162    HG2  LYS  24           HG2      LYS  24  13.953  30.149  28.134
  163    HG3  LYS  24           HG3      LYS  24  15.609  30.274  28.762
  164    HD2  LYS  24           HD2      LYS  24  16.424  31.331  26.807
  165    HD3  LYS  24           HD3      LYS  24  14.984  30.911  25.884
  166    HE2  LYS  24           HE2      LYS  24  13.620  32.471  27.104
  167    HE3  LYS  24           HE3      LYS  24  14.945  32.838  28.231
  168    HZ1  LYS  24           HZ1      LYS  24  16.139  33.901  26.542
  169    HZ2  LYS  24           HZ2      LYS  24  15.249  33.247  25.317
  170    HZ3  LYS  24           HZ3      LYS  24  14.598  34.419  26.271
  171    H    HIS  25           H        HIS  25  17.388  26.180  27.680
  172    HA   HIS  25           HA       HIS  25  15.733  23.981  26.456
  173    HB2  HIS  25           HB2      HIS  25  17.943  25.585  25.101
  174    HB3  HIS  25           HB3      HIS  25  17.133  24.185  24.417
  175    HD2  HIS  25           HD2      HIS  25  16.737  27.923  24.733
  176    HE1  HIS  25           HE1      HIS  25  13.175  26.524  22.870
  177    HE2  HIS  25           HE2      HIS  25  14.502  28.602  23.507
  178    H    CYS  26           H        CYS  26  18.316  24.372  28.596
  179    HA   CYS  26           HA       CYS  26  19.939  23.135  29.382
  180    HB2  CYS  26           HB2      CYS  26  18.522  20.769  28.167
  181    HB3  CYS  26           HB3      CYS  26  19.672  20.752  29.498
  182    H    LYS  27           H        LYS  27  20.283  24.110  26.591
  183    HA   LYS  27           HA       LYS  27  22.882  22.824  25.981
  184    HB2  LYS  27           HB2      LYS  27  22.280  22.488  23.630
  185    HB3  LYS  27           HB3      LYS  27  21.255  21.550  24.712
  186    HG2  LYS  27           HG2      LYS  27  19.497  23.435  24.478
  187    HG3  LYS  27           HG3      LYS  27  20.550  24.142  23.258
  188    HD2  LYS  27           HD2      LYS  27  18.802  22.890  22.202
  189    HD3  LYS  27           HD3      LYS  27  20.365  22.094  21.905
  190    HE2  LYS  27           HE2      LYS  27  19.844  20.497  23.771
  191    HE3  LYS  27           HE3      LYS  27  18.252  21.251  23.951
  192    HZ1  LYS  27           HZ1      LYS  27  17.747  20.529  21.669
  193    HZ2  LYS  27           HZ2      LYS  27  19.274  19.923  21.494
  194    HZ3  LYS  27           HZ3      LYS  27  18.257  19.239  22.560
  195    H    CYS  28           H        CYS  28  24.109  24.005  24.330
  196    HA   CYS  28           HA       CYS  28  23.914  26.859  24.816
  197    HB2  CYS  28           HB2      CYS  28  26.026  25.406  24.636
  198    HB3  CYS  28           HB3      CYS  28  25.786  25.498  22.892
  199    H    ILE  29           H        ILE  29  24.034  28.455  23.176
  200    HA   ILE  29           HA       ILE  29  21.578  28.360  21.738
  201    HB   ILE  29           HB       ILE  29  22.334  30.273  22.991
  202   HG12  ILE  29          HG12      ILE  29  21.974  31.027  20.060
  203   HG13  ILE  29          HG13      ILE  29  20.682  30.543  21.167
  204   HG21  ILE  29          HG21      ILE  29  24.443  30.770  20.850
  205   HG22  ILE  29          HG22      ILE  29  24.095  31.787  22.259
  206   HG23  ILE  29          HG23      ILE  29  24.765  30.175  22.493
  207   HD11  ILE  29          HD11      ILE  29  21.310  32.470  22.674
  208   HD12  ILE  29          HD12      ILE  29  22.407  33.035  21.385
  209   HD13  ILE  29          HD13      ILE  29  20.665  32.929  21.084
  210    HA   PRO  30           HA       PRO  30  23.235  27.283  17.685
  211    HB2  PRO  30           HB2      PRO  30  20.976  27.189  16.216
  212    HB3  PRO  30           HB3      PRO  30  21.303  26.026  17.517
  213    HG2  PRO  30           HG2      PRO  30  19.630  28.549  17.678
  214    HG3  PRO  30           HG3      PRO  30  19.172  26.900  18.187
  215    HD2  PRO  30           HD2      PRO  30  20.159  28.750  19.939
  216    HD3  PRO  30           HD3      PRO  30  20.535  27.004  20.099
  217    H    ARG  31           H        ARG  31  24.334  29.341  17.968
  218    HA   ARG  31           HA       ARG  31  24.011  30.768  15.496
  219    HB2  ARG  31           HB2      ARG  31  23.946  32.942  16.121
  220    HB3  ARG  31           HB3      ARG  31  22.762  32.204  17.212
  221    HG2  ARG  31           HG2      ARG  31  24.308  32.371  19.067
  222    HG3  ARG  31           HG3      ARG  31  25.641  32.915  18.058
  223    HD2  ARG  31           HD2      ARG  31  23.001  34.382  18.392
  224    HD3  ARG  31           HD3      ARG  31  24.484  34.777  19.271
  225    HE   ARG  31           HE       ARG  31  25.376  34.897  16.715
  226   HH11  ARG  31          HH22      ARG  31  22.431  36.412  17.990
  227   HH12  ARG  31          HH21      ARG  31  22.474  37.613  16.715
  228   HH21  ARG  31          HH11      ARG  31  25.392  36.556  15.307
  229   HH22  ARG  31          HH12      ARG  31  23.990  37.590  15.176
  Start of MODEL   17
    1    H1   GLY   1           H1       GLY   1  12.152  26.117  28.951
    2    H2   GLY   1           H2       GLY   1  11.583  24.660  29.446
    3    H3   GLY   1           H3       GLY   1  13.040  25.199  29.981
    4    HA2  GLY   1           HA2      GLY   1  10.428  26.415  30.594
    5    HA3  GLY   1           HA3      GLY   1  11.379  25.403  31.708
    6    H    SER   2           H        SER   2  12.428  26.621  33.189
    7    HA   SER   2           HA       SER   2  13.384  29.374  32.439
    8    HB2  SER   2           HB2      SER   2  13.193  29.903  34.791
    9    HB3  SER   2           HB3      SER   2  11.651  29.274  34.189
   10    HG   SER   2           HG       SER   2  12.369  28.430  36.221
   11    H    GLY   3           H        GLY   3  14.502  26.244  33.420
   12    HA2  GLY   3           HA2      GLY   3  17.278  27.053  33.209
   13    HA3  GLY   3           HA3      GLY   3  16.825  26.649  34.869
   14    H    CYS   4           H        CYS   4  18.745  25.195  33.465
   15    HA   CYS   4           HA       CYS   4  17.388  22.547  33.338
   16    HB2  CYS   4           HB2      CYS   4  18.400  23.230  31.130
   17    HB3  CYS   4           HB3      CYS   4  19.986  23.067  31.881
   18    H    MET   5           H        MET   5  20.837  23.343  33.644
   19    HA   MET   5           HA       MET   5  20.693  23.216  36.583
   20    HB2  MET   5           HB2      MET   5  22.585  21.513  34.923
   21    HB3  MET   5           HB3      MET   5  22.780  21.813  36.653
   22    HG2  MET   5           HG2      MET   5  20.685  20.699  37.150
   23    HG3  MET   5           HG3      MET   5  20.316  20.501  35.438
   24    HE1  MET   5           HE1      MET   5  22.675  17.774  34.176
   25    HE2  MET   5           HE2      MET   5  21.300  18.836  33.822
   26    HE3  MET   5           HE3      MET   5  22.935  19.511  34.007
   27    H    LYS   6           H        LYS   6  21.741  24.973  37.320
   28    HA   LYS   6           HA       LYS   6  22.614  26.852  35.449
   29    HB2  LYS   6           HB2      LYS   6  21.556  27.071  37.829
   30    HB3  LYS   6           HB3      LYS   6  23.231  27.133  38.389
   31    HG2  LYS   6           HG2      LYS   6  23.593  29.083  36.817
   32    HG3  LYS   6           HG3      LYS   6  21.905  28.953  36.326
   33    HD2  LYS   6           HD2      LYS   6  22.024  30.720  37.898
   34    HD3  LYS   6           HD3      LYS   6  21.225  29.382  38.725
   35    HE2  LYS   6           HE2      LYS   6  23.271  28.818  39.922
   36    HE3  LYS   6           HE3      LYS   6  24.218  29.940  38.937
   37    HZ1  LYS   6           HZ1      LYS   6  23.757  30.956  41.029
   38    HZ2  LYS   6           HZ2      LYS   6  22.901  31.744  39.879
   39    HZ3  LYS   6           HZ3      LYS   6  22.124  30.694  40.899
   40    H    GLU   7           H        GLU   7  24.687  24.647  37.275
   41    HA   GLU   7           HA       GLU   7  27.172  26.003  36.401
   42    HB2  GLU   7           HB2      GLU   7  26.592  23.327  37.729
   43    HB3  GLU   7           HB3      GLU   7  28.208  23.825  37.253
   44    HG2  GLU   7           HG2      GLU   7  26.464  25.449  39.158
   45    HG3  GLU   7           HG3      GLU   7  27.660  24.258  39.669
   46    H    TYR   8           H        TYR   8  25.102  23.451  35.140
   47    HA   TYR   8           HA       TYR   8  27.007  22.229  33.361
   48    HB2  TYR   8           HB2      TYR   8  24.928  21.186  34.153
   49    HB3  TYR   8           HB3      TYR   8  23.973  22.415  33.346
   50    HD1  TYR   8           HD1      TYR   8  26.606  19.883  32.490
   51    HD2  TYR   8           HD2      TYR   8  22.987  21.897  31.330
   52    HE1  TYR   8           HE1      TYR   8  26.425  18.421  30.469
   53    HE2  TYR   8           HE2      TYR   8  22.805  20.440  29.341
   54    HH   TYR   8           HH       TYR   8  23.716  18.763  28.159
   55    H    CYS   9           H        CYS   9  24.569  24.810  32.891
   56    HA   CYS   9           HA       CYS   9  25.346  25.335  30.153
   57    HB2  CYS   9           HB2      CYS   9  23.766  26.941  32.182
   58    HB3  CYS   9           HB3      CYS   9  23.956  27.397  30.490
   59    H    ALA  10           H        ALA  10  26.207  27.008  33.240
   60    HA   ALA  10           HA       ALA  10  27.811  29.005  32.052
   61    HB1  ALA  10           HB1      ALA  10  26.926  29.129  34.335
   62    HB2  ALA  10           HB2      ALA  10  27.965  27.770  34.839
   63    HB3  ALA  10           HB3      ALA  10  28.682  29.318  34.349
   64    H    GLY  11           H        GLY  11  28.732  25.684  32.955
   65    HA2  GLY  11           HA2      GLY  11  31.580  26.073  32.580
   66    HA3  GLY  11           HA3      GLY  11  30.722  24.539  32.704
   67    H    GLN  12           H        GLN  12  28.995  24.616  30.520
   68    HA   GLN  12           HA       GLN  12  30.807  23.826  28.435
   69    HB2  GLN  12           HB2      GLN  12  27.798  24.234  28.466
   70    HB3  GLN  12           HB3      GLN  12  28.692  23.557  27.105
   71    HG2  GLN  12           HG2      GLN  12  29.458  21.661  28.476
   72    HG3  GLN  12           HG3      GLN  12  28.605  22.299  29.882
   73   HE21  GLN  12          HE22      GLN  12  26.183  22.659  29.569
   74   HE22  GLN  12          HE21      GLN  12  25.326  21.692  28.352
   75    H    CYS  13           H        CYS  13  28.583  26.655  28.647
   76    HA   CYS  13           HA       CYS  13  29.738  27.730  26.098
   77    HB2  CYS  13           HB2      CYS  13  26.845  27.466  26.988
   78    HB3  CYS  13           HB3      CYS  13  27.350  28.360  25.548
   79    H    ARG  14           H        ARG  14  29.360  30.025  25.733
   80    HA   ARG  14           HA       ARG  14  28.922  31.679  28.166
   81    HB2  ARG  14           HB2      ARG  14  31.435  32.051  26.560
   82    HB3  ARG  14           HB3      ARG  14  30.969  32.807  28.079
   83    HG2  ARG  14           HG2      ARG  14  31.262  30.643  29.267
   84    HG3  ARG  14           HG3      ARG  14  31.760  29.887  27.728
   85    HD2  ARG  14           HD2      ARG  14  33.560  31.619  27.525
   86    HD3  ARG  14           HD3      ARG  14  33.165  32.163  29.170
   87    HE   ARG  14           HE       ARG  14  33.565  29.479  29.525
   88   HH11  ARG  14          HH11      ARG  14  35.577  32.002  28.155
   89   HH12  ARG  14          HH12      ARG  14  37.049  31.075  28.323
   90   HH21  ARG  14          HH21      ARG  14  35.533  28.449  29.916
   91   HH22  ARG  14          HH22      ARG  14  37.014  29.217  29.373
   92    H    GLY  15           H        GLY  15  29.188  33.944  27.765
   93    HA2  GLY  15           HA2      GLY  15  28.193  35.818  26.578
   94    HA3  GLY  15           HA3      GLY  15  27.483  34.667  25.430
   95    H    LYS  16           H        LYS  16  26.499  36.571  27.777
   96    HA   LYS  16           HA       LYS  16  25.426  34.796  29.799
   97    HB2  LYS  16           HB2      LYS  16  26.120  37.305  29.920
   98    HB3  LYS  16           HB3      LYS  16  24.489  37.644  29.321
   99    HG2  LYS  16           HG2      LYS  16  23.522  36.478  31.285
  100    HG3  LYS  16           HG3      LYS  16  25.154  35.991  31.807
  101    HD2  LYS  16           HD2      LYS  16  25.749  38.444  31.956
  102    HD3  LYS  16           HD3      LYS  16  24.039  38.822  31.665
  103    HE2  LYS  16           HE2      LYS  16  23.453  37.468  33.708
  104    HE3  LYS  16           HE3      LYS  16  25.181  37.179  33.977
  105    HZ1  LYS  16           HZ1      LYS  16  23.793  39.796  34.023
  106    HZ2  LYS  16           HZ2      LYS  16  24.491  39.045  35.303
  107    HZ3  LYS  16           HZ3      LYS  16  25.412  39.670  34.076
  108    H    VAL  17           H        VAL  17  24.243  35.842  26.732
  109    HA   VAL  17           HA       VAL  17  21.484  34.925  27.222
  110    HB   VAL  17           HB       VAL  17  22.616  35.951  24.611
  111   HG11  VAL  17          HG11      VAL  17  20.226  36.464  24.160
  112   HG12  VAL  17          HG12      VAL  17  20.503  34.731  24.363
  113   HG13  VAL  17          HG13      VAL  17  19.776  35.676  25.689
  114   HG21  VAL  17          HG21      VAL  17  22.890  37.733  26.273
  115   HG22  VAL  17          HG22      VAL  17  21.517  38.113  25.235
  116   HG23  VAL  17          HG23      VAL  17  21.234  37.468  26.870
  117    H    SER  18           H        SER  18  24.483  33.793  25.641
  118    HA   SER  18           HA       SER  18  23.379  31.373  24.511
  119    HB2  SER  18           HB2      SER  18  25.752  32.175  24.113
  120    HB3  SER  18           HB3      SER  18  26.142  31.667  25.750
  121    HG   SER  18           HG       SER  18  26.334  30.231  23.722
  122    H    GLN  19           H        GLN  19  24.902  32.010  27.696
  123    HA   GLN  19           HA       GLN  19  24.124  29.591  28.967
  124    HB2  GLN  19           HB2      GLN  19  24.660  32.400  30.000
  125    HB3  GLN  19           HB3      GLN  19  24.372  31.019  31.080
  126    HG2  GLN  19           HG2      GLN  19  26.269  29.811  30.273
  127    HG3  GLN  19           HG3      GLN  19  26.485  30.878  28.880
  128   HE21  GLN  19          HE22      GLN  19  28.660  30.351  30.242
  129   HE22  GLN  19          HE21      GLN  19  29.179  31.768  31.143
  130    H    ASP  20           H        ASP  20  22.190  32.662  28.740
  131    HA   ASP  20           HA       ASP  20  19.967  31.718  30.238
  132    HB2  ASP  20           HB2      ASP  20  20.344  34.082  29.621
  133    HB3  ASP  20           HB3      ASP  20  20.034  33.657  27.905
  134    H    TYR  21           H        TYR  21  20.658  31.364  26.725
  135    HA   TYR  21           HA       TYR  21  18.139  30.126  26.095
  136    HB2  TYR  21           HB2      TYR  21  19.698  31.215  24.466
  137    HB3  TYR  21           HB3      TYR  21  20.808  29.874  24.672
  138    HD1  TYR  21           HD2      TYR  21  17.495  30.896  23.315
  139    HD2  TYR  21           HD1      TYR  21  20.357  27.702  23.683
  140    HE1  TYR  21           HE2      TYR  21  16.257  29.592  21.595
  141    HE2  TYR  21           HE1      TYR  21  19.153  26.410  21.923
  142    HH   TYR  21           HH       TYR  21  16.060  27.552  20.559
  143    H    CYS  22           H        CYS  22  21.269  28.839  27.211
  144    HA   CYS  22           HA       CYS  22  20.419  26.041  27.074
  145    HB2  CYS  22           HB2      CYS  22  22.735  26.620  26.922
  146    HB3  CYS  22           HB3      CYS  22  22.701  27.470  28.464
  147    H    LEU  23           H        LEU  23  20.208  28.551  29.614
  148    HA   LEU  23           HA       LEU  23  19.000  26.803  31.550
  149    HB2  LEU  23           HB2      LEU  23  19.379  29.695  31.062
  150    HB3  LEU  23           HB3      LEU  23  17.915  29.321  31.970
  151    HG   LEU  23           HG       LEU  23  19.121  28.287  33.752
  152   HD11  LEU  23          HD11      LEU  23  20.883  27.031  32.631
  153   HD12  LEU  23          HD12      LEU  23  21.652  28.537  32.070
  154   HD13  LEU  23          HD13      LEU  23  21.610  28.129  33.794
  155   HD21  LEU  23          HD21      LEU  23  19.140  30.785  33.669
  156   HD22  LEU  23          HD22      LEU  23  20.526  30.112  34.535
  157   HD23  LEU  23          HD23      LEU  23  20.727  30.728  32.877
  158    H    LYS  24           H        LYS  24  17.471  28.824  28.981
  159    HA   LYS  24           HA       LYS  24  14.814  27.876  29.550
  160    HB2  LYS  24           HB2      LYS  24  16.048  29.189  27.096
  161    HB3  LYS  24           HB3      LYS  24  14.314  28.801  27.246
  162    HG2  LYS  24           HG2      LYS  24  14.200  30.153  29.310
  163    HG3  LYS  24           HG3      LYS  24  15.895  30.613  29.100
  164    HD2  LYS  24           HD2      LYS  24  15.405  31.758  27.009
  165    HD3  LYS  24           HD3      LYS  24  13.748  31.118  27.004
  166    HE2  LYS  24           HE2      LYS  24  13.722  33.444  27.671
  167    HE3  LYS  24           HE3      LYS  24  13.172  32.421  28.995
  168    HZ1  LYS  24           HZ1      LYS  24  14.790  34.235  29.570
  169    HZ2  LYS  24           HZ2      LYS  24  15.233  32.746  30.119
  170    HZ3  LYS  24           HZ3      LYS  24  15.961  33.404  28.813
  171    H    HIS  25           H        HIS  25  17.234  26.522  27.380
  172    HA   HIS  25           HA       HIS  25  15.289  24.394  26.551
  173    HB2  HIS  25           HB2      HIS  25  17.353  25.871  24.876
  174    HB3  HIS  25           HB3      HIS  25  16.295  24.597  24.304
  175    HD2  HIS  25           HD2      HIS  25  16.327  28.316  25.037
  176    HE1  HIS  25           HE1      HIS  25  12.373  27.428  23.732
  177    HE2  HIS  25           HE2      HIS  25  14.000  29.314  24.300
  178    H    CYS  26           H        CYS  26  18.073  24.525  28.324
  179    HA   CYS  26           HA       CYS  26  19.754  23.188  28.815
  180    HB2  CYS  26           HB2      CYS  26  17.665  21.758  29.226
  181    HB3  CYS  26           HB3      CYS  26  18.259  20.776  27.880
  182    H    LYS  27           H        LYS  27  19.535  23.988  25.855
  183    HA   LYS  27           HA       LYS  27  22.036  22.656  25.003
  184    HB2  LYS  27           HB2      LYS  27  21.261  22.592  22.690
  185    HB3  LYS  27           HB3      LYS  27  20.255  21.612  23.731
  186    HG2  LYS  27           HG2      LYS  27  18.636  23.690  23.802
  187    HG3  LYS  27           HG3      LYS  27  19.655  24.341  22.524
  188    HD2  LYS  27           HD2      LYS  27  17.794  23.395  21.437
  189    HD3  LYS  27           HD3      LYS  27  19.134  22.298  21.150
  190    HE2  LYS  27           HE2      LYS  27  17.252  20.936  21.607
  191    HE3  LYS  27           HE3      LYS  27  18.254  20.847  23.053
  192    HZ1  LYS  27           HZ1      LYS  27  16.732  22.364  24.149
  193    HZ2  LYS  27           HZ2      LYS  27  15.868  22.641  22.775
  194    HZ3  LYS  27           HZ3      LYS  27  15.856  21.178  23.512
  195    H    CYS  28           H        CYS  28  23.369  23.976  23.757
  196    HA   CYS  28           HA       CYS  28  23.163  26.786  24.582
  197    HB2  CYS  28           HB2      CYS  28  25.292  25.446  22.892
  198    HB3  CYS  28           HB3      CYS  28  25.357  27.077  23.576
  199    H    ILE  29           H        ILE  29  23.447  28.631  23.155
  200    HA   ILE  29           HA       ILE  29  21.217  28.831  21.527
  201    HB   ILE  29           HB       ILE  29  22.294  30.563  22.860
  202   HG12  ILE  29          HG12      ILE  29  21.859  31.595  20.053
  203   HG13  ILE  29          HG13      ILE  29  20.556  31.125  21.169
  204   HG21  ILE  29          HG21      ILE  29  24.197  31.830  22.119
  205   HG22  ILE  29          HG22      ILE  29  24.632  30.124  22.051
  206   HG23  ILE  29          HG23      ILE  29  24.227  30.989  20.553
  207   HD11  ILE  29          HD11      ILE  29  21.348  32.804  22.811
  208   HD12  ILE  29          HD12      ILE  29  22.586  33.348  21.649
  209   HD13  ILE  29          HD13      ILE  29  20.872  33.523  21.258
  210    HA   PRO  30           HA       PRO  30  21.782  26.880  17.987
  211    HB2  PRO  30           HB2      PRO  30  20.746  29.177  16.317
  212    HB3  PRO  30           HB3      PRO  30  20.264  27.453  16.274
  213    HG2  PRO  30           HG2      PRO  30  18.743  29.211  17.633
  214    HG3  PRO  30           HG3      PRO  30  19.158  27.643  18.398
  215    HD2  PRO  30           HD2      PRO  30  20.434  30.335  18.828
  216    HD3  PRO  30           HD3      PRO  30  19.921  29.115  20.031
  217    H    ARG  31           H        ARG  31  22.895  26.271  16.207
  218    HA   ARG  31           HA       ARG  31  24.989  28.020  15.055
  219    HB2  ARG  31           HB2      ARG  31  26.720  26.366  15.369
  220    HB3  ARG  31           HB3      ARG  31  26.062  26.881  16.916
  221    HG2  ARG  31           HG2      ARG  31  24.783  24.789  17.121
  222    HG3  ARG  31           HG3      ARG  31  25.319  24.269  15.507
  223    HD2  ARG  31           HD2      ARG  31  27.648  24.246  16.237
  224    HD3  ARG  31           HD3      ARG  31  27.192  24.860  17.838
  225    HE   ARG  31           HE       ARG  31  25.719  22.597  17.764
  226   HH11  ARG  31          HH11      ARG  31  29.179  22.950  17.012
  227   HH12  ARG  31          HH12      ARG  31  29.436  21.300  17.541
  228   HH21  ARG  31          HH21      ARG  31  26.249  20.598  18.343
  229   HH22  ARG  31          HH22      ARG  31  27.940  20.080  18.287
  Start of MODEL   18
    1    H1   GLY   1           H1       GLY   1  15.182  21.905  39.023
    2    H2   GLY   1           H2       GLY   1  16.093  23.233  39.370
    3    H3   GLY   1           H3       GLY   1  16.184  22.515  37.888
    4    HA2  GLY   1           HA2      GLY   1  13.964  23.147  37.329
    5    HA3  GLY   1           HA3      GLY   1  13.753  23.793  38.972
    6    H    SER   2           H        SER   2  13.149  25.752  37.488
    7    HA   SER   2           HA       SER   2  13.636  27.795  36.622
    8    HB2  SER   2           HB2      SER   2  15.920  27.695  38.605
    9    HB3  SER   2           HB3      SER   2  15.112  29.146  37.977
   10    HG   SER   2           HG       SER   2  13.269  28.599  39.040
   11    H    GLY   3           H        GLY   3  14.584  25.895  34.905
   12    HA2  GLY   3           HA2      GLY   3  15.934  26.091  32.900
   13    HA3  GLY   3           HA3      GLY   3  17.240  26.805  33.855
   14    H    CYS   4           H        CYS   4  18.269  24.888  32.526
   15    HA   CYS   4           HA       CYS   4  17.643  22.232  33.342
   16    HB2  CYS   4           HB2      CYS   4  18.623  23.081  31.159
   17    HB3  CYS   4           HB3      CYS   4  20.190  23.123  31.945
   18    H    MET   5           H        MET   5  20.905  23.577  33.677
   19    HA   MET   5           HA       MET   5  20.907  23.592  36.561
   20    HB2  MET   5           HB2      MET   5  22.659  21.613  35.058
   21    HB3  MET   5           HB3      MET   5  23.152  22.322  36.599
   22    HG2  MET   5           HG2      MET   5  20.949  21.444  37.552
   23    HG3  MET   5           HG3      MET   5  20.758  20.559  36.030
   24    HE1  MET   5           HE1      MET   5  23.847  21.235  38.500
   25    HE2  MET   5           HE2      MET   5  22.463  20.724  39.497
   26    HE3  MET   5           HE3      MET   5  23.879  19.661  39.323
   27    H    LYS   6           H        LYS   6  22.143  25.329  37.150
   28    HA   LYS   6           HA       LYS   6  23.042  27.160  35.068
   29    HB2  LYS   6           HB2      LYS   6  23.151  27.213  38.110
   30    HB3  LYS   6           HB3      LYS   6  23.706  28.547  37.095
   31    HG2  LYS   6           HG2      LYS   6  21.527  28.907  36.159
   32    HG3  LYS   6           HG3      LYS   6  20.870  27.451  36.905
   33    HD2  LYS   6           HD2      LYS   6  21.952  29.811  38.491
   34    HD3  LYS   6           HD3      LYS   6  20.263  29.661  38.032
   35    HE2  LYS   6           HE2      LYS   6  21.742  27.539  39.646
   36    HE3  LYS   6           HE3      LYS   6  20.895  28.896  40.393
   37    HZ1  LYS   6           HZ1      LYS   6  19.581  26.900  38.629
   38    HZ2  LYS   6           HZ2      LYS   6  19.484  26.938  40.276
   39    HZ3  LYS   6           HZ3      LYS   6  18.857  28.157  39.374
   40    H    GLU   7           H        GLU   7  24.719  25.093  37.407
   41    HA   GLU   7           HA       GLU   7  27.405  26.072  36.801
   42    HB2  GLU   7           HB2      GLU   7  26.275  23.606  38.165
   43    HB3  GLU   7           HB3      GLU   7  27.982  23.708  37.771
   44    HG2  GLU   7           HG2      GLU   7  27.691  24.401  40.051
   45    HG3  GLU   7           HG3      GLU   7  28.244  25.758  39.093
   46    H    TYR   8           H        TYR   8  25.597  23.165  35.752
   47    HA   TYR   8           HA       TYR   8  27.350  22.172  33.823
   48    HB2  TYR   8           HB2      TYR   8  25.315  21.025  34.569
   49    HB3  TYR   8           HB3      TYR   8  24.323  22.303  33.875
   50    HD1  TYR   8           HD1      TYR   8  26.879  19.760  32.899
   51    HD2  TYR   8           HD2      TYR   8  23.447  22.081  31.718
   52    HE1  TYR   8           HE1      TYR   8  26.811  18.552  30.701
   53    HE2  TYR   8           HE2      TYR   8  23.355  20.853  29.552
   54    HH   TYR   8           HH       TYR   8  24.261  19.224  28.279
   55    H    CYS   9           H        CYS   9  24.652  24.527  33.255
   56    HA   CYS   9           HA       CYS   9  25.231  24.976  30.528
   57    HB2  CYS   9           HB2      CYS   9  23.747  26.550  32.641
   58    HB3  CYS   9           HB3      CYS   9  23.959  27.193  31.021
   59    H    ALA  10           H        ALA  10  26.702  26.613  33.383
   60    HA   ALA  10           HA       ALA  10  28.050  28.601  31.796
   61    HB1  ALA  10           HB1      ALA  10  29.384  28.942  33.838
   62    HB2  ALA  10           HB2      ALA  10  27.655  28.817  34.216
   63    HB3  ALA  10           HB3      ALA  10  28.736  27.441  34.532
   64    H    GLY  11           H        GLY  11  28.902  25.241  32.605
   65    HA2  GLY  11           HA2      GLY  11  31.614  25.421  31.489
   66    HA3  GLY  11           HA3      GLY  11  30.760  23.966  32.005
   67    H    GLN  12           H        GLN  12  28.414  24.573  30.240
   68    HA   GLN  12           HA       GLN  12  29.483  23.523  27.695
   69    HB2  GLN  12           HB2      GLN  12  26.656  24.284  28.541
   70    HB3  GLN  12           HB3      GLN  12  27.096  23.530  27.010
   71    HG2  GLN  12           HG2      GLN  12  27.350  22.289  29.773
   72    HG3  GLN  12           HG3      GLN  12  26.183  21.882  28.526
   73   HE21  GLN  12          HE22      GLN  12  29.022  20.833  29.920
   74   HE22  GLN  12          HE21      GLN  12  29.575  19.830  28.577
   75    H    CYS  13           H        CYS  13  27.884  26.535  28.816
   76    HA   CYS  13           HA       CYS  13  28.207  27.728  26.107
   77    HB2  CYS  13           HB2      CYS  13  25.887  28.031  28.034
   78    HB3  CYS  13           HB3      CYS  13  25.957  28.540  26.360
   79    H    ARG  14           H        ARG  14  28.490  29.963  25.952
   80    HA   ARG  14           HA       ARG  14  29.173  31.409  28.488
   81    HB2  ARG  14           HB2      ARG  14  30.861  31.434  25.997
   82    HB3  ARG  14           HB3      ARG  14  31.253  32.123  27.563
   83    HG2  ARG  14           HG2      ARG  14  31.097  29.140  26.903
   84    HG3  ARG  14           HG3      ARG  14  32.569  30.069  27.036
   85    HD2  ARG  14           HD2      ARG  14  30.639  29.568  29.332
   86    HD3  ARG  14           HD3      ARG  14  32.126  28.673  29.023
   87    HE   ARG  14           HE       ARG  14  32.808  31.422  29.177
   88   HH11  ARG  14          HH11      ARG  14  31.545  28.994  31.395
   89   HH12  ARG  14          HH12      ARG  14  32.320  29.753  32.767
   90   HH21  ARG  14          HH21      ARG  14  33.585  32.367  30.882
   91   HH22  ARG  14          HH22      ARG  14  33.190  31.804  32.509
   92    H    GLY  15           H        GLY  15  29.357  33.608  28.403
   93    HA2  GLY  15           HA2      GLY  15  28.495  35.709  27.895
   94    HA3  GLY  15           HA3      GLY  15  27.944  35.154  26.313
   95    H    LYS  16           H        LYS  16  26.487  36.685  28.214
   96    HA   LYS  16           HA       LYS  16  24.730  35.281  29.954
   97    HB2  LYS  16           HB2      LYS  16  25.198  37.696  30.042
   98    HB3  LYS  16           HB3      LYS  16  24.447  37.931  28.467
   99    HG2  LYS  16           HG2      LYS  16  23.004  38.684  30.244
  100    HG3  LYS  16           HG3      LYS  16  22.247  37.342  29.387
  101    HD2  LYS  16           HD2      LYS  16  22.736  35.811  31.232
  102    HD3  LYS  16           HD3      LYS  16  23.751  37.045  32.022
  103    HE2  LYS  16           HE2      LYS  16  21.767  38.542  32.177
  104    HE3  LYS  16           HE3      LYS  16  20.749  37.268  31.495
  105    HZ1  LYS  16           HZ1      LYS  16  22.340  36.855  33.959
  106    HZ2  LYS  16           HZ2      LYS  16  20.825  37.517  33.984
  107    HZ3  LYS  16           HZ3      LYS  16  21.031  35.982  33.443
  108    H    VAL  17           H        VAL  17  24.353  36.042  26.473
  109    HA   VAL  17           HA       VAL  17  21.576  35.196  26.518
  110    HB   VAL  17           HB       VAL  17  22.500  36.962  25.039
  111   HG11  VAL  17          HG11      VAL  17  23.370  34.664  23.230
  112   HG12  VAL  17          HG12      VAL  17  23.389  36.395  22.859
  113   HG13  VAL  17          HG13      VAL  17  24.467  35.758  24.102
  114   HG21  VAL  17          HG21      VAL  17  20.917  34.776  23.672
  115   HG22  VAL  17          HG22      VAL  17  20.251  35.993  24.784
  116   HG23  VAL  17          HG23      VAL  17  20.952  36.495  23.233
  117    H    SER  18           H        SER  18  24.580  33.550  25.535
  118    HA   SER  18           HA       SER  18  23.206  31.167  24.582
  119    HB2  SER  18           HB2      SER  18  25.583  31.862  24.006
  120    HB3  SER  18           HB3      SER  18  26.033  31.325  25.639
  121    HG   SER  18           HG       SER  18  26.360  29.684  24.212
  122    H    GLN  19           H        GLN  19  24.822  32.036  27.735
  123    HA   GLN  19           HA       GLN  19  23.899  29.720  29.129
  124    HB2  GLN  19           HB2      GLN  19  24.480  32.551  30.070
  125    HB3  GLN  19           HB3      GLN  19  24.077  31.216  31.172
  126    HG2  GLN  19           HG2      GLN  19  25.955  29.884  30.363
  127    HG3  GLN  19           HG3      GLN  19  26.346  31.087  29.137
  128   HE21  GLN  19          HE22      GLN  19  28.425  30.490  30.401
  129   HE22  GLN  19          HE21      GLN  19  28.856  31.744  31.586
  130    H    ASP  20           H        ASP  20  22.087  32.814  28.616
  131    HA   ASP  20           HA       ASP  20  19.747  32.072  30.049
  132    HB2  ASP  20           HB2      ASP  20  20.061  34.331  29.472
  133    HB3  ASP  20           HB3      ASP  20  20.302  33.967  27.761
  134    H    TYR  21           H        TYR  21  20.573  31.533  26.579
  135    HA   TYR  21           HA       TYR  21  18.191  30.118  25.899
  136    HB2  TYR  21           HB2      TYR  21  20.111  30.967  24.411
  137    HB3  TYR  21           HB3      TYR  21  20.952  29.482  24.811
  138    HD1  TYR  21           HD2      TYR  21  19.954  27.239  23.977
  139    HD2  TYR  21           HD1      TYR  21  18.253  31.080  22.968
  140    HE1  TYR  21           HE2      TYR  21  18.596  26.186  22.181
  141    HE2  TYR  21           HE1      TYR  21  16.934  30.017  21.158
  142    HH   TYR  21           HH       TYR  21  16.609  28.124  19.940
  143    H    CYS  22           H        CYS  22  21.278  28.895  27.275
  144    HA   CYS  22           HA       CYS  22  20.490  26.125  27.327
  145    HB2  CYS  22           HB2      CYS  22  22.801  27.001  27.412
  146    HB3  CYS  22           HB3      CYS  22  22.523  27.600  29.044
  147    H    LEU  23           H        LEU  23  19.810  28.774  29.509
  148    HA   LEU  23           HA       LEU  23  18.587  27.108  31.565
  149    HB2  LEU  23           HB2      LEU  23  19.231  29.949  31.000
  150    HB3  LEU  23           HB3      LEU  23  17.749  29.710  31.909
  151    HG   LEU  23           HG       LEU  23  18.889  28.560  33.691
  152   HD11  LEU  23          HD11      LEU  23  21.352  28.266  33.751
  153   HD12  LEU  23          HD12      LEU  23  20.612  27.268  32.496
  154   HD13  LEU  23          HD13      LEU  23  21.451  28.767  32.054
  155   HD21  LEU  23          HD21      LEU  23  18.964  31.048  33.631
  156   HD22  LEU  23          HD22      LEU  23  20.354  30.351  34.487
  157   HD23  LEU  23          HD23      LEU  23  20.538  30.968  32.825
  158    H    LYS  24           H        LYS  24  17.448  27.889  28.503
  159    HA   LYS  24           HA       LYS  24  14.620  27.276  29.370
  160    HB2  LYS  24           HB2      LYS  24  15.686  29.018  27.111
  161    HB3  LYS  24           HB3      LYS  24  14.005  28.449  27.171
  162    HG2  LYS  24           HG2      LYS  24  13.668  29.509  29.326
  163    HG3  LYS  24           HG3      LYS  24  15.356  30.016  29.393
  164    HD2  LYS  24           HD2      LYS  24  13.458  30.956  27.208
  165    HD3  LYS  24           HD3      LYS  24  13.701  31.800  28.751
  166    HE2  LYS  24           HE2      LYS  24  16.177  31.832  28.284
  167    HE3  LYS  24           HE3      LYS  24  15.851  31.213  26.665
  168    HZ1  LYS  24           HZ1      LYS  24  14.700  33.195  26.135
  169    HZ2  LYS  24           HZ2      LYS  24  14.678  33.731  27.699
  170    HZ3  LYS  24           HZ3      LYS  24  16.103  33.639  26.871
  171    H    HIS  25           H        HIS  25  17.249  26.313  27.451
  172    HA   HIS  25           HA       HIS  25  15.665  24.140  26.098
  173    HB2  HIS  25           HB2      HIS  25  17.765  25.928  24.835
  174    HB3  HIS  25           HB3      HIS  25  16.905  24.621  24.037
  175    HD2  HIS  25           HD2      HIS  25  16.435  28.258  25.169
  176    HE1  HIS  25           HE1      HIS  25  13.091  27.277  22.726
  177    HE2  HIS  25           HE2      HIS  25  14.328  29.175  23.882
  178    H    CYS  26           H        CYS  26  18.123  24.463  28.282
  179    HA   CYS  26           HA       CYS  26  20.070  23.452  28.751
  180    HB2  CYS  26           HB2      CYS  26  18.142  21.874  29.271
  181    HB3  CYS  26           HB3      CYS  26  18.730  20.899  27.924
  182    H    LYS  27           H        LYS  27  20.319  24.450  26.092
  183    HA   LYS  27           HA       LYS  27  22.797  23.040  25.387
  184    HB2  LYS  27           HB2      LYS  27  22.222  22.976  22.981
  185    HB3  LYS  27           HB3      LYS  27  21.187  21.932  23.948
  186    HG2  LYS  27           HG2      LYS  27  19.439  23.832  23.905
  187    HG3  LYS  27           HG3      LYS  27  20.506  24.680  22.802
  188    HD2  LYS  27           HD2      LYS  27  18.715  23.547  21.635
  189    HD3  LYS  27           HD3      LYS  27  20.299  22.940  21.160
  190    HE2  LYS  27           HE2      LYS  27  18.811  21.064  21.284
  191    HE3  LYS  27           HE3      LYS  27  19.966  20.930  22.609
  192    HZ1  LYS  27           HZ1      LYS  27  17.191  21.958  22.846
  193    HZ2  LYS  27           HZ2      LYS  27  17.671  20.482  23.339
  194    HZ3  LYS  27           HZ3      LYS  27  18.213  21.825  24.103
  195    H    CYS  28           H        CYS  28  24.099  24.362  23.844
  196    HA   CYS  28           HA       CYS  28  23.892  27.192  24.555
  197    HB2  CYS  28           HB2      CYS  28  25.794  25.914  22.581
  198    HB3  CYS  28           HB3      CYS  28  25.956  27.470  23.387
  199    H    ILE  29           H        ILE  29  23.624  28.960  23.189
  200    HA   ILE  29           HA       ILE  29  21.289  28.735  21.714
  201    HB   ILE  29           HB       ILE  29  21.994  30.686  22.916
  202   HG12  ILE  29          HG12      ILE  29  21.469  31.476  20.040
  203   HG13  ILE  29          HG13      ILE  29  20.255  30.769  21.110
  204   HG21  ILE  29          HG21      ILE  29  23.834  31.440  20.618
  205   HG22  ILE  29          HG22      ILE  29  23.611  32.279  22.168
  206   HG23  ILE  29          HG23      ILE  29  24.408  30.706  22.121
  207   HD11  ILE  29          HD11      ILE  29  19.976  33.152  21.139
  208   HD12  ILE  29          HD12      ILE  29  20.594  32.635  22.721
  209   HD13  ILE  29          HD13      ILE  29  21.682  33.414  21.543
  210    HA   PRO  30           HA       PRO  30  22.544  27.510  17.651
  211    HB2  PRO  30           HB2      PRO  30  20.087  29.033  16.779
  212    HB3  PRO  30           HB3      PRO  30  20.655  27.421  16.248
  213    HG2  PRO  30           HG2      PRO  30  18.699  27.599  18.096
  214    HG3  PRO  30           HG3      PRO  30  20.053  26.455  18.381
  215    HD2  PRO  30           HD2      PRO  30  19.690  29.250  19.494
  216    HD3  PRO  30           HD3      PRO  30  20.165  27.738  20.330
  217    H    ARG  31           H        ARG  31  23.397  28.222  15.688
  218    HA   ARG  31           HA       ARG  31  23.432  31.100  14.999
  219    HB2  ARG  31           HB2      ARG  31  25.799  31.184  14.679
  220    HB3  ARG  31           HB3      ARG  31  25.432  30.749  16.345
  221    HG2  ARG  31           HG2      ARG  31  25.875  28.325  15.737
  222    HG3  ARG  31           HG3      ARG  31  26.430  28.874  14.148
  223    HD2  ARG  31           HD2      ARG  31  27.571  29.733  16.842
  224    HD3  ARG  31           HD3      ARG  31  28.258  28.483  15.786
  225    HE   ARG  31           HE       ARG  31  27.937  31.089  14.479
  226   HH11  ARG  31          HH11      ARG  31  30.123  29.418  16.657
  227   HH12  ARG  31          HH12      ARG  31  31.509  30.296  16.039
  228   HH21  ARG  31          HH21      ARG  31  29.600  32.201  13.892
  229   HH22  ARG  31          HH22      ARG  31  31.174  31.997  14.658
  Start of MODEL   19
    1    H1   GLY   1           H1       GLY   1  18.637  23.144  37.766
    2    H2   GLY   1           H2       GLY   1  17.103  23.547  38.157
    3    H3   GLY   1           H3       GLY   1  18.095  22.890  39.300
    4    HA2  GLY   1           HA2      GLY   1  17.864  25.257  39.676
    5    HA3  GLY   1           HA3      GLY   1  19.530  24.818  39.238
    6    H    SER   2           H        SER   2  16.479  26.126  37.997
    7    HA   SER   2           HA       SER   2  15.852  27.244  36.243
    8    HB2  SER   2           HB2      SER   2  17.210  29.064  35.319
    9    HB3  SER   2           HB3      SER   2  17.048  29.071  37.076
   10    HG   SER   2           HG       SER   2  19.213  27.651  36.408
   11    H    GLY   3           H        GLY   3  15.218  26.255  34.504
   12    HA2  GLY   3           HA2      GLY   3  15.255  25.324  32.377
   13    HA3  GLY   3           HA3      GLY   3  16.959  25.810  32.242
   14    H    CYS   4           H        CYS   4  18.506  24.472  33.323
   15    HA   CYS   4           HA       CYS   4  17.739  21.717  34.047
   16    HB2  CYS   4           HB2      CYS   4  19.536  22.450  31.782
   17    HB3  CYS   4           HB3      CYS   4  20.138  21.215  32.870
   18    H    MET   5           H        MET   5  20.993  23.296  33.862
   19    HA   MET   5           HA       MET   5  20.909  23.873  36.732
   20    HB2  MET   5           HB2      MET   5  22.908  21.898  35.567
   21    HB3  MET   5           HB3      MET   5  23.115  22.727  37.110
   22    HG2  MET   5           HG2      MET   5  21.013  21.666  37.931
   23    HG3  MET   5           HG3      MET   5  20.869  20.816  36.385
   24    HE1  MET   5           HE1      MET   5  22.644  21.050  39.813
   25    HE2  MET   5           HE2      MET   5  24.004  19.918  39.654
   26    HE3  MET   5           HE3      MET   5  24.040  21.469  38.792
   27    H    LYS   6           H        LYS   6  22.112  25.586  37.241
   28    HA   LYS   6           HA       LYS   6  23.120  27.401  35.285
   29    HB2  LYS   6           HB2      LYS   6  23.856  27.209  38.239
   30    HB3  LYS   6           HB3      LYS   6  24.064  28.621  37.197
   31    HG2  LYS   6           HG2      LYS   6  21.544  28.626  36.874
   32    HG3  LYS   6           HG3      LYS   6  21.441  27.394  38.144
   33    HD2  LYS   6           HD2      LYS   6  22.574  30.199  38.419
   34    HD3  LYS   6           HD3      LYS   6  21.017  29.639  39.036
   35    HE2  LYS   6           HE2      LYS   6  22.087  28.142  40.624
   36    HE3  LYS   6           HE3      LYS   6  23.687  28.481  39.946
   37    HZ1  LYS   6           HZ1      LYS   6  23.454  30.777  40.618
   38    HZ2  LYS   6           HZ2      LYS   6  21.959  30.511  41.266
   39    HZ3  LYS   6           HZ3      LYS   6  23.266  29.824  41.950
   40    H    GLU   7           H        GLU   7  24.858  25.122  37.390
   41    HA   GLU   7           HA       GLU   7  27.508  25.934  36.606
   42    HB2  GLU   7           HB2      GLU   7  26.537  23.307  37.817
   43    HB3  GLU   7           HB3      GLU   7  28.206  23.832  37.698
   44    HG2  GLU   7           HG2      GLU   7  27.529  24.285  39.934
   45    HG3  GLU   7           HG3      GLU   7  27.686  25.836  39.111
   46    H    TYR   8           H        TYR   8  25.409  23.280  35.515
   47    HA   TYR   8           HA       TYR   8  27.185  22.055  33.655
   48    HB2  TYR   8           HB2      TYR   8  25.150  20.981  34.490
   49    HB3  TYR   8           HB3      TYR   8  24.159  22.243  33.785
   50    HD1  TYR   8           HD1      TYR   8  26.628  19.598  32.828
   51    HD2  TYR   8           HD2      TYR   8  23.178  21.926  31.689
   52    HE1  TYR   8           HE1      TYR   8  26.399  18.232  30.740
   53    HE2  TYR   8           HE2      TYR   8  22.916  20.531  29.623
   54    HH   TYR   8           HH       TYR   8  25.266  18.003  28.719
   55    H    CYS   9           H        CYS   9  24.587  24.517  33.155
   56    HA   CYS   9           HA       CYS   9  25.077  24.933  30.387
   57    HB2  CYS   9           HB2      CYS   9  23.716  26.521  32.575
   58    HB3  CYS   9           HB3      CYS   9  23.842  27.143  30.939
   59    H    ALA  10           H        ALA  10  26.566  26.532  33.237
   60    HA   ALA  10           HA       ALA  10  28.006  28.487  31.728
   61    HB1  ALA  10           HB1      ALA  10  28.409  27.287  34.498
   62    HB2  ALA  10           HB2      ALA  10  29.290  28.698  33.885
   63    HB3  ALA  10           HB3      ALA  10  27.529  28.775  34.079
   64    H    GLY  11           H        GLY  11  28.657  25.086  32.212
   65    HA2  GLY  11           HA2      GLY  11  31.430  25.221  31.165
   66    HA3  GLY  11           HA3      GLY  11  30.503  23.780  31.586
   67    H    GLN  12           H        GLN  12  28.148  24.361  30.024
   68    HA   GLN  12           HA       GLN  12  28.944  23.467  27.397
   69    HB2  GLN  12           HB2      GLN  12  26.327  24.499  28.553
   70    HB3  GLN  12           HB3      GLN  12  26.463  23.899  26.909
   71    HG2  GLN  12           HG2      GLN  12  27.302  22.139  29.239
   72    HG3  GLN  12           HG3      GLN  12  25.612  22.319  28.784
   73   HE21  GLN  12          HE22      GLN  12  25.060  20.394  27.706
   74   HE22  GLN  12          HE21      GLN  12  25.972  19.788  26.339
   75    H    CYS  13           H        CYS  13  28.017  26.688  28.650
   76    HA   CYS  13           HA       CYS  13  28.442  27.916  25.962
   77    HB2  CYS  13           HB2      CYS  13  26.023  26.939  26.920
   78    HB3  CYS  13           HB3      CYS  13  25.962  28.599  27.460
   79    H    ARG  14           H        ARG  14  28.750  30.198  25.933
   80    HA   ARG  14           HA       ARG  14  28.782  31.655  28.537
   81    HB2  ARG  14           HB2      ARG  14  31.018  32.519  28.093
   82    HB3  ARG  14           HB3      ARG  14  30.975  30.785  28.421
   83    HG2  ARG  14           HG2      ARG  14  31.302  30.253  26.055
   84    HG3  ARG  14           HG3      ARG  14  31.091  31.948  25.603
   85    HD2  ARG  14           HD2      ARG  14  33.392  31.586  25.458
   86    HD3  ARG  14           HD3      ARG  14  33.157  32.493  26.939
   87    HE   ARG  14           HE       ARG  14  33.833  30.623  28.230
   88   HH11  ARG  14          HH11      ARG  14  33.418  29.425  24.939
   89   HH12  ARG  14          HH12      ARG  14  34.740  28.294  25.120
   90   HH21  ARG  14          HH21      ARG  14  35.542  29.273  28.311
   91   HH22  ARG  14          HH22      ARG  14  35.782  28.066  27.055
   92    H    GLY  15           H        GLY  15  28.897  33.842  28.514
   93    HA2  GLY  15           HA2      GLY  15  28.238  35.986  27.598
   94    HA3  GLY  15           HA3      GLY  15  27.652  35.183  26.137
   95    H    LYS  16           H        LYS  16  26.168  36.927  28.091
   96    HA   LYS  16           HA       LYS  16  24.701  35.324  29.982
   97    HB2  LYS  16           HB2      LYS  16  24.061  38.057  28.780
   98    HB3  LYS  16           HB3      LYS  16  23.241  37.349  30.158
   99    HG2  LYS  16           HG2      LYS  16  26.152  38.212  30.029
  100    HG3  LYS  16           HG3      LYS  16  24.847  39.001  30.904
  101    HD2  LYS  16           HD2      LYS  16  26.036  36.267  31.520
  102    HD3  LYS  16           HD3      LYS  16  26.318  37.763  32.392
  103    HE2  LYS  16           HE2      LYS  16  23.832  37.858  32.909
  104    HE3  LYS  16           HE3      LYS  16  23.691  36.237  32.214
  105    HZ1  LYS  16           HZ1      LYS  16  23.987  36.024  34.561
  106    HZ2  LYS  16           HZ2      LYS  16  25.406  35.535  33.864
  107    HZ3  LYS  16           HZ3      LYS  16  25.329  37.010  34.561
  108    H    VAL  17           H        VAL  17  23.996  36.209  26.635
  109    HA   VAL  17           HA       VAL  17  21.246  35.180  26.753
  110    HB   VAL  17           HB       VAL  17  22.832  35.887  24.274
  111   HG11  VAL  17          HG11      VAL  17  20.761  34.623  23.820
  112   HG12  VAL  17          HG12      VAL  17  19.839  35.766  24.825
  113   HG13  VAL  17          HG13      VAL  17  20.591  36.304  23.310
  114   HG21  VAL  17          HG21      VAL  17  22.857  37.845  25.710
  115   HG22  VAL  17          HG22      VAL  17  21.715  38.095  24.388
  116   HG23  VAL  17          HG23      VAL  17  21.116  37.674  26.009
  117    H    SER  18           H        SER  18  24.456  33.999  25.602
  118    HA   SER  18           HA       SER  18  23.588  31.555  24.498
  119    HB2  SER  18           HB2      SER  18  26.142  31.931  26.072
  120    HB3  SER  18           HB3      SER  18  25.860  30.966  24.631
  121    HG   SER  18           HG       SER  18  27.044  33.019  24.499
  122    H    GLN  19           H        GLN  19  24.729  32.293  27.881
  123    HA   GLN  19           HA       GLN  19  23.862  29.771  28.943
  124    HB2  GLN  19           HB2      GLN  19  24.405  32.487  30.175
  125    HB3  GLN  19           HB3      GLN  19  23.923  31.074  31.148
  126    HG2  GLN  19           HG2      GLN  19  25.807  29.773  30.332
  127    HG3  GLN  19           HG3      GLN  19  26.265  31.041  29.196
  128   HE21  GLN  19          HE22      GLN  19  28.289  30.415  30.412
  129   HE22  GLN  19          HE21      GLN  19  28.695  31.501  31.738
  130    H    ASP  20           H        ASP  20  21.974  32.854  28.613
  131    HA   ASP  20           HA       ASP  20  19.662  31.923  29.974
  132    HB2  ASP  20           HB2      ASP  20  20.020  34.268  29.274
  133    HB3  ASP  20           HB3      ASP  20  19.767  33.797  27.586
  134    H    TYR  21           H        TYR  21  20.624  31.493  26.520
  135    HA   TYR  21           HA       TYR  21  18.342  30.037  25.677
  136    HB2  TYR  21           HB2      TYR  21  20.335  30.964  24.332
  137    HB3  TYR  21           HB3      TYR  21  21.181  29.492  24.760
  138    HD1  TYR  21           HD1      TYR  21  20.219  27.241  23.927
  139    HD2  TYR  21           HD2      TYR  21  18.707  31.070  22.630
  140    HE1  TYR  21           HE1      TYR  21  19.014  26.130  22.051
  141    HE2  TYR  21           HE2      TYR  21  17.539  29.958  20.723
  142    HH   TYR  21           HH       TYR  21  17.498  26.407  20.319
  143    H    CYS  22           H        CYS  22  21.249  28.859  27.422
  144    HA   CYS  22           HA       CYS  22  20.361  26.065  27.352
  145    HB2  CYS  22           HB2      CYS  22  22.721  26.809  27.440
  146    HB3  CYS  22           HB3      CYS  22  22.458  27.448  29.062
  147    H    LEU  23           H        LEU  23  19.946  28.761  29.596
  148    HA   LEU  23           HA       LEU  23  18.473  27.220  31.566
  149    HB2  LEU  23           HB2      LEU  23  19.266  30.040  31.029
  150    HB3  LEU  23           HB3      LEU  23  17.768  29.834  31.900
  151    HG   LEU  23           HG       LEU  23  18.869  28.493  33.613
  152   HD11  LEU  23          HD11      LEU  23  21.466  28.961  32.083
  153   HD12  LEU  23          HD12      LEU  23  21.337  28.294  33.724
  154   HD13  LEU  23          HD13      LEU  23  20.675  27.390  32.365
  155   HD21  LEU  23          HD21      LEU  23  20.343  31.060  32.975
  156   HD22  LEU  23          HD22      LEU  23  18.793  30.903  33.844
  157   HD23  LEU  23          HD23      LEU  23  20.280  30.260  34.568
  158    H    LYS  24           H        LYS  24  17.561  28.565  28.489
  159    HA   LYS  24           HA       LYS  24  14.665  28.081  28.974
  160    HB2  LYS  24           HB2      LYS  24  16.224  28.902  26.494
  161    HB3  LYS  24           HB3      LYS  24  14.482  28.691  26.552
  162    HG2  LYS  24           HG2      LYS  24  16.064  30.770  28.108
  163    HG3  LYS  24           HG3      LYS  24  15.133  31.041  26.649
  164    HD2  LYS  24           HD2      LYS  24  13.088  30.243  27.970
  165    HD3  LYS  24           HD3      LYS  24  14.109  30.314  29.419
  166    HE2  LYS  24           HE2      LYS  24  13.479  32.623  27.529
  167    HE3  LYS  24           HE3      LYS  24  12.753  32.355  29.117
  168    HZ1  LYS  24           HZ1      LYS  24  14.504  33.959  29.247
  169    HZ2  LYS  24           HZ2      LYS  24  14.968  32.636  30.105
  170    HZ3  LYS  24           HZ3      LYS  24  15.638  32.957  28.635
  171    H    HIS  25           H        HIS  25  17.383  26.436  27.467
  172    HA   HIS  25           HA       HIS  25  15.538  24.252  26.521
  173    HB2  HIS  25           HB2      HIS  25  17.811  25.578  25.011
  174    HB3  HIS  25           HB3      HIS  25  16.842  24.235  24.430
  175    HD2  HIS  25           HD2      HIS  25  16.973  27.906  24.297
  176    HE1  HIS  25           HE1      HIS  25  13.084  26.870  22.905
  177    HE2  HIS  25           HE2      HIS  25  14.801  28.736  23.048
  178    H    CYS  26           H        CYS  26  18.160  24.378  28.646
  179    HA   CYS  26           HA       CYS  26  19.692  22.914  29.315
  180    HB2  CYS  26           HB2      CYS  26  17.903  20.855  28.004
  181    HB3  CYS  26           HB3      CYS  26  19.177  20.517  29.164
  182    H    LYS  27           H        LYS  27  19.989  23.997  26.494
  183    HA   LYS  27           HA       LYS  27  22.408  22.466  25.744
  184    HB2  LYS  27           HB2      LYS  27  21.749  22.341  23.391
  185    HB3  LYS  27           HB3      LYS  27  20.611  21.485  24.415
  186    HG2  LYS  27           HG2      LYS  27  19.217  23.722  24.342
  187    HG3  LYS  27           HG3      LYS  27  20.287  24.180  23.028
  188    HD2  LYS  27           HD2      LYS  27  18.192  23.315  22.206
  189    HD3  LYS  27           HD3      LYS  27  19.506  22.233  21.710
  190    HE2  LYS  27           HE2      LYS  27  18.845  20.535  23.202
  191    HE3  LYS  27           HE3      LYS  27  17.992  21.652  24.265
  192    HZ1  LYS  27           HZ1      LYS  27  16.264  21.893  22.638
  193    HZ2  LYS  27           HZ2      LYS  27  17.062  20.979  21.545
  194    HZ3  LYS  27           HZ3      LYS  27  16.462  20.312  22.960
  195    H    CYS  28           H        CYS  28  23.796  23.619  24.310
  196    HA   CYS  28           HA       CYS  28  23.873  26.483  24.942
  197    HB2  CYS  28           HB2      CYS  28  25.894  24.984  24.841
  198    HB3  CYS  28           HB3      CYS  28  25.680  24.935  23.089
  199    H    ILE  29           H        ILE  29  24.290  28.101  23.243
  200    HA   ILE  29           HA       ILE  29  22.009  28.088  21.447
  201    HB   ILE  29           HB       ILE  29  22.585  29.979  22.901
  202   HG12  ILE  29          HG12      ILE  29  22.481  30.747  19.960
  203   HG13  ILE  29          HG13      ILE  29  21.108  30.156  20.900
  204   HG21  ILE  29          HG21      ILE  29  24.339  31.561  22.347
  205   HG22  ILE  29          HG22      ILE  29  25.062  29.970  22.578
  206   HG23  ILE  29          HG23      ILE  29  24.823  30.617  20.936
  207   HD11  ILE  29          HD11      ILE  29  20.967  32.549  20.824
  208   HD12  ILE  29          HD12      ILE  29  21.409  32.096  22.482
  209   HD13  ILE  29          HD13      ILE  29  22.639  32.743  21.371
  210    HA   PRO  30           HA       PRO  30  24.321  27.104  17.675
  211    HB2  PRO  30           HB2      PRO  30  22.062  28.644  16.392
  212    HB3  PRO  30           HB3      PRO  30  22.776  27.080  15.907
  213    HG2  PRO  30           HG2      PRO  30  20.427  27.115  17.224
  214    HG3  PRO  30           HG3      PRO  30  21.688  25.945  17.729
  215    HD2  PRO  30           HD2      PRO  30  21.041  28.644  18.962
  216    HD3  PRO  30           HD3      PRO  30  21.270  27.060  19.763
  217    H    ARG  31           H        ARG  31  25.785  28.142  16.365
  218    HA   ARG  31           HA       ARG  31  25.619  31.055  15.895
  219    HB2  ARG  31           HB2      ARG  31  27.896  31.497  16.514
  220    HB3  ARG  31           HB3      ARG  31  26.996  30.885  17.899
  221    HG2  ARG  31           HG2      ARG  31  28.065  28.646  17.606
  222    HG3  ARG  31           HG3      ARG  31  28.996  29.292  16.235
  223    HD2  ARG  31           HD2      ARG  31  29.940  31.044  17.744
  224    HD3  ARG  31           HD3      ARG  31  29.068  30.336  19.102
  225    HE   ARG  31           HE       ARG  31  31.398  29.153  17.638
  226   HH11  ARG  31          HH11      ARG  31  29.261  28.773  20.455
  227   HH12  ARG  31          HH12      ARG  31  30.522  27.815  21.245
  228   HH21  ARG  31          HH21      ARG  31  32.763  28.000  18.746
  229   HH22  ARG  31          HH22      ARG  31  32.370  27.429  20.382
  Start of MODEL   20
    1    H1   GLY   1           H1       GLY   1  16.930  21.102  38.409
    2    H2   GLY   1           H2       GLY   1  16.334  21.600  36.942
    3    H3   GLY   1           H3       GLY   1  15.474  21.862  38.316
    4    HA2  GLY   1           HA2      GLY   1  17.012  23.425  39.150
    5    HA3  GLY   1           HA3      GLY   1  18.104  23.057  37.794
    6    H    SER   2           H        SER   2  17.646  25.624  37.844
    7    HA   SER   2           HA       SER   2  15.252  26.447  36.385
    8    HB2  SER   2           HB2      SER   2  17.893  27.870  36.849
    9    HB3  SER   2           HB3      SER   2  16.429  28.601  36.160
   10    HG   SER   2           HG       SER   2  16.705  28.875  38.483
   11    H    GLY   3           H        GLY   3  14.876  25.708  34.375
   12    HA2  GLY   3           HA2      GLY   3  15.206  25.113  32.153
   13    HA3  GLY   3           HA3      GLY   3  16.813  25.854  32.214
   14    H    CYS   4           H        CYS   4  18.562  24.647  32.685
   15    HA   CYS   4           HA       CYS   4  18.249  21.840  33.618
   16    HB2  CYS   4           HB2      CYS   4  19.979  22.848  31.395
   17    HB3  CYS   4           HB3      CYS   4  20.709  21.727  32.544
   18    H    MET   5           H        MET   5  21.352  23.530  33.593
   19    HA   MET   5           HA       MET   5  20.900  24.832  36.143
   20    HB2  MET   5           HB2      MET   5  23.036  22.664  35.906
   21    HB3  MET   5           HB3      MET   5  23.013  23.908  37.150
   22    HG2  MET   5           HG2      MET   5  20.724  23.053  37.834
   23    HG3  MET   5           HG3      MET   5  21.049  21.650  36.796
   24    HE1  MET   5           HE1      MET   5  24.308  21.320  37.298
   25    HE2  MET   5           HE2      MET   5  24.261  20.117  38.592
   26    HE3  MET   5           HE3      MET   5  23.151  19.971  37.210
   27    H    LYS   6           H        LYS   6  22.230  26.596  36.382
   28    HA   LYS   6           HA       LYS   6  23.939  27.614  34.298
   29    HB2  LYS   6           HB2      LYS   6  23.801  28.217  37.288
   30    HB3  LYS   6           HB3      LYS   6  24.802  29.116  36.143
   31    HG2  LYS   6           HG2      LYS   6  22.796  29.781  34.870
   32    HG3  LYS   6           HG3      LYS   6  21.769  28.866  35.992
   33    HD2  LYS   6           HD2      LYS   6  22.416  30.329  37.848
   34    HD3  LYS   6           HD3      LYS   6  23.519  31.239  36.789
   35    HE2  LYS   6           HE2      LYS   6  21.646  31.942  35.371
   36    HE3  LYS   6           HE3      LYS   6  20.525  30.919  36.285
   37    HZ1  LYS   6           HZ1      LYS   6  21.906  33.271  37.456
   38    HZ2  LYS   6           HZ2      LYS   6  20.364  33.236  36.889
   39    HZ3  LYS   6           HZ3      LYS   6  20.749  32.335  38.175
   40    H    GLU   7           H        GLU   7  24.780  25.866  37.301
   41    HA   GLU   7           HA       GLU   7  27.557  25.903  36.995
   42    HB2  GLU   7           HB2      GLU   7  25.761  23.740  38.222
   43    HB3  GLU   7           HB3      GLU   7  27.510  23.710  38.338
   44    HG2  GLU   7           HG2      GLU   7  26.889  24.628  40.370
   45    HG3  GLU   7           HG3      GLU   7  27.409  26.021  39.425
   46    H    TYR   8           H        TYR   8  25.345  23.645  35.468
   47    HA   TYR   8           HA       TYR   8  27.456  21.906  34.391
   48    HB2  TYR   8           HB2      TYR   8  25.316  20.893  34.738
   49    HB3  TYR   8           HB3      TYR   8  24.469  22.191  33.906
   50    HD1  TYR   8           HD2      TYR   8  27.060  19.552  33.322
   51    HD2  TYR   8           HD1      TYR   8  23.989  22.033  31.605
   52    HE1  TYR   8           HE2      TYR   8  27.419  18.461  31.097
   53    HE2  TYR   8           HE1      TYR   8  24.348  20.954  29.380
   54    HH   TYR   8           HH       TYR   8  26.818  18.408  28.886
   55    H    CYS   9           H        CYS   9  25.192  24.340  33.035
   56    HA   CYS   9           HA       CYS   9  26.400  24.216  30.451
   57    HB2  CYS   9           HB2      CYS   9  24.126  25.577  31.677
   58    HB3  CYS   9           HB3      CYS   9  24.944  26.608  30.505
   59    H    ALA  10           H        ALA  10  27.364  26.186  33.239
   60    HA   ALA  10           HA       ALA  10  28.932  28.078  31.835
   61    HB1  ALA  10           HB1      ALA  10  30.173  28.228  33.969
   62    HB2  ALA  10           HB2      ALA  10  28.423  28.186  34.235
   63    HB3  ALA  10           HB3      ALA  10  29.401  26.729  34.530
   64    H    GLY  11           H        GLY  11  29.487  24.619  32.058
   65    HA2  GLY  11           HA2      GLY  11  32.310  24.845  31.161
   66    HA3  GLY  11           HA3      GLY  11  31.409  23.371  31.480
   67    H    GLN  12           H        GLN  12  29.231  24.897  29.622
   68    HA   GLN  12           HA       GLN  12  30.285  23.644  27.099
   69    HB2  GLN  12           HB2      GLN  12  27.410  23.914  28.030
   70    HB3  GLN  12           HB3      GLN  12  27.967  23.061  26.600
   71    HG2  GLN  12           HG2      GLN  12  28.594  22.263  29.482
   72    HG3  GLN  12           HG3      GLN  12  27.276  21.628  28.531
   73   HE21  GLN  12          HE22      GLN  12  29.739  20.304  29.742
   74   HE22  GLN  12          HE21      GLN  12  30.259  19.293  28.377
   75    H    CYS  13           H        CYS  13  28.253  26.283  28.368
   76    HA   CYS  13           HA       CYS  13  28.152  27.636  25.707
   77    HB2  CYS  13           HB2      CYS  13  26.017  27.586  27.850
   78    HB3  CYS  13           HB3      CYS  13  25.867  28.149  26.188
   79    H    ARG  14           H        ARG  14  28.617  29.839  25.728
   80    HA   ARG  14           HA       ARG  14  28.935  31.195  28.390
   81    HB2  ARG  14           HB2      ARG  14  30.988  31.022  26.177
   82    HB3  ARG  14           HB3      ARG  14  31.080  32.068  27.606
   83    HG2  ARG  14           HG2      ARG  14  30.856  29.986  29.050
   84    HG3  ARG  14           HG3      ARG  14  31.107  29.026  27.585
   85    HD2  ARG  14           HD2      ARG  14  33.341  30.011  27.282
   86    HD3  ARG  14           HD3      ARG  14  33.049  31.124  28.622
   87    HE   ARG  14           HE       ARG  14  33.328  29.421  30.187
   88   HH11  ARG  14          HH11      ARG  14  33.458  27.884  27.011
   89   HH12  ARG  14          HH12      ARG  14  33.952  26.360  27.735
   90   HH21  ARG  14          HH21      ARG  14  33.870  27.533  30.950
   91   HH22  ARG  14          HH22      ARG  14  34.317  26.191  29.927
   92    H    GLY  15           H        GLY  15  29.333  33.393  28.415
   93    HA2  GLY  15           HA2      GLY  15  28.532  35.541  28.020
   94    HA3  GLY  15           HA3      GLY  15  27.937  35.070  26.424
   95    H    LYS  16           H        LYS  16  26.578  36.537  28.522
   96    HA   LYS  16           HA       LYS  16  24.851  35.057  30.187
   97    HB2  LYS  16           HB2      LYS  16  25.352  37.457  30.369
   98    HB3  LYS  16           HB3      LYS  16  24.455  37.793  28.889
   99    HG2  LYS  16           HG2      LYS  16  22.366  37.083  29.926
  100    HG3  LYS  16           HG3      LYS  16  23.202  36.565  31.393
  101    HD2  LYS  16           HD2      LYS  16  23.185  39.446  30.374
  102    HD3  LYS  16           HD3      LYS  16  21.997  38.783  31.500
  103    HE2  LYS  16           HE2      LYS  16  23.793  38.204  33.098
  104    HE3  LYS  16           HE3      LYS  16  24.997  38.939  32.032
  105    HZ1  LYS  16           HZ1      LYS  16  24.117  40.399  33.860
  106    HZ2  LYS  16           HZ2      LYS  16  23.992  41.073  32.381
  107    HZ3  LYS  16           HZ3      LYS  16  22.655  40.434  33.094
  108    H    VAL  17           H        VAL  17  24.415  35.871  26.766
  109    HA   VAL  17           HA       VAL  17  21.582  35.196  26.747
  110    HB   VAL  17           HB       VAL  17  23.479  35.725  24.455
  111   HG11  VAL  17          HG11      VAL  17  21.444  36.321  23.184
  112   HG12  VAL  17          HG12      VAL  17  21.413  34.625  23.654
  113   HG13  VAL  17          HG13      VAL  17  20.430  35.807  24.547
  114   HG21  VAL  17          HG21      VAL  17  22.492  38.004  24.515
  115   HG22  VAL  17          HG22      VAL  17  21.551  37.564  25.958
  116   HG23  VAL  17          HG23      VAL  17  23.322  37.640  26.020
  117    H    SER  18           H        SER  18  24.520  33.504  25.571
  118    HA   SER  18           HA       SER  18  23.149  31.163  24.599
  119    HB2  SER  18           HB2      SER  18  25.534  31.879  24.123
  120    HB3  SER  18           HB3      SER  18  25.947  31.338  25.751
  121    HG   SER  18           HG       SER  18  26.346  29.850  24.065
  122    H    GLN  19           H        GLN  19  24.757  31.856  27.814
  123    HA   GLN  19           HA       GLN  19  23.710  29.508  29.061
  124    HB2  GLN  19           HB2      GLN  19  24.512  32.215  30.158
  125    HB3  GLN  19           HB3      GLN  19  24.042  30.841  31.191
  126    HG2  GLN  19           HG2      GLN  19  25.821  29.454  30.210
  127    HG3  GLN  19           HG3      GLN  19  26.264  30.747  29.096
  128   HE21  GLN  19          HE22      GLN  19  28.344  29.991  30.223
  129   HE22  GLN  19          HE21      GLN  19  28.850  31.057  31.535
  130    H    ASP  20           H        ASP  20  22.043  32.691  28.653
  131    HA   ASP  20           HA       ASP  20  19.682  31.958  30.099
  132    HB2  ASP  20           HB2      ASP  20  20.176  34.255  29.641
  133    HB3  ASP  20           HB3      ASP  20  20.216  33.963  27.899
  134    H    TYR  21           H        TYR  21  20.541  31.491  26.616
  135    HA   TYR  21           HA       TYR  21  18.073  30.177  25.927
  136    HB2  TYR  21           HB2      TYR  21  19.803  31.001  24.329
  137    HB3  TYR  21           HB3      TYR  21  20.840  29.661  24.799
  138    HD1  TYR  21           HD2      TYR  21  17.770  30.630  22.981
  139    HD2  TYR  21           HD1      TYR  21  20.355  27.362  24.060
  140    HE1  TYR  21           HE2      TYR  21  16.687  29.188  21.257
  141    HE2  TYR  21           HE1      TYR  21  19.293  25.937  22.325
  142    HH   TYR  21           HH       TYR  21  17.820  25.887  20.514
  143    H    CYS  22           H        CYS  22  21.095  28.885  27.395
  144    HA   CYS  22           HA       CYS  22  20.220  26.128  27.370
  145    HB2  CYS  22           HB2      CYS  22  22.552  26.653  27.705
  146    HB3  CYS  22           HB3      CYS  22  22.203  27.528  29.199
  147    H    LEU  23           H        LEU  23  19.680  28.762  29.665
  148    HA   LEU  23           HA       LEU  23  18.201  27.266  31.603
  149    HB2  LEU  23           HB2      LEU  23  18.915  30.049  30.956
  150    HB3  LEU  23           HB3      LEU  23  17.323  29.900  31.686
  151    HG   LEU  23           HG       LEU  23  18.236  28.730  33.620
  152   HD11  LEU  23          HD11      LEU  23  20.986  29.032  32.314
  153   HD12  LEU  23          HD12      LEU  23  20.665  28.473  33.973
  154   HD13  LEU  23          HD13      LEU  23  20.149  27.492  32.610
  155   HD21  LEU  23          HD21      LEU  23  19.540  30.571  34.530
  156   HD22  LEU  23          HD22      LEU  23  19.881  31.174  32.881
  157   HD23  LEU  23          HD23      LEU  23  18.222  31.191  33.533
  158    H    LYS  24           H        LYS  24  17.259  27.984  28.434
  159    HA   LYS  24           HA       LYS  24  14.383  27.407  29.124
  160    HB2  LYS  24           HB2      LYS  24  15.553  28.816  26.704
  161    HB3  LYS  24           HB3      LYS  24  13.835  28.455  26.958
  162    HG2  LYS  24           HG2      LYS  24  13.860  29.892  28.993
  163    HG3  LYS  24           HG3      LYS  24  15.576  30.210  28.731
  164    HD2  LYS  24           HD2      LYS  24  14.289  30.891  26.289
  165    HD3  LYS  24           HD3      LYS  24  13.279  31.564  27.574
  166    HE2  LYS  24           HE2      LYS  24  16.307  31.927  27.416
  167    HE3  LYS  24           HE3      LYS  24  15.170  33.053  26.679
  168    HZ1  LYS  24           HZ1      LYS  24  15.979  33.655  28.936
  169    HZ2  LYS  24           HZ2      LYS  24  14.341  33.660  28.809
  170    HZ3  LYS  24           HZ3      LYS  24  15.140  32.440  29.592
  171    H    HIS  25           H        HIS  25  17.181  26.282  27.433
  172    HA   HIS  25           HA       HIS  25  15.612  24.043  26.199
  173    HB2  HIS  25           HB2      HIS  25  17.657  25.852  24.869
  174    HB3  HIS  25           HB3      HIS  25  16.840  24.495  24.103
  175    HD2  HIS  25           HD2      HIS  25  16.443  28.169  24.673
  176    HE1  HIS  25           HE1      HIS  25  12.686  26.828  23.166
  177    HE2  HIS  25           HE2      HIS  25  14.142  28.878  23.581
  178    H    CYS  26           H        CYS  26  18.205  24.328  28.307
  179    HA   CYS  26           HA       CYS  26  19.964  23.050  28.834
  180    HB2  CYS  26           HB2      CYS  26  18.213  20.928  27.599
  181    HB3  CYS  26           HB3      CYS  26  19.598  20.601  28.617
  182    H    LYS  27           H        LYS  27  19.991  24.072  25.944
  183    HA   LYS  27           HA       LYS  27  22.545  22.761  25.109
  184    HB2  LYS  27           HB2      LYS  27  20.202  23.680  23.376
  185    HB3  LYS  27           HB3      LYS  27  21.808  23.329  22.746
  186    HG2  LYS  27           HG2      LYS  27  21.645  20.995  23.563
  187    HG3  LYS  27           HG3      LYS  27  19.986  21.319  24.128
  188    HD2  LYS  27           HD2      LYS  27  19.324  21.935  21.839
  189    HD3  LYS  27           HD3      LYS  27  20.977  21.647  21.260
  190    HE2  LYS  27           HE2      LYS  27  20.768  19.255  22.106
  191    HE3  LYS  27           HE3      LYS  27  19.063  19.590  22.441
  192    HZ1  LYS  27           HZ1      LYS  27  18.875  20.150  20.007
  193    HZ2  LYS  27           HZ2      LYS  27  20.383  19.563  19.780
  194    HZ3  LYS  27           HZ3      LYS  27  19.221  18.561  20.344
  195    H    CYS  28           H        CYS  28  23.820  24.254  23.664
  196    HA   CYS  28           HA       CYS  28  23.783  27.028  24.657
  197    HB2  CYS  28           HB2      CYS  28  25.413  25.896  22.373
  198    HB3  CYS  28           HB3      CYS  28  25.709  27.360  23.307
  199    H    ILE  29           H        ILE  29  23.818  28.853  22.965
  200    HA   ILE  29           HA       ILE  29  21.268  28.692  21.601
  201    HB   ILE  29           HB       ILE  29  21.902  30.575  22.941
  202   HG12  ILE  29          HG12      ILE  29  21.380  31.407  20.076
  203   HG13  ILE  29          HG13      ILE  29  20.177  30.695  21.166
  204   HG21  ILE  29          HG21      ILE  29  23.496  32.230  22.351
  205   HG22  ILE  29          HG22      ILE  29  24.332  30.683  22.214
  206   HG23  ILE  29          HG23      ILE  29  23.771  31.499  20.750
  207   HD11  ILE  29          HD11      ILE  29  21.625  33.330  21.624
  208   HD12  ILE  29          HD12      ILE  29  19.935  33.109  21.156
  209   HD13  ILE  29          HD13      ILE  29  20.483  32.565  22.756
  210    HA   PRO  30           HA       PRO  30  22.795  27.250  17.739
  211    HB2  PRO  30           HB2      PRO  30  20.441  28.760  16.569
  212    HB3  PRO  30           HB3      PRO  30  21.025  27.109  16.184
  213    HG2  PRO  30           HG2      PRO  30  18.951  27.442  17.862
  214    HG3  PRO  30           HG3      PRO  30  20.265  26.305  18.312
  215    HD2  PRO  30           HD2      PRO  30  19.838  29.158  19.248
  216    HD3  PRO  30           HD3      PRO  30  20.253  27.689  20.185
  217    H    ARG  31           H        ARG  31  24.673  28.075  17.157
  218    HA   ARG  31           HA       ARG  31  24.870  30.517  15.456
  219    HB2  ARG  31           HB2      ARG  31  26.466  29.943  17.992
  220    HB3  ARG  31           HB3      ARG  31  26.996  31.085  16.750
  221    HG2  ARG  31           HG2      ARG  31  24.924  32.393  17.033
  222    HG3  ARG  31           HG3      ARG  31  24.370  31.283  18.292
  223    HD2  ARG  31           HD2      ARG  31  26.261  31.891  19.723
  224    HD3  ARG  31           HD3      ARG  31  26.899  32.973  18.464
  225    HE   ARG  31           HE       ARG  31  24.479  34.032  18.706
  226   HH11  ARG  31          HH22      ARG  31  26.866  33.465  21.264
  227   HH12  ARG  31          HH21      ARG  31  25.962  34.466  22.378
  228   HH21  ARG  31          HH11      ARG  31  23.414  35.201  20.220
  229   HH22  ARG  31          HH12      ARG  31  24.336  35.717  21.632