*HEADER    CELL ADHESION                           06-APR-01   1IE5              
*TITLE     NMR STRUCTURE OF THE THIRD IMMUNOGLOBULIN DOMAIN FROM THE             
*TITLE    2 NEURAL CELL ADHESION MOLECULE.                                       
*COMPND    MOL_ID: 1;                                                            
*COMPND   2 MOLECULE: NEURAL CELL ADHESION MOLECULE;                             
*COMPND   3 CHAIN: A;                                                            
*COMPND   4 FRAGMENT: THIRD IMMUNOGLOBULIN DOMAIN, RESIDUES 183-288;             
*COMPND   5 SYNONYM: N-CAM;                                                      
*COMPND   6 ENGINEERED: YES                                                      
*SOURCE    MOL_ID: 1;                                                            
*SOURCE   2 ORGANISM_SCIENTIFIC: GALLUS GALLUS;                                  
*SOURCE   3 ORGANISM_COMMON: CHICKEN;                                            
*SOURCE   4 ORGAN: BRAIN;                                                        
*SOURCE   5 EXPRESSION_SYSTEM: ESCHERICHIA COLI;                                 
*SOURCE   6 EXPRESSION_SYSTEM_COMMON: BACTERIA;                                  
*SOURCE   7 EXPRESSION_SYSTEM_STRAIN: BL21(DE3);                                 
*SOURCE   8 EXPRESSION_SYSTEM_VECTOR_TYPE: PLASMID;                              
*SOURCE   9 EXPRESSION_SYSTEM_PLASMID: PET3D                                     
*KEYWDS    INTERMEDIATE IMMUNOGLOBULIN FOLD                                      
*EXPDTA    NMR, 20 STRUCTURES                                                    
*AUTHOR    A.R.ATKINS, J.CHUNG, S.DEECHONGKIT, E.B.LITTLE, G.M.EDELMAN,          
*AUTHOR   2 P.E.WRIGHT, B.A.CUNNINGHAM, H.J.DYSON                                
*REVDAT   1   08-AUG-01 1IE5    0                                                
#
#   12 PRO  HB-          12 PRO  HA          3.50    (#     97:20  Preassigned    2.24, 2.51 A)
 &rst
  ixpk= 97, nxpk= 20, iat=  -1, 186, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,

      rk2=20.0, rk3=20.0, ir6=1, ialtd=0,
 igr1= 183, 184,
 &end
#
#    0 AMB  20-3:98      99 THR  HA          5.00    (#     98:20  Single Ambig)
 &rst
  ixpk= 98, nxpk= 20, iat=  -1,1473, r1= 1.30, r2= 1.80, r3= 6.74, r4= 7.24,
 igr1= 245, 246, 247,1498,1499,1500,
 &end
#
#  100 ILE  HN           99 THR  HA          5.00    (#     99:20  Preassigned    2.16, 2.21 A)
 &rst
  ixpk= 99, nxpk= 20, iat=1485,1473, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50,  &end
#
#   99 THR  MG2          99 THR  HA          3.50    (#    100:20  Preassigned    2.63, 3.24 A)
 &rst
  ixpk= 100, nxpk= 20, iat=  -1,1473, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
 igr1=1477,1478,1479,
 &end
#
#    0 AMB  20-3:101     99 THR  HA          5.00    (#    101:20  Single Ambig)
 &rst
  ixpk= 101, nxpk= 20, iat=  -1,1473, r1= 1.30, r2= 1.80, r3= 6.92, r4= 7.42,
 igr1=1495,1496,1301,1302,1465,1466,1467,
 &end
#
#   39 GLY  HA+          12 PRO  HA          5.00    (#    102:20  Unique         2.20, 2.53 A)
 &rst
  ixpk= 102, nxpk= 20, iat=  -1, 186, r1= 1.30, r2= 1.80, r3= 5.61, r4= 6.11,
 igr1= 559, 560,
 &end
#
#   24 THR  HN           24 THR  HA          5.00    (#    103:20  Unique         2.83, 2.91 A)
 &rst
  ixpk= 103, nxpk= 20, iat= 358, 360, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50,  &end
#
#   24 THR  MG2          24 THR  HA          3.50    (#    104:20  Unique         2.27, 3.03 A)
 &rst
  ixpk= 104, nxpk= 20, iat=  -1, 360, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
 igr1= 364, 365, 366,
 &end
#
#   25 ALA  HN           24 THR  HA          2.70    (#    105:20  Unique         2.20, 2.30 A)
 &rst
  ixpk= 105, nxpk= 20, iat= 372, 360, r1= 1.30, r2= 1.80, r3= 2.70, r4= 3.20,  &end
#
#   24 THR  HB           24 THR  HA          5.00    (#    108:20  Unique         3.02, 3.04 A)
 &rst
  ixpk= 108, nxpk= 20, iat= 362, 360, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50,  &end
#
#  105 PHE  HN           24 THR  HA          3.50    (#    111:20  Unique         2.95, 3.26 A)
 &rst
  ixpk= 111, nxpk= 20, iat=1578, 360, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#    0 AMB  20-3:114     20 THR  HA          3.50    (#    114:20  Single Ambig)
 &rst
  ixpk= 114, nxpk= 20, iat=  -1, 305, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
 igr1= 307, 296, 297,
 &end
#
#   21 MET  HN           20 THR  HA          3.50    (#    116:20  Unique         2.09, 2.19 A)
 &rst
  ixpk= 116, nxpk= 20, iat= 317, 305, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   20 THR  MG2          20 THR  HA          3.50    (#    118:20  Unique         2.37, 3.11 A)
 &rst
  ixpk= 118, nxpk= 20, iat=  -1, 305, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
 igr1= 309, 310, 311,
 &end
#
#   15 ARG  HN           14 VAL  HA          2.70    (#    121:20  Preassigned    2.12, 2.19 A)
 &rst
  ixpk= 121, nxpk= 20, iat= 217, 203, r1= 1.30, r2= 1.80, r3= 2.70, r4= 3.20,  &end
#
#   37 ALA  HA           14 VAL  HA          3.50    (#    122:20  Preassigned    2.04, 2.16 A)
 &rst
  ixpk= 122, nxpk= 20, iat= 537, 203, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   14 VAL  HB           14 VAL  HA          3.50    (#    123:20  Preassigned    2.28, 2.38 A)
 &rst
  ixpk= 123, nxpk= 20, iat= 205, 203, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#    0 AMB  20-3:124     14 VAL  HA          3.50    (#    124:20  Single Ambig)
 &rst
  ixpk= 124, nxpk= 20, iat=  -1, 203, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1= 545, 523,
 &end
#
#   87 CYS  HN           86 ILE  HA          2.70    (#    127:20  Unique         2.16, 2.22 A)
 &rst
  ixpk= 127, nxpk= 20, iat=1310,1293, r1= 1.30, r2= 1.80, r3= 2.70, r4= 3.20,  &end
#
#    0 AMB  20-3:128      0 AMB  20-2:128    2.70    (#    128:20  Double Ambig)
 &rst
  ixpk= 128, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.37, r4= 4.87,
 igr1= 207, 208, 209, 211, 212, 213,1297,1298,1299,
 igr2= 203,1293,
 &end
#
#    0 AMB  20-3:131      0 AMB  20-2:131    5.00    (#    131:20  Double Ambig)
 &rst
  ixpk= 131, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.34, r4= 7.84,
 igr1= 539, 540, 541,1330,1331,
 igr2= 203,1293,
 &end
#
#   49 LYS  HN           48 THR  HA          2.70    (#    134:20  Unique         2.08, 2.16 A)
 &rst
  ixpk= 134, nxpk= 20, iat= 710, 698, r1= 1.30, r2= 1.80, r3= 2.70, r4= 3.20,  &end
#
#   48 THR  HB           48 THR  HA          3.50    (#    136:20  Unique         2.35, 2.45 A)
 &rst
  ixpk= 136, nxpk= 20, iat= 700, 698, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#    0 AMB  20-3:137     48 THR  HA          3.50    (#    137:20  Single Ambig)
 &rst
  ixpk= 137, nxpk= 20, iat=  -1, 698, r1= 1.30, r2= 1.80, r3= 4.58, r4= 5.08,
 igr1= 790, 791, 702, 703, 704,
 &end
#
#   53 PRO  HA           48 THR  HA          3.50    (#    138:20  Unique         2.31, 2.66 A)
 &rst
  ixpk= 138, nxpk= 20, iat= 776, 698, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   84 GLU  HA          101 HIS  HA          5.00    (#    142:20  Unique         2.28, 2.44 A)
 &rst
  ixpk= 142, nxpk= 20, iat=1257,1506, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50,  &end
#
#  101 HIS  QB          101 HIS  HA          3.50    (#    144:20  Unique         2.28, 2.70 A)
 &rst
  ixpk= 144, nxpk= 20, iat=  -1,1506, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1=1508,1509,
 &end
#
#  102 LEU  HN          101 HIS  HA          2.70    (#    145:20  Preassigned    2.15, 2.19 A)
 &rst
  ixpk= 145, nxpk= 20, iat=1521,1506, r1= 1.30, r2= 1.80, r3= 2.70, r4= 3.20,  &end
#
#   84 GLU  HA          101 HIS  HA          5.00    (#    147:20  Unique         2.28, 2.44 A)
 &rst
  ixpk= 147, nxpk= 20, iat=1257,1506, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50,  &end
#
#   91 ASN  HN           90 GLU  HA          2.70    (#    153:20  Preassigned    2.15, 2.22 A)
 &rst
  ixpk= 153, nxpk= 20, iat=1364,1351, r1= 1.30, r2= 1.80, r3= 2.70, r4= 3.20,  &end
#
#   95 GLU  HA           90 GLU  HA          3.50    (#    154:20  Preassigned    2.13, 2.19 A)
 &rst
  ixpk= 154, nxpk= 20, iat=1419,1351, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#    0 AMB  20-3:155     90 GLU  HA          3.50    (#    155:20  Single Ambig)
 &rst
  ixpk= 155, nxpk= 20, iat=  -1,1351, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,
 igr1=1424,1425,1356,1357,
 &end
#
#    0 AMB  20-3:156     90 GLU  HA          2.70    (#    156:20  Single Ambig)
 &rst
  ixpk= 156, nxpk= 20, iat=  -1,1351, r1= 1.30, r2= 1.80, r3= 3.64, r4= 4.14,
 igr1= 180, 181,1353,1354,1421,1422,
 &end
#
#   72 LEU  HN           71 GLU  HA          2.70    (#    160:20  Unique         2.07, 2.18 A)
 &rst
  ixpk= 160, nxpk= 20, iat=1056,1043, r1= 1.30, r2= 1.80, r3= 2.70, r4= 3.20,  &end
#
#   71 GLU  QB           71 GLU  HA          3.50    (#    161:20  Unique         2.35, 2.74 A)
 &rst
  ixpk= 161, nxpk= 20, iat=  -1,1043, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1=1045,1046,
 &end
#
#   34 ALA  MB           71 GLU  HA          5.00    (#    162:20  Unique         2.05, 2.84 A)
 &rst
  ixpk= 162, nxpk= 20, iat=  -1,1043, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,
 igr1= 507, 508, 509,
 &end
#
#   34 ALA  HA           71 GLU  HA          3.50    (#    163:20  Unique         2.17, 2.65 A)
 &rst
  ixpk= 163, nxpk= 20, iat= 505,1043, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   17 ARG  HN           35 CYS  HA          3.50    (#    168:20  Unique         2.07, 2.39 A)
 &rst
  ixpk= 168, nxpk= 20, iat= 251, 515, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   36 ASP  HN           35 CYS  HA          3.50    (#    169:20  Unique         2.19, 2.28 A)
 &rst
  ixpk= 169, nxpk= 20, iat= 523, 515, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   16 ALA  MB           35 CYS  HA          5.00    (#    170:20  Preassigned    4.26, 4.78 A)
 &rst
  ixpk= 170, nxpk= 20, iat=  -1, 515, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,
 igr1= 245, 246, 247,
 &end
#
#   35 CYS  HB-          35 CYS  HA          3.50    (#    173:20  Preassigned    2.41, 2.77 A)
 &rst
  ixpk= 173, nxpk= 20, iat=  -1, 515, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1= 517, 518,
 &end
#
#   21 MET  HB2         102 LEU  HA          3.50    (#    177:20  Unique         2.50, 2.92 A)
 &rst
  ixpk= 177, nxpk= 20, iat= 321,1523, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   37 ALA  HN           36 ASP  HA          2.70    (#    179:20  Unique         2.14, 2.25 A)
 &rst
  ixpk= 179, nxpk= 20, iat= 535, 525, r1= 1.30, r2= 1.80, r3= 2.70, r4= 3.20,  &end
#
#   36 ASP  HB3          36 ASP  HA          3.50    (#    180:20  Unique         2.31, 2.40 A)
 &rst
  ixpk= 180, nxpk= 20, iat= 528, 525, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#  103 LYS  HN          102 LEU  HA          2.70    (#    182:20  Unique         2.18, 2.24 A)
 &rst
  ixpk= 182, nxpk= 20, iat=1540,1523, r1= 1.30, r2= 1.80, r3= 2.70, r4= 3.20,  &end
#
#    0 AMB  20-3:183    102 LEU  HA          3.50    (#    183:20  Single Ambig)
 &rst
  ixpk= 183, nxpk= 20, iat=  -1,1523, r1= 1.30, r2= 1.80, r3= 5.30, r4= 5.80,
 igr1=1530,1531,1532,1534,1535,1536,1530,1531,1532,1534,
      1535,1536,
 &end
#
#   10 VAL  HN            9 ASN  HA          2.70    (#    184:20  Unique         2.14, 2.28 A)
 &rst
  ixpk= 184, nxpk= 20, iat= 146, 134, r1= 1.30, r2= 1.80, r3= 2.70, r4= 3.20,  &end
#
#    9 ASN  HN            9 ASN  HA          3.50    (#    185:20  Preassigned    2.37, 2.86 A)
 &rst
  ixpk= 185, nxpk= 20, iat= 132, 134, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#    0 AMB  20-3:186      9 ASN  HA          2.70    (#    186:20  Single Ambig)
 &rst
  ixpk= 186, nxpk= 20, iat=  -1, 134, r1= 1.30, r2= 1.80, r3= 3.40, r4= 3.90,
 igr1= 136, 137,  37,  38,
 &end
#
#    9 ASN  HD21          9 ASN  HA          5.00    (#    187:20  Unique         3.67, 4.58 A)
 &rst
  ixpk= 187, nxpk= 20, iat= 141, 134, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50,  &end
#
#   60 GLU  HN           59 ASN  HA          3.50    (#    189:20  Unique         2.12, 2.19 A)
 &rst
  ixpk= 189, nxpk= 20, iat= 872, 860, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   59 ASN  HN           59 ASN  HA          3.50    (#    190:20  Preassigned    2.92, 2.94 A)
 &rst
  ixpk= 190, nxpk= 20, iat= 858, 860, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   59 ASN  HB+          59 ASN  HA          3.50    (#    191:20  Preassigned    2.39, 2.73 A)
 &rst
  ixpk= 191, nxpk= 20, iat=  -1, 860, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1= 862, 863,
 &end
#
#   59 ASN  HB-          59 ASN  HA          3.50    (#    192:20  Preassigned    2.39, 2.73 A)
 &rst
  ixpk= 192, nxpk= 20, iat=  -1, 860, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1= 862, 863,
 &end
#
#   52 GLU  HB2          52 GLU  HA          3.50    (#    193:20  Preassigned    2.26, 2.32 A)
 &rst
  ixpk= 193, nxpk= 20, iat= 755, 753, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   53 PRO  HD+          52 GLU  HA          2.70    (#    194:20  Unique         2.16, 2.43 A)
 &rst
  ixpk= 194, nxpk= 20, iat=  -1, 753, r1= 1.30, r2= 1.80, r3= 3.03, r4= 3.53,
 igr1= 767, 768,
 &end
#
#   53 PRO  HD-          52 GLU  HA          2.70    (#    195:20  Unique         2.16, 2.43 A)
 &rst
  ixpk= 195, nxpk= 20, iat=  -1, 753, r1= 1.30, r2= 1.80, r3= 3.03, r4= 3.53,
 igr1= 767, 768,
 &end
#
#   52 GLU  HB3          52 GLU  HA          3.50    (#    196:20  Preassigned    2.52, 2.59 A)
 &rst
  ixpk= 196, nxpk= 20, iat= 756, 753, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   68 ASP  HA           38 ASP  HA          5.00    (#    199:20  Unique         4.25, 4.68 A)
 &rst
  ixpk= 199, nxpk= 20, iat=1013, 547, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50,  &end
#
#   38 ASP  HN           38 ASP  HA          3.50    (#    200:20  Unique         2.93, 2.97 A)
 &rst
  ixpk= 200, nxpk= 20, iat= 545, 547, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   39 GLY  HN           38 ASP  HA          2.70    (#    201:20  Unique         1.99, 2.14 A)
 &rst
  ixpk= 201, nxpk= 20, iat= 557, 547, r1= 1.30, r2= 1.80, r3= 2.70, r4= 3.20,  &end
#
#   38 ASP  QB           38 ASP  HA          2.70    (#    202:20  Preassigned    2.28, 2.67 A)
 &rst
  ixpk= 202, nxpk= 20, iat=  -1, 547, r1= 1.30, r2= 1.80, r3= 3.03, r4= 3.53,
 igr1= 549, 550,
 &end
#
#    0 AMB  20-3:210      0 AMB  20-2:210    3.50    (#    210:20  Double Ambig)
 &rst
  ixpk= 210, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.30, r4= 5.80,
 igr1= 770, 771, 755,
 igr2= 767, 768, 767, 768,
 &end
#
#   45 MET  HA           89 ALA  HA          3.50    (#    217:20  Preassigned    2.01, 2.09 A)
 &rst
  ixpk= 217, nxpk= 20, iat= 643,1341, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   90 GLU  HN           89 ALA  HA          2.70    (#    218:20  Preassigned    2.14, 2.19 A)
 &rst
  ixpk= 218, nxpk= 20, iat=1349,1341, r1= 1.30, r2= 1.80, r3= 2.70, r4= 3.20,  &end
#
#   89 ALA  MB           89 ALA  HA          3.50    (#    220:20  Preassigned    2.35, 2.65 A)
 &rst
  ixpk= 220, nxpk= 20, iat=  -1,1341, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
 igr1=1343,1344,1345,
 &end
#
#   86 ILE  HN           85 TYR  HA          3.50    (#    246:20  Unique         2.29, 2.32 A)
 &rst
  ixpk= 246, nxpk= 20, iat=1291,1272, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   48 THR  HN           47 TRP  HA          2.70    (#    247:20  Unique         2.17, 2.29 A)
 &rst
  ixpk= 247, nxpk= 20, iat= 696, 674, r1= 1.30, r2= 1.80, r3= 2.70, r4= 3.20,  &end
#
#   47 TRP  HB2          47 TRP  HA          3.50    (#    249:20  Unique         2.56, 2.57 A)
 &rst
  ixpk= 249, nxpk= 20, iat= 676, 674, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   47 TRP  HB3          47 TRP  HA          3.50    (#    250:20  Unique         2.17, 2.22 A)
 &rst
  ixpk= 250, nxpk= 20, iat= 677, 674, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#    0 AMB  20-3:251     47 TRP  HA          3.50    (#    251:20  Single Ambig)
 &rst
  ixpk= 251, nxpk= 20, iat=  -1, 674, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1= 672,1320,
 &end
#
#   75 LYS  HA           30 SER  HA          3.50    (#    253:20  Unique         2.43, 2.95 A)
 &rst
  ixpk= 253, nxpk= 20, iat=1115, 445, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   31 VAL  MG2          30 SER  HA          3.50    (#    254:20  Preassigned    3.27, 4.43 A)
 &rst
  ixpk= 254, nxpk= 20, iat=  -1, 445, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
 igr1= 464, 465, 466,
 &end
#
#   31 VAL  HN           30 SER  HA          3.50    (#    255:20  Preassigned    2.19, 2.25 A)
 &rst
  ixpk= 255, nxpk= 20, iat= 454, 445, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   30 SER  QB           30 SER  HA          2.70    (#    256:20  Preassigned    2.37, 2.66 A)
 &rst
  ixpk= 256, nxpk= 20, iat=  -1, 445, r1= 1.30, r2= 1.80, r3= 3.03, r4= 3.53,
 igr1= 447, 448,
 &end
#
#    0 AMB  20-3:257     30 SER  HA          3.50    (#    257:20  Single Ambig)
 &rst
  ixpk= 257, nxpk= 20, iat=  -1, 445, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1= 443,1157,
 &end
#
#    0 AMB  20-3:258     63 TYR  HA          2.70    (#    258:20  Single Ambig)
 &rst
  ixpk= 258, nxpk= 20, iat=  -1, 926, r1= 1.30, r2= 1.80, r3= 3.03, r4= 3.53,
 igr1= 945,1113,
 &end
#
#   63 TYR  QB           63 TYR  HA          3.50    (#    260:20  Preassigned    2.37, 2.46 A)
 &rst
  ixpk= 260, nxpk= 20, iat=  -1, 926, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1= 928, 929,
 &end
#
#   45 MET  HG-          45 MET  HA          5.00    (#    262:20  Preassigned    3.68, 3.95 A)
 &rst
  ixpk= 262, nxpk= 20, iat=  -1, 643, r1= 1.30, r2= 1.80, r3= 5.61, r4= 6.11,
 igr1= 648, 649,
 &end
#
#   96 GLN  HN           95 GLU  HA          3.50    (#    264:20  Unique         2.15, 2.21 A)
 &rst
  ixpk= 264, nxpk= 20, iat=1432,1419, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   46 THR  HN           45 MET  HA          2.70    (#    266:20  Preassigned    2.23, 2.30 A)
 &rst
  ixpk= 266, nxpk= 20, iat= 658, 643, r1= 1.30, r2= 1.80, r3= 2.70, r4= 3.20,  &end
#
#   89 ALA  HA           45 MET  HA          3.50    (#    268:20  Preassigned    2.01, 2.09 A)
 &rst
  ixpk= 268, nxpk= 20, iat=1341, 643, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   45 MET  HB2          45 MET  HA          3.50    (#    269:20  Preassigned    2.29, 2.33 A)
 &rst
  ixpk= 269, nxpk= 20, iat= 645, 643, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   23 ALA  HN           22 ASN  HA          2.70    (#    271:20  Preassigned    2.28, 2.49 A)
 &rst
  ixpk= 271, nxpk= 20, iat= 348, 336, r1= 1.30, r2= 1.80, r3= 2.70, r4= 3.20,  &end
#
#   22 ASN  QB           22 ASN  HA          3.50    (#    273:20  Unique         2.29, 2.51 A)
 &rst
  ixpk= 273, nxpk= 20, iat=  -1, 336, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1= 338, 339,
 &end
#
#    0 AMB  20-3:274     97 ASP  HA          5.00    (#    274:20  Single Ambig)
 &rst
  ixpk= 274, nxpk= 20, iat=  -1,1451, r1= 1.30, r2= 1.80, r3= 5.61, r4= 6.11,
 igr1=1339,1320,
 &end
#
#   88 ILE  HA           97 ASP  HA          3.50    (#    275:20  Unique         2.23, 2.38 A)
 &rst
  ixpk= 275, nxpk= 20, iat=1322,1451, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#    0 AMB  20-3:276     97 ASP  HA          2.70    (#    276:20  Single Ambig)
 &rst
  ixpk= 276, nxpk= 20, iat=  -1,1451, r1= 1.30, r2= 1.80, r3= 3.89, r4= 4.39,
 igr1= 207, 208, 209, 211, 212, 213,1333,1334,1335,
 &end
#
#   98 ALA  HN           97 ASP  HA          2.70    (#    277:20  Unique         2.29, 2.34 A)
 &rst
  ixpk= 277, nxpk= 20, iat=1461,1451, r1= 1.30, r2= 1.80, r3= 2.70, r4= 3.20,  &end
#
#   83 ALA  MB           83 ALA  HA          2.70    (#    278:20  Preassigned    2.36, 2.69 A)
 &rst
  ixpk= 278, nxpk= 20, iat=  -1,1247, r1= 1.30, r2= 1.80, r3= 3.24, r4= 3.74,
 igr1=1249,1250,1251,
 &end
#
#   97 ASP  HB+          97 ASP  HA          3.50    (#    279:20  Unique         2.37, 2.47 A)
 &rst
  ixpk= 279, nxpk= 20, iat=  -1,1451, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1=1453,1454,
 &end
#
#   97 ASP  HB-          97 ASP  HA          2.70    (#    280:20  Unique         2.37, 2.47 A)
 &rst
  ixpk= 280, nxpk= 20, iat=  -1,1451, r1= 1.30, r2= 1.80, r3= 3.03, r4= 3.53,
 igr1=1453,1454,
 &end
#
#   34 ALA  MB           34 ALA  HA          2.70    (#    281:20  Preassigned    2.37, 2.70 A)
 &rst
  ixpk= 281, nxpk= 20, iat=  -1, 505, r1= 1.30, r2= 1.80, r3= 3.24, r4= 3.74,
 igr1= 507, 508, 509,
 &end
#
#   35 CYS  HN           34 ALA  HA          5.00    (#    282:20  Preassigned    2.14, 2.18 A)
 &rst
  ixpk= 282, nxpk= 20, iat= 513, 505, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50,  &end
#
#   38 ASP  HN           37 ALA  HA          2.70    (#    285:20  Preassigned    2.16, 2.29 A)
 &rst
  ixpk= 285, nxpk= 20, iat= 545, 537, r1= 1.30, r2= 1.80, r3= 2.70, r4= 3.20,  &end
#
#   14 VAL  HA           37 ALA  HA          2.70    (#    287:20  Preassigned    2.04, 2.16 A)
 &rst
  ixpk= 287, nxpk= 20, iat= 203, 537, r1= 1.30, r2= 1.80, r3= 2.70, r4= 3.20,  &end
#
#   37 ALA  MB           37 ALA  HA          2.70    (#    288:20  Preassigned    2.36, 2.62 A)
 &rst
  ixpk= 288, nxpk= 20, iat=  -1, 537, r1= 1.30, r2= 1.80, r3= 3.24, r4= 3.74,
 igr1= 539, 540, 541,
 &end
#
#   69 GLY  HN           69 GLY  HA+         5.00    (#    331:20  Preassigned    2.20, 2.57 A)
 &rst
  ixpk= 331, nxpk= 20, iat=1023,  -1, r1= 1.30, r2= 1.80, r3= 5.61, r4= 6.11,
 igr2=1025,1026,
 &end
#
#   95 GLU  HN           94 GLY  HA+         2.70    (#    335:20  Unique         2.26, 2.55 A)
 &rst
  ixpk= 335, nxpk= 20, iat=1417,  -1, r1= 1.30, r2= 1.80, r3= 3.03, r4= 3.53,
 igr2=1412,1413,
 &end
#
#   94 GLY  HN           94 GLY  HA+         5.00    (#    336:20  Unique         2.75, 2.82 A)
 &rst
  ixpk= 336, nxpk= 20, iat=1410,  -1, r1= 1.30, r2= 1.80, r3= 5.61, r4= 6.11,
 igr2=1412,1413,
 &end
#
#   51 GLY  HN           51 GLY  HA+         3.50    (#    342:20  Unique         2.30, 2.74 A)
 &rst
  ixpk= 342, nxpk= 20, iat= 744,  -1, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr2= 746, 747,
 &end
#
#   52 GLU  HN           48 THR  HB          5.00    (#    407:20  Unique         2.32, 2.87 A)
 &rst
  ixpk= 407, nxpk= 20, iat= 751, 700, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50,  &end
#
#   48 THR  MG2          48 THR  HB          3.50    (#    409:20  Unique         2.40, 2.67 A)
 &rst
  ixpk= 409, nxpk= 20, iat=  -1, 700, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
 igr1= 702, 703, 704,
 &end
#
#    0 AMB  20-3:423     44 THR  HB          3.50    (#    423:20  Single Ambig)
 &rst
  ixpk= 423, nxpk= 20, iat=  -1, 631, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1= 629, 623,
 &end
#
#   20 THR  MG2          20 THR  HB          3.50    (#    425:20  Unique         2.41, 2.67 A)
 &rst
  ixpk= 425, nxpk= 20, iat=  -1, 307, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
 igr1= 309, 310, 311,
 &end
#
#   20 THR  HN           20 THR  HB          5.00    (#    426:20  Unique         2.66, 2.81 A)
 &rst
  ixpk= 426, nxpk= 20, iat= 303, 307, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50,  &end
#
#   20 THR  HA           20 THR  HB          5.00    (#    427:20  Unique         3.03, 3.05 A)
 &rst
  ixpk= 427, nxpk= 20, iat= 305, 307, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50,  &end
#
#    0 AMB  20-3:431     44 THR  HB          3.50    (#    431:20  Single Ambig)
 &rst
  ixpk= 431, nxpk= 20, iat=  -1, 631, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1=1349, 641,
 &end
#
#   44 THR  HN           44 THR  HB          5.00    (#    432:20  Unique         2.42, 2.58 A)
 &rst
  ixpk= 432, nxpk= 20, iat= 627, 631, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50,  &end
#
#   44 THR  MG2          44 THR  HB          2.70    (#    433:20  Unique         2.42, 2.68 A)
 &rst
  ixpk= 433, nxpk= 20, iat=  -1, 631, r1= 1.30, r2= 1.80, r3= 3.24, r4= 3.74,
 igr1= 633, 634, 635,
 &end
#
#   70 SER  HA           70 SER  QB          3.50    (#    491:20  Unique         2.18, 2.55 A)
 &rst
  ixpk= 491, nxpk= 20, iat=1032,  -1, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr2=1034,1035,
 &end
#
#   54 ILE  HN           53 PRO  HA          3.50    (#    492:20  Unique         2.07, 2.14 A)
 &rst
  ixpk= 492, nxpk= 20, iat= 780, 776, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   48 THR  HA           53 PRO  HA          3.50    (#    493:20  Unique         2.31, 2.66 A)
 &rst
  ixpk= 493, nxpk= 20, iat= 698, 776, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   53 PRO  HB+          53 PRO  HA          3.50    (#    495:20  Unique         2.21, 2.46 A)
 &rst
  ixpk= 495, nxpk= 20, iat=  -1, 776, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1= 773, 774,
 &end
#
#   48 THR  MG2          53 PRO  HA          3.50    (#    496:20  Unique         2.16, 3.44 A)
 &rst
  ixpk= 496, nxpk= 20, iat=  -1, 776, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
 igr1= 702, 703, 704,
 &end
#
#   19 SER  HA           19 SER  HB+         3.50    (#    497:20  Unique         2.32, 2.63 A)
 &rst
  ixpk= 497, nxpk= 20, iat= 294,  -1, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr2= 296, 297,
 &end
#
#   19 SER  HA           19 SER  HB-         3.50    (#    501:20  Unique         2.32, 2.63 A)
 &rst
  ixpk= 501, nxpk= 20, iat= 294,  -1, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr2= 296, 297,
 &end
#
#    0 AMB  20-3:505     19 SER  HB-         5.00    (#    505:20  Single Ambig)
 &rst
  ixpk= 505, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.30, r4= 6.80,
 igr1=1487, 243,
 igr2= 296, 297,
 &end
#
#   53 PRO  HB-          53 PRO  HA          3.50    (#    506:20  Unique         2.21, 2.46 A)
 &rst
  ixpk= 506, nxpk= 20, iat=  -1, 776, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1= 773, 774,
 &end
#
#   91 ASN  HB+          43 PRO  HA          5.00    (#    518:20  Unique         2.10, 2.37 A)
 &rst
  ixpk= 518, nxpk= 20, iat=  -1, 623, r1= 1.30, r2= 1.80, r3= 5.61, r4= 6.11,
 igr1=1368,1369,
 &end
#
#   44 THR  HN           43 PRO  HA          2.70    (#    519:20  Unique         2.33, 2.38 A)
 &rst
  ixpk= 519, nxpk= 20, iat= 627, 623, r1= 1.30, r2= 1.80, r3= 2.70, r4= 3.20,  &end
#
#    0 AMB  20-3:521     43 PRO  HA          3.50    (#    521:20  Single Ambig)
 &rst
  ixpk= 521, nxpk= 20, iat=  -1, 623, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,
 igr1= 620, 621, 617, 618,
 &end
#
#   91 ASN  HB-          43 PRO  HA          5.00    (#    524:20  Unique         2.10, 2.37 A)
 &rst
  ixpk= 524, nxpk= 20, iat=  -1, 623, r1= 1.30, r2= 1.80, r3= 5.61, r4= 6.11,
 igr1=1368,1369,
 &end
#
#    7 ILE  HN            6 VAL  HA          2.70    (#    528:20  Preassigned    2.24, 2.53 A)
 &rst
  ixpk= 528, nxpk= 20, iat=  97,  83, r1= 1.30, r2= 1.80, r3= 2.70, r4= 3.20,  &end
#
#    6 VAL  HB            6 VAL  HA          5.00    (#    530:20  Preassigned    3.05, 3.06 A)
 &rst
  ixpk= 530, nxpk= 20, iat=  85,  83, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50,  &end
#
#    6 VAL  MG1           6 VAL  HA          3.50    (#    531:20  Preassigned    2.43, 3.15 A)
 &rst
  ixpk= 531, nxpk= 20, iat=  -1,  83, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
 igr1=  87,  88,  89,
 &end
#
#    9 ASN  HN            8 VAL  HA          3.50    (#    539:20  Preassigned    3.50, 3.53 A)
 &rst
  ixpk= 539, nxpk= 20, iat= 132, 118, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#    8 VAL  HB            8 VAL  HA          3.50    (#    540:20  Preassigned    3.02, 3.05 A)
 &rst
  ixpk= 540, nxpk= 20, iat= 120, 118, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#    8 VAL  MG2           8 VAL  HA          3.50    (#    541:20  Preassigned    2.44, 3.13 A)
 &rst
  ixpk= 541, nxpk= 20, iat=  -1, 118, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
 igr1= 126, 127, 128,
 &end
#
#   45 MET  HN           44 THR  HA          5.00    (#    542:20  Preassigned    2.17, 2.25 A)
 &rst
  ixpk= 542, nxpk= 20, iat= 641, 629, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50,  &end
#
#   12 PRO  HD+          11 PRO  HA          2.70    (#    543:20  Preassigned    2.13, 2.43 A)
 &rst
  ixpk= 543, nxpk= 20, iat=  -1, 172, r1= 1.30, r2= 1.80, r3= 3.03, r4= 3.53,
 igr1= 177, 178,
 &end
#
#   12 PRO  HD-          11 PRO  HA          3.50    (#    544:20  Preassigned    2.13, 2.43 A)
 &rst
  ixpk= 544, nxpk= 20, iat=  -1, 172, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1= 177, 178,
 &end
#
#    0 AMB  20-3:545     11 PRO  HA          3.50    (#    545:20  Single Ambig)
 &rst
  ixpk= 545, nxpk= 20, iat=  -1, 172, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,
 igr1= 169, 170, 166, 167,
 &end
#
#    0 AMB  20-3:548      4 ILE  HA          5.00    (#    548:20  Single Ambig)
 &rst
  ixpk= 548, nxpk= 20, iat=  -1,  47, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,
 igr1=  49,  15,  16,
 &end
#
#    2 LYS  QD            4 ILE  HA          5.00    (#    549:20  Unique         3.64, 5.53 A)
 &rst
  ixpk= 549, nxpk= 20, iat=  -1,  47, r1= 1.30, r2= 1.80, r3= 5.61, r4= 6.11,
 igr1=  21,  22,
 &end
#
#   89 ALA  HN           88 ILE  HA          2.70    (#    550:20  Preassigned    2.19, 2.26 A)
 &rst
  ixpk= 550, nxpk= 20, iat=1339,1322, r1= 1.30, r2= 1.80, r3= 2.70, r4= 3.20,  &end
#
#   97 ASP  HA           88 ILE  HA          5.00    (#    551:20  Unique         2.23, 2.38 A)
 &rst
  ixpk= 551, nxpk= 20, iat=1451,1322, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50,  &end
#
#   47 TRP  HN           46 THR  HA          3.50    (#    552:20  Preassigned    2.38, 2.48 A)
 &rst
  ixpk= 552, nxpk= 20, iat= 672, 660, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   44 THR  HN           44 THR  HA          3.50    (#    553:20  Unique         2.95, 2.99 A)
 &rst
  ixpk= 553, nxpk= 20, iat= 627, 629, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#    0 AMB  20-3:554      0 AMB  20-2:554    2.70    (#    554:20  Double Ambig)
 &rst
  ixpk= 554, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.09, r4= 4.59,
 igr1= 664, 665, 666, 633, 634, 635,
 igr2= 660, 629,
 &end
#
#    0 AMB  20-3:556      0 AMB  20-2:556    2.70    (#    556:20  Double Ambig)
 &rst
  ixpk= 556, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 3.40, r4= 3.90,
 igr1= 662, 631,
 igr2= 660, 629,
 &end
#
#    0 AMB  20-3:558     46 THR  HA          6.00    (#    558:20  Single Ambig)
 &rst
  ixpk= 558, nxpk= 20, iat=  -1, 660, r1= 1.30, r2= 1.80, r3= 7.56, r4= 8.06,
 igr1= 652, 653, 654, 784,
 &end
#
#   19 SER  HB+          19 SER  HA          3.50    (#    560:20  Unique         2.32, 2.63 A)
 &rst
  ixpk= 560, nxpk= 20, iat=  -1, 294, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1= 296, 297,
 &end
#
#   80 SER  HB3          80 SER  HA          5.00    (#    562:20  Unique         2.33, 2.40 A)
 &rst
  ixpk= 562, nxpk= 20, iat=1212,1209, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50,  &end
#
#   16 ALA  MB           19 SER  HA          3.50    (#    566:20  Preassigned    2.20, 2.97 A)
 &rst
  ixpk= 566, nxpk= 20, iat=  -1, 294, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
 igr1= 245, 246, 247,
 &end
#
#   54 ILE  MG2          54 ILE  HA          3.50    (#    568:20  Preassigned    2.40, 3.04 A)
 &rst
  ixpk= 568, nxpk= 20, iat=  -1, 782, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
 igr1= 786, 787, 788,
 &end
#
#    7 ILE  HN            7 ILE  HA          5.00    (#    571:20  Unique         2.69, 2.89 A)
 &rst
  ixpk= 571, nxpk= 20, iat=  97,  99, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50,  &end
#
#    8 VAL  HN            7 ILE  HA          2.70    (#    572:20  Preassigned    2.13, 2.19 A)
 &rst
  ixpk= 572, nxpk= 20, iat= 116,  99, r1= 1.30, r2= 1.80, r3= 2.70, r4= 3.20,  &end
#
#    7 ILE  MG2           7 ILE  HA          3.50    (#    574:20  Preassigned    2.35, 3.11 A)
 &rst
  ixpk= 574, nxpk= 20, iat=  -1,  99, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
 igr1= 103, 104, 105,
 &end
#
#    0 AMB  20-3:575     88 ILE  HA          3.50    (#    575:20  Single Ambig)
 &rst
  ixpk= 575, nxpk= 20, iat=  -1,1322, r1= 1.30, r2= 1.80, r3= 5.30, r4= 5.80,
 igr1=1326,1327,1328,1333,1334,1335, 207, 208, 209, 211,
       212, 213,
 &end
#
#   75 LYS  HN           74 ILE  HA          2.70    (#    578:20  Preassigned    2.18, 2.25 A)
 &rst
  ixpk= 578, nxpk= 20, iat=1113,1096, r1= 1.30, r2= 1.80, r3= 2.70, r4= 3.20,  &end
#
#   80 SER  HB2          80 SER  HA          2.70    (#    581:20  Unique         2.41, 2.53 A)
 &rst
  ixpk= 581, nxpk= 20, iat=1211,1209, r1= 1.30, r2= 1.80, r3= 2.70, r4= 3.20,  &end
#
#    7 ILE  HG1-          7 ILE  HA          5.00    (#    586:20  Unique         2.43, 2.93 A)
 &rst
  ixpk= 586, nxpk= 20, iat=  -1,  99, r1= 1.30, r2= 1.80, r3= 5.61, r4= 6.11,
 igr1= 107, 108,
 &end
#
#   73 ILE  MG2          73 ILE  HA          3.50    (#    587:20  Unique         2.33, 2.99 A)
 &rst
  ixpk= 587, nxpk= 20, iat=  -1,1077, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
 igr1=1081,1082,1083,
 &end
#
#   74 ILE  HN           73 ILE  HA          2.70    (#    588:20  Preassigned    2.11, 2.17 A)
 &rst
  ixpk= 588, nxpk= 20, iat=1094,1077, r1= 1.30, r2= 1.80, r3= 2.70, r4= 3.20,  &end
#
#   32 THR  HN           31 VAL  HA          2.70    (#    589:20  Unique         2.11, 2.17 A)
 &rst
  ixpk= 589, nxpk= 20, iat= 470, 456, r1= 1.30, r2= 1.80, r3= 2.70, r4= 3.20,  &end
#
#    0 AMB  20-3:590     31 VAL  HA          3.50    (#    590:20  Single Ambig)
 &rst
  ixpk= 590, nxpk= 20, iat=  -1, 456, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,
 igr1= 464, 465, 466, 460, 461, 462,
 &end
#
#   31 VAL  HB           31 VAL  HA          3.50    (#    594:20  Unique         3.00, 3.03 A)
 &rst
  ixpk= 594, nxpk= 20, iat= 458, 456, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   17 ARG  HN           17 ARG  HA          3.50    (#    597:20  Preassigned    2.54, 2.77 A)
 &rst
  ixpk= 597, nxpk= 20, iat= 251, 253, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   17 ARG  HB+          17 ARG  HA          3.50    (#    598:20  Preassigned    2.37, 2.78 A)
 &rst
  ixpk= 598, nxpk= 20, iat=  -1, 253, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1= 255, 256,
 &end
#
#   17 ARG  HB-          17 ARG  HA          3.50    (#    599:20  Preassigned    2.37, 2.78 A)
 &rst
  ixpk= 599, nxpk= 20, iat=  -1, 253, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1= 255, 256,
 &end
#
#   17 ARG  QG           17 ARG  HA          5.00    (#    604:20  Unique         2.29, 2.76 A)
 &rst
  ixpk= 604, nxpk= 20, iat=  -1, 253, r1= 1.30, r2= 1.80, r3= 5.61, r4= 6.11,
 igr1= 258, 259,
 &end
#
#    0 AMB  20-3:616     72 LEU  MDY         3.50    (#    616:20  Single Ambig)
 &rst
  ixpk= 616, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.36, r4= 6.86,
 igr1= 932, 941, 691, 827,1278,1287,
 igr2=1065,1066,1067,1069,1070,1071,
 &end
#
#   83 ALA  HN           82 GLU  HA          3.50    (#    622:20  Unique         2.19, 2.23 A)
 &rst
  ixpk= 622, nxpk= 20, iat=1245,1232, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   92 LYS  HN           92 LYS  HA          5.00    (#    623:20  Unique         2.71, 2.76 A)
 &rst
  ixpk= 623, nxpk= 20, iat=1378,1380, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50,  &end
#
#   92 LYS  HB-          92 LYS  HA          2.70    (#    624:20  Unique         2.23, 2.42 A)
 &rst
  ixpk= 624, nxpk= 20, iat=  -1,1380, r1= 1.30, r2= 1.80, r3= 3.03, r4= 3.53,
 igr1=1382,1383,
 &end
#
#   61 GLU  QG           61 GLU  HA          3.50    (#    625:20  Unique         2.43, 2.76 A)
 &rst
  ixpk= 625, nxpk= 20, iat=  -1, 889, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1= 894, 895,
 &end
#
#   60 GLU  HN           60 GLU  HA          3.50    (#    627:20  Unique         2.97, 3.00 A)
 &rst
  ixpk= 627, nxpk= 20, iat= 872, 874, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   61 GLU  HN           60 GLU  HA          3.50    (#    629:20  Unique         3.09, 3.31 A)
 &rst
  ixpk= 629, nxpk= 20, iat= 887, 874, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#    0 AMB  20-3:630     60 GLU  HA          2.70    (#    630:20  Single Ambig)
 &rst
  ixpk= 630, nxpk= 20, iat=  -1, 874, r1= 1.30, r2= 1.80, r3= 3.40, r4= 3.90,
 igr1= 879, 880, 879, 880,
 &end
#
#   60 GLU  HB+          60 GLU  HA          3.50    (#    631:20  Unique         2.38, 2.74 A)
 &rst
  ixpk= 631, nxpk= 20, iat=  -1, 874, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1= 876, 877,
 &end
#
#   60 GLU  HB-          60 GLU  HA          3.50    (#    632:20  Unique         2.38, 2.74 A)
 &rst
  ixpk= 632, nxpk= 20, iat=  -1, 874, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1= 876, 877,
 &end
#
#   82 GLU  HB-          82 GLU  HA          5.00    (#    633:20  Unique         2.44, 2.77 A)
 &rst
  ixpk= 633, nxpk= 20, iat=  -1,1232, r1= 1.30, r2= 1.80, r3= 5.61, r4= 6.11,
 igr1=1234,1235,
 &end
#
#    0 AMB  20-3:634     82 GLU  HA          3.50    (#    634:20  Single Ambig)
 &rst
  ixpk= 634, nxpk= 20, iat=  -1,1232, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1=1568,1569,1570,1572,1573,1574,1530,1531,1532,1534,
      1535,1536,1530,1531,1532,1534,1535,1536,
 &end
#
#  107 LYS  HN          107 LYS  HA          3.50    (#    639:20  Unique         2.24, 2.32 A)
 &rst
  ixpk= 639, nxpk= 20, iat=1608,1610, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   24 THR  MG2         107 LYS  HA          3.50    (#    642:20  Unique         2.31, 3.30 A)
 &rst
  ixpk= 642, nxpk= 20, iat=  -1,1610, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
 igr1= 364, 365, 366,
 &end
#
#   61 GLU  HN           61 GLU  HA          3.50    (#    644:20  Unique         2.16, 2.37 A)
 &rst
  ixpk= 644, nxpk= 20, iat= 887, 889, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   61 GLU  QB           61 GLU  HA          2.70    (#    645:20  Unique         2.32, 2.77 A)
 &rst
  ixpk= 645, nxpk= 20, iat=  -1, 889, r1= 1.30, r2= 1.80, r3= 3.03, r4= 3.53,
 igr1= 891, 892,
 &end
#
#   25 ALA  HN          104 VAL  MGY         3.50    (#    650:20  Preassigned    2.17, 4.76 A)
 &rst
  ixpk= 650, nxpk= 20, iat= 372,  -1, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,
 igr2=1568,1569,1570,1572,1573,1574,
 &end
#
#   40 PHE  HN           40 PHE  HA          5.00    (#    652:20  Preassigned    2.91, 2.95 A)
 &rst
  ixpk= 652, nxpk= 20, iat= 564, 566, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50,  &end
#
#   41 PRO  HA           40 PHE  HA          2.70    (#    654:20  Preassigned    2.22, 2.38 A)
 &rst
  ixpk= 654, nxpk= 20, iat= 594, 566, r1= 1.30, r2= 1.80, r3= 2.70, r4= 3.20,  &end
#
#   40 PHE  QB           40 PHE  HA          3.50    (#    655:20  Preassigned    2.34, 2.73 A)
 &rst
  ixpk= 655, nxpk= 20, iat=  -1, 566, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1= 568, 569,
 &end
#
#   58 ASP  HN           57 GLU  HA          3.50    (#    657:20  Preassigned    3.24, 3.45 A)
 &rst
  ixpk= 657, nxpk= 20, iat= 846, 833, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   57 GLU  QG           57 GLU  HA          3.50    (#    658:20  Preassigned    2.55, 3.42 A)
 &rst
  ixpk= 658, nxpk= 20, iat=  -1, 833, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1= 838, 839,
 &end
#
#   57 GLU  QB           57 GLU  HA          3.50    (#    659:20  Preassigned    2.36, 2.65 A)
 &rst
  ixpk= 659, nxpk= 20, iat=  -1, 833, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1= 835, 836,
 &end
#
#   56 GLN  HN           56 GLN  HA          2.70    (#    660:20  Preassigned    2.55, 2.63 A)
 &rst
  ixpk= 660, nxpk= 20, iat= 814, 816, r1= 1.30, r2= 1.80, r3= 2.70, r4= 3.20,  &end
#
#   56 GLN  HG+          56 GLN  HA          3.50    (#    661:20  Unique         2.37, 3.00 A)
 &rst
  ixpk= 661, nxpk= 20, iat=  -1, 816, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1= 821, 822,
 &end
#
#   56 GLN  HB+          56 GLN  HA          2.70    (#    662:20  Preassigned    2.38, 2.69 A)
 &rst
  ixpk= 662, nxpk= 20, iat=  -1, 816, r1= 1.30, r2= 1.80, r3= 3.03, r4= 3.53,
 igr1= 818, 819,
 &end
#
#   56 GLN  HB-          56 GLN  HA          3.50    (#    663:20  Preassigned    2.38, 2.69 A)
 &rst
  ixpk= 663, nxpk= 20, iat=  -1, 816, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1= 818, 819,
 &end
#
#   40 PHE  QD           40 PHE  HA          5.00    (#    667:20  Unique         2.45, 3.45 A)
 &rst
  ixpk= 667, nxpk= 20, iat=  -1, 566, r1= 1.30, r2= 1.80, r3= 5.61, r4= 6.11,
 igr1= 572, 580,
 &end
#
#   57 GLU  HN           57 GLU  HA          5.00    (#    669:20  Unique         2.75, 2.83 A)
 &rst
  ixpk= 669, nxpk= 20, iat= 831, 833, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50,  &end
#
#   96 GLN  HN           96 GLN  HA          3.50    (#    671:20  Unique         2.91, 2.97 A)
 &rst
  ixpk= 671, nxpk= 20, iat=1432,1434, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   97 ASP  HN           96 GLN  HA          2.70    (#    672:20  Preassigned    2.44, 2.50 A)
 &rst
  ixpk= 672, nxpk= 20, iat=1449,1434, r1= 1.30, r2= 1.80, r3= 2.70, r4= 3.20,  &end
#
#    0 AMB  20-3:673      0 AMB  20-2:673    3.50    (#    673:20  Double Ambig)
 &rst
  ixpk= 673, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.95, r4= 5.45,
 igr1= 136, 137,1439,1440,
 igr2=  13,1434,
 &end
#
#   96 GLN  HB-          96 GLN  HA          3.50    (#    674:20  Preassigned    2.50, 2.80 A)
 &rst
  ixpk= 674, nxpk= 20, iat=  -1,1434, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1=1436,1437,
 &end
#
#   96 GLN  HB+          96 GLN  HA          2.70    (#    675:20  Preassigned    2.50, 2.80 A)
 &rst
  ixpk= 675, nxpk= 20, iat=  -1,1434, r1= 1.30, r2= 1.80, r3= 3.03, r4= 3.53,
 igr1=1436,1437,
 &end
#
#   58 ASP  HB+          58 ASP  HA          2.70    (#    686:20  Preassigned    2.40, 2.72 A)
 &rst
  ixpk= 686, nxpk= 20, iat=  -1, 848, r1= 1.30, r2= 1.80, r3= 3.03, r4= 3.53,
 igr1= 850, 851,
 &end
#
#   18 GLN  HG+          18 GLN  HA          3.50    (#    687:20  Preassigned    2.30, 2.98 A)
 &rst
  ixpk= 687, nxpk= 20, iat=  -1, 277, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1= 282, 283,
 &end
#
#   58 ASP  HN           58 ASP  HA          3.50    (#    688:20  Preassigned    2.92, 2.98 A)
 &rst
  ixpk= 688, nxpk= 20, iat= 846, 848, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   59 ASN  HN           58 ASP  HA          3.50    (#    689:20  Preassigned    3.51, 3.53 A)
 &rst
  ixpk= 689, nxpk= 20, iat= 858, 848, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   50 ASP  HN           50 ASP  HA          2.70    (#    690:20  Preassigned    2.21, 2.38 A)
 &rst
  ixpk= 690, nxpk= 20, iat= 732, 734, r1= 1.30, r2= 1.80, r3= 2.70, r4= 3.20,  &end
#
#   50 ASP  HB+          50 ASP  HA          2.70    (#    691:20  Preassigned    2.43, 2.76 A)
 &rst
  ixpk= 691, nxpk= 20, iat=  -1, 734, r1= 1.30, r2= 1.80, r3= 3.03, r4= 3.53,
 igr1= 736, 737,
 &end
#
#   50 ASP  HB-          50 ASP  HA          3.50    (#    692:20  Preassigned    2.43, 2.76 A)
 &rst
  ixpk= 692, nxpk= 20, iat=  -1, 734, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1= 736, 737,
 &end
#
#   30 SER  HN           29 GLN  HA          2.70    (#    693:20  Preassigned    2.16, 2.40 A)
 &rst
  ixpk= 693, nxpk= 20, iat= 443, 428, r1= 1.30, r2= 1.80, r3= 2.70, r4= 3.20,  &end
#
#   18 GLN  HN           18 GLN  HA          5.00    (#    698:20  Unique         2.34, 2.84 A)
 &rst
  ixpk= 698, nxpk= 20, iat= 275, 277, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50,  &end
#
#   18 GLN  HB+          18 GLN  HA          2.70    (#    701:20  Unique         2.41, 2.78 A)
 &rst
  ixpk= 701, nxpk= 20, iat=  -1, 277, r1= 1.30, r2= 1.80, r3= 3.03, r4= 3.53,
 igr1= 279, 280,
 &end
#
#   19 SER  HN           18 GLN  HA          5.00    (#    702:20  Unique         2.18, 2.53 A)
 &rst
  ixpk= 702, nxpk= 20, iat= 292, 277, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50,  &end
#
#    5 GLN  HB+           5 GLN  HA          2.70    (#    703:20  Preassigned    2.35, 2.62 A)
 &rst
  ixpk= 703, nxpk= 20, iat=  -1,  66, r1= 1.30, r2= 1.80, r3= 3.03, r4= 3.53,
 igr1=  68,  69,
 &end
#
#   42 GLU  HN           42 GLU  HA          5.00    (#    704:20  Unique         2.55, 2.65 A)
 &rst
  ixpk= 704, nxpk= 20, iat= 598, 600, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50,  &end
#
#   43 PRO  HD-          42 GLU  HA          2.70    (#    706:20  Preassigned    2.15, 2.33 A)
 &rst
  ixpk= 706, nxpk= 20, iat=  -1, 600, r1= 1.30, r2= 1.80, r3= 3.03, r4= 3.53,
 igr1= 614, 615,
 &end
#
#   42 GLU  QB           42 GLU  HA          3.50    (#    707:20  Preassigned    2.30, 2.67 A)
 &rst
  ixpk= 707, nxpk= 20, iat=  -1, 600, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1= 602, 603,
 &end
#
#    0 AMB  20-3:711     75 LYS  HA          3.50    (#    711:20  Single Ambig)
 &rst
  ixpk= 711, nxpk= 20, iat=  -1,1115, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1=1113,1094,
 &end
#
#    0 AMB  20-3:712      0 AMB  20-2:712    3.50    (#    712:20  Double Ambig)
 &rst
  ixpk= 712, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,
 igr1=1135,  64,
 igr2=1115,  66,
 &end
#
#    0 AMB  20-3:713     75 LYS  HA          2.70    (#    713:20  Single Ambig)
 &rst
  ixpk= 713, nxpk= 20, iat=  -1,1115, r1= 1.30, r2= 1.80, r3= 3.40, r4= 3.90,
 igr1=1117,1118,1145,1146,
 &end
#
#   41 PRO  HA           42 GLU  HA          5.00    (#    716:20  Unique         4.15, 4.25 A)
 &rst
  ixpk= 716, nxpk= 20, iat= 594, 600, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50,  &end
#
#    0 AMB  20-3:717     42 GLU  HA          5.00    (#    717:20  Single Ambig)
 &rst
  ixpk= 717, nxpk= 20, iat=  -1, 600, r1= 1.30, r2= 1.80, r3= 6.30, r4= 6.80,
 igr1= 605, 606, 605, 606,
 &end
#
#   43 PRO  HD+          42 GLU  HA          2.70    (#    718:20  Unique         2.15, 2.33 A)
 &rst
  ixpk= 718, nxpk= 20, iat=  -1, 600, r1= 1.30, r2= 1.80, r3= 3.03, r4= 3.53,
 igr1= 614, 615,
 &end
#
#   26 ASN  HN           26 ASN  HA          3.50    (#    720:20  Preassigned    2.18, 2.31 A)
 &rst
  ixpk= 720, nxpk= 20, iat= 382, 384, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   26 ASN  HB+          26 ASN  HA          3.50    (#    721:20  Preassigned    2.17, 2.62 A)
 &rst
  ixpk= 721, nxpk= 20, iat=  -1, 384, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1= 386, 387,
 &end
#
#   55 GLU  HB3          55 GLU  HA          3.50    (#    722:20  Preassigned    2.27, 2.31 A)
 &rst
  ixpk= 722, nxpk= 20, iat= 804, 801, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   56 GLN  HN           55 GLU  HA          2.70    (#    723:20  Preassigned    2.22, 2.36 A)
 &rst
  ixpk= 723, nxpk= 20, iat= 814, 801, r1= 1.30, r2= 1.80, r3= 2.70, r4= 3.20,  &end
#
#   55 GLU  QG           55 GLU  HA          3.50    (#    725:20  Preassigned    3.75, 3.84 A)
 &rst
  ixpk= 725, nxpk= 20, iat=  -1, 801, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1= 806, 807,
 &end
#
#   55 GLU  HB2          55 GLU  HA          3.50    (#    726:20  Preassigned    2.48, 2.52 A)
 &rst
  ixpk= 726, nxpk= 20, iat= 803, 801, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   30 SER  HA           75 LYS  HA          5.00    (#    728:20  Unique         2.43, 2.95 A)
 &rst
  ixpk= 728, nxpk= 20, iat= 445,1115, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50,  &end
#
#   62 LYS  HB-          62 LYS  HA          3.50    (#    730:20  Unique         2.31, 2.41 A)
 &rst
  ixpk= 730, nxpk= 20, iat=  -1, 904, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1= 906, 907,
 &end
#
#    0 AMB  20-3:735     27 LEU  HA          2.70    (#    735:20  Single Ambig)
 &rst
  ixpk= 735, nxpk= 20, iat=  -1, 398, r1= 1.30, r2= 1.80, r3= 4.09, r4= 4.59,
 igr1= 405, 406, 407, 409, 410, 411, 405, 406, 407, 409,
       410, 411,
 &end
#
#    9 ASN  HA            3 ASP  HA          5.00    (#    737:20  Unique         4.87, 7.02 A)
 &rst
  ixpk= 737, nxpk= 20, iat= 134,  35, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50,  &end
#
#  103 LYS  HN          103 LYS  HA          3.50    (#    738:20  Unique         2.94, 2.98 A)
 &rst
  ixpk= 738, nxpk= 20, iat=1540,1542, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#  103 LYS  HB-         103 LYS  HA          2.70    (#    739:20  Unique         2.23, 2.62 A)
 &rst
  ixpk= 739, nxpk= 20, iat=  -1,1542, r1= 1.30, r2= 1.80, r3= 3.03, r4= 3.53,
 igr1=1544,1545,
 &end
#
#   82 GLU  HG+         103 LYS  HA          3.50    (#    740:20  Unique         2.22, 3.14 A)
 &rst
  ixpk= 740, nxpk= 20, iat=  -1,1542, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1=1237,1238,
 &end
#
#   50 ASP  HN           49 LYS  HA          2.70    (#    741:20  Preassigned    2.11, 2.31 A)
 &rst
  ixpk= 741, nxpk= 20, iat= 732, 712, r1= 1.30, r2= 1.80, r3= 2.70, r4= 3.20,  &end
#
#   98 ALA  HN           86 ILE  MG2         5.00    (#    743:20  Unique         3.75, 4.77 A)
 &rst
  ixpk= 743, nxpk= 20, iat=1461,  -1, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,
 igr2=1297,1298,1299,
 &end
#
#    3 ASP  HB+           3 ASP  HA          3.50    (#    745:20  Unique         2.43, 2.74 A)
 &rst
  ixpk= 745, nxpk= 20, iat=  -1,  35, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1=  37,  38,
 &end
#
#    4 ILE  HN            3 ASP  HA          3.50    (#    746:20  Unique         2.19, 2.61 A)
 &rst
  ixpk= 746, nxpk= 20, iat=  45,  35, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   33 LEU  HB2          33 LEU  HA          5.00    (#    750:20  Preassigned    2.38, 2.53 A)
 &rst
  ixpk= 750, nxpk= 20, iat= 488, 486, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50,  &end
#
#   34 ALA  HN           33 LEU  HA          2.70    (#    751:20  Unique         2.24, 2.56 A)
 &rst
  ixpk= 751, nxpk= 20, iat= 503, 486, r1= 1.30, r2= 1.80, r3= 2.70, r4= 3.20,  &end
#
#   33 LEU  HB3          33 LEU  HA          5.00    (#    752:20  Preassigned    2.19, 2.26 A)
 &rst
  ixpk= 752, nxpk= 20, iat= 489, 486, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50,  &end
#
#   98 ALA  MB           15 ARG  HA          3.50    (#    759:20  Unique         2.29, 3.02 A)
 &rst
  ixpk= 759, nxpk= 20, iat=  -1, 219, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
 igr1=1465,1466,1467,
 &end
#
#   16 ALA  HN           15 ARG  HA          2.70    (#    760:20  Unique         2.05, 2.19 A)
 &rst
  ixpk= 760, nxpk= 20, iat= 241, 219, r1= 1.30, r2= 1.80, r3= 2.70, r4= 3.20,  &end
#
#   15 ARG  HN           15 ARG  HA          5.00    (#    761:20  Unique         2.90, 2.96 A)
 &rst
  ixpk= 761, nxpk= 20, iat= 217, 219, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50,  &end
#
#   16 ALA  MB           15 ARG  HA          5.00    (#    762:20  Unique         4.39, 4.93 A)
 &rst
  ixpk= 762, nxpk= 20, iat=  -1, 219, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,
 igr1= 245, 246, 247,
 &end
#
#   33 LEU  MDX          33 LEU  HA          3.50    (#    763:20  Unique         3.81, 4.75 A)
 &rst
  ixpk= 763, nxpk= 20, iat=  -1, 486, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,
 igr1= 493, 494, 495, 497, 498, 499,
 &end
#
#    0 AMB  20-3:777     72 LEU  HA          5.00    (#    777:20  Single Ambig)
 &rst
  ixpk= 777, nxpk= 20, iat=  -1,1058, r1= 1.30, r2= 1.80, r3= 5.61, r4= 6.11,
 igr1=1056, 945,
 &end
#
#   65 PHE  HA           72 LEU  HA          3.50    (#    778:20  Unique         2.26, 2.75 A)
 &rst
  ixpk= 778, nxpk= 20, iat= 958,1058, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   72 LEU  MDY          72 LEU  HA          3.50    (#    781:20  Unique         2.44, 4.25 A)
 &rst
  ixpk= 781, nxpk= 20, iat=  -1,1058, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,
 igr1=1065,1066,1067,1069,1070,1071,
 &end
#
#   73 ILE  HN           72 LEU  HA          2.70    (#    784:20  Unique         2.13, 2.16 A)
 &rst
  ixpk= 784, nxpk= 20, iat=1075,1058, r1= 1.30, r2= 1.80, r3= 2.70, r4= 3.20,  &end
#
#  107 LYS  HN          106 ALA  HA          2.70    (#    788:20  Unique         2.56, 2.65 A)
 &rst
  ixpk= 788, nxpk= 20, iat=1608,1600, r1= 1.30, r2= 1.80, r3= 2.70, r4= 3.20,  &end
#
#  106 ALA  MB          106 ALA  HA          5.00    (#    790:20  Preassigned    2.41, 2.65 A)
 &rst
  ixpk= 790, nxpk= 20, iat=  -1,1600, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,
 igr1=1602,1603,1604,
 &end
#
#   88 ILE  HN           87 CYS  HA          2.70    (#    796:20  Unique         2.01, 2.10 A)
 &rst
  ixpk= 796, nxpk= 20, iat=1320,1312, r1= 1.30, r2= 1.80, r3= 2.70, r4= 3.20,  &end
#
#   47 TRP  HA           87 CYS  HA          3.50    (#    797:20  Unique         2.18, 2.27 A)
 &rst
  ixpk= 797, nxpk= 20, iat= 674,1312, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   87 CYS  HB2          87 CYS  HA          3.50    (#    798:20  Unique         2.33, 2.49 A)
 &rst
  ixpk= 798, nxpk= 20, iat=1314,1312, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#    0 AMB  20-3:799     87 CYS  HA          5.00    (#    799:20  Single Ambig)
 &rst
  ixpk= 799, nxpk= 20, iat=  -1,1312, r1= 1.30, r2= 1.80, r3= 6.74, r4= 7.24,
 igr1=1333,1334,1335,1297,1298,1299,
 &end
#
#   87 CYS  HB3          87 CYS  HA          3.50    (#    800:20  Unique         2.33, 2.43 A)
 &rst
  ixpk= 800, nxpk= 20, iat=1315,1312, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#    0 AMB  20-3:805     93 ALA  HA          3.50    (#    805:20  Single Ambig)
 &rst
  ixpk= 805, nxpk= 20, iat=  -1,1402, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1=1400,1410,
 &end
#
#   93 ALA  MB           93 ALA  HA          2.70    (#    807:20  Preassigned    2.35, 2.64 A)
 &rst
  ixpk= 807, nxpk= 20, iat=  -1,1402, r1= 1.30, r2= 1.80, r3= 3.24, r4= 3.74,
 igr1=1404,1405,1406,
 &end
#
#   53 PRO  HG-          53 PRO  HD+         3.50    (#    808:20  Unique         2.30, 2.61 A)
 &rst
  ixpk= 808, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,
 igr1= 770, 771,
 igr2= 767, 768,
 &end
#
#   69 GLY  HN           69 GLY  HA-         5.00    (#    845:20  Preassigned    2.20, 2.57 A)
 &rst
  ixpk= 845, nxpk= 20, iat=1023,  -1, r1= 1.30, r2= 1.80, r3= 5.61, r4= 6.11,
 igr2=1025,1026,
 &end
#
#   40 PHE  HN           39 GLY  HA+         3.50    (#    855:20  Unique         2.29, 2.61 A)
 &rst
  ixpk= 855, nxpk= 20, iat= 564,  -1, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr2= 559, 560,
 &end
#
#   49 LYS  HN           48 THR  HB          3.50    (#    882:20  Unique         3.18, 3.34 A)
 &rst
  ixpk= 882, nxpk= 20, iat= 710, 700, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   99 THR  HN           99 THR  HB          3.50    (#    887:20  Unique         2.75, 2.78 A)
 &rst
  ixpk= 887, nxpk= 20, iat=1471,1475, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   99 THR  MG2          99 THR  HB          3.50    (#    888:20  Unique         2.44, 2.68 A)
 &rst
  ixpk= 888, nxpk= 20, iat=  -1,1475, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
 igr1=1477,1478,1479,
 &end
#
#   24 THR  HN           24 THR  HB          5.00    (#    890:20  Unique         2.50, 2.61 A)
 &rst
  ixpk= 890, nxpk= 20, iat= 358, 362, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50,  &end
#
#   24 THR  HA           24 THR  HB          5.00    (#    891:20  Unique         3.02, 3.04 A)
 &rst
  ixpk= 891, nxpk= 20, iat= 360, 362, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50,  &end
#
#   24 THR  MG2          24 THR  HB          3.50    (#    892:20  Unique         2.36, 2.66 A)
 &rst
  ixpk= 892, nxpk= 20, iat=  -1, 362, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
 igr1= 364, 365, 366,
 &end
#
#   32 THR  MG2          32 THR  HB          2.70    (#    896:20  Unique         2.42, 2.67 A)
 &rst
  ixpk= 896, nxpk= 20, iat=  -1, 474, r1= 1.30, r2= 1.80, r3= 3.24, r4= 3.74,
 igr1= 476, 477, 478,
 &end
#
#   32 THR  HN           32 THR  HB          3.50    (#    897:20  Unique         2.44, 2.52 A)
 &rst
  ixpk= 897, nxpk= 20, iat= 470, 474, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   73 ILE  MG2          30 SER  QB          3.50    (#    898:20  Unique         2.56, 4.34 A)
 &rst
  ixpk= 898, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,
 igr1=1081,1082,1083,
 igr2= 447, 448,
 &end
#
#   64 SER  HA           64 SER  HB+         3.50    (#    899:20  Unique         2.40, 2.75 A)
 &rst
  ixpk= 899, nxpk= 20, iat= 947,  -1, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr2= 949, 950,
 &end
#
#   73 ILE  HB           64 SER  HB+         5.00    (#    901:20  Unique         2.67, 3.81 A)
 &rst
  ixpk= 901, nxpk= 20, iat=1079,  -1, r1= 1.30, r2= 1.80, r3= 5.61, r4= 6.11,
 igr2= 949, 950,
 &end
#
#   31 VAL  HN           30 SER  QB          3.50    (#    902:20  Preassigned    3.16, 3.78 A)
 &rst
  ixpk= 902, nxpk= 20, iat= 454,  -1, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr2= 447, 448,
 &end
#
#   30 SER  HN           30 SER  QB          3.50    (#    903:20  Unique         2.63, 3.30 A)
 &rst
  ixpk= 903, nxpk= 20, iat= 443,  -1, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr2= 447, 448,
 &end
#
#   30 SER  HA           30 SER  QB          3.50    (#    904:20  Unique         2.37, 2.66 A)
 &rst
  ixpk= 904, nxpk= 20, iat= 445,  -1, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr2= 447, 448,
 &end
#
#   75 LYS  HA           30 SER  QB          5.00    (#    905:20  Preassigned    2.36, 3.50 A)
 &rst
  ixpk= 905, nxpk= 20, iat=1115,  -1, r1= 1.30, r2= 1.80, r3= 5.61, r4= 6.11,
 igr2= 447, 448,
 &end
#
#   14 VAL  HN           13 SER  QB          5.00    (#    906:20  Preassigned    4.04, 4.43 A)
 &rst
  ixpk= 906, nxpk= 20, iat= 201,  -1, r1= 1.30, r2= 1.80, r3= 5.61, r4= 6.11,
 igr2= 194, 195,
 &end
#
#   13 SER  HN           13 SER  QB          3.50    (#    907:20  Preassigned    2.40, 3.03 A)
 &rst
  ixpk= 907, nxpk= 20, iat= 190,  -1, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr2= 194, 195,
 &end
#
#   13 SER  HA           13 SER  QB          3.50    (#    908:20  Preassigned    2.37, 2.68 A)
 &rst
  ixpk= 908, nxpk= 20, iat= 192,  -1, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr2= 194, 195,
 &end
#
#    0 AMB  20-3:913     77 VAL  HA          5.00    (#    913:20  Single Ambig)
 &rst
  ixpk= 913, nxpk= 20, iat=  -1,1159, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,
 igr1=1175,1220, 384,
 &end
#
#   78 ASP  HN           77 VAL  HA          2.70    (#    918:20  Unique         2.08, 2.20 A)
 &rst
  ixpk= 918, nxpk= 20, iat=1173,1159, r1= 1.30, r2= 1.80, r3= 2.70, r4= 3.20,  &end
#
#    0 AMB  20-3:920     77 VAL  HA          2.70    (#    920:20  Single Ambig)
 &rst
  ixpk= 920, nxpk= 20, iat=  -1,1159, r1= 1.30, r2= 1.80, r3= 3.64, r4= 4.14,
 igr1=1163,1164,1165,1167,1168,1169,
 &end
#
#   79 LYS  HN           79 LYS  HA          5.00    (#    945:20  Unique         2.70, 2.78 A)
 &rst
  ixpk= 945, nxpk= 20, iat=1185,1187, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50,  &end
#
#    0 AMB  20-3:947     79 LYS  HA          2.70    (#    947:20  Single Ambig)
 &rst
  ixpk= 947, nxpk= 20, iat=  -1,1187, r1= 1.30, r2= 1.80, r3= 3.53, r4= 4.03,
 igr1=1195,1196,1566,1189,1190,
 &end
#
#    0 AMB  20-3:948     79 LYS  HA          3.50    (#    948:20  Single Ambig)
 &rst
  ixpk= 948, nxpk= 20, iat=  -1,1187, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,
 igr1=1192,1193,1192,1193,
 &end
#
#  104 VAL  MGX          79 LYS  HA          3.50    (#    949:20  Unique         2.24, 3.93 A)
 &rst
  ixpk= 949, nxpk= 20, iat=  -1,1187, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,
 igr1=1568,1569,1570,1572,1573,1574,
 &end
#
#   97 ASP  HA           14 VAL  MGY         5.00    (#    954:20  Unique         2.29, 3.59 A)
 &rst
  ixpk= 954, nxpk= 20, iat=1451,  -1, r1= 1.30, r2= 1.80, r3= 6.74, r4= 7.24,
 igr2= 207, 208, 209, 211, 212, 213,
 &end
#
#    0 AMB  20-3:955    104 VAL  MGY         3.50    (#    955:20  Single Ambig)
 &rst
  ixpk= 955, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.30, r4= 5.80,
 igr1=1564,1175,
 igr2=1568,1569,1570,1572,1573,1574,
 &end
#
#   10 VAL  MG1          11 PRO  HD+         5.00    (#    963:20  Preassigned    2.79, 4.27 A)
 &rst
  ixpk= 963, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.74, r4= 7.24,
 igr1= 152, 153, 154,
 igr2= 163, 164,
 &end
#
#   10 VAL  HA           11 PRO  HD+         3.50    (#    964:20  Preassigned    2.18, 2.34 A)
 &rst
  ixpk= 964, nxpk= 20, iat= 148,  -1, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr2= 163, 164,
 &end
#
#   11 PRO  QG           11 PRO  HD+         3.50    (#    966:20  Preassigned    2.32, 2.61 A)
 &rst
  ixpk= 966, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,
 igr1= 166, 167,
 igr2= 163, 164,
 &end
#
#   10 VAL  HA           11 PRO  HD-         3.50    (#    967:20  Preassigned    2.18, 2.34 A)
 &rst
  ixpk= 967, nxpk= 20, iat= 148,  -1, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr2= 163, 164,
 &end
#
#   11 PRO  QG           11 PRO  HD-         3.50    (#    968:20  Preassigned    2.32, 2.61 A)
 &rst
  ixpk= 968, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,
 igr1= 166, 167,
 igr2= 163, 164,
 &end
#
#   52 GLU  HA           53 PRO  HD-         3.50    (#    971:20  Unique         2.16, 2.43 A)
 &rst
  ixpk= 971, nxpk= 20, iat= 753,  -1, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr2= 767, 768,
 &end
#
#    0 AMB  20-3:973     53 PRO  HD-         3.50    (#    973:20  Single Ambig)
 &rst
  ixpk= 973, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,
 igr1= 770, 771, 755,
 igr2= 767, 768,
 &end
#
#   53 PRO  HG-          53 PRO  HD-         3.50    (#    974:20  Unique         2.30, 2.61 A)
 &rst
  ixpk= 974, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,
 igr1= 770, 771,
 igr2= 767, 768,
 &end
#
#   42 GLU  HA           43 PRO  HD+         3.50    (#    975:20  Unique         2.15, 2.33 A)
 &rst
  ixpk= 975, nxpk= 20, iat= 600,  -1, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr2= 614, 615,
 &end
#
#    0 AMB  20-3:977      0 AMB  20-2:977    5.00    (#    977:20  Double Ambig)
 &rst
  ixpk= 977, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.94, r4= 8.44,
 igr1= 617, 618, 620, 621,
 igr2= 614, 615, 614, 615,
 &end
#
#   12 PRO  HG+          12 PRO  HD+         3.50    (#    986:20  Preassigned    2.31, 2.61 A)
 &rst
  ixpk= 986, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,
 igr1= 180, 181,
 igr2= 177, 178,
 &end
#
#   11 PRO  HA           12 PRO  HD+         3.50    (#    987:20  Preassigned    2.13, 2.43 A)
 &rst
  ixpk= 987, nxpk= 20, iat= 172,  -1, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr2= 177, 178,
 &end
#
#    0 AMB  20-3:988      0 AMB  20-2:988    5.00    (#    988:20  Double Ambig)
 &rst
  ixpk= 988, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.94, r4= 8.44,
 igr1= 169, 170, 169, 170,
 igr2= 177, 178, 177, 178,
 &end
#
#   41 PRO  HB-          41 PRO  HD+         3.50    (#    991:20  Unique         2.71, 3.67 A)
 &rst
  ixpk= 991, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,
 igr1= 591, 592,
 igr2= 585, 586,
 &end
#
#   51 GLY  HN           51 GLY  HA-         3.50    (#    993:20  Unique         2.30, 2.74 A)
 &rst
  ixpk= 993, nxpk= 20, iat= 744,  -1, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr2= 746, 747,
 &end
#
#   40 PHE  HN           39 GLY  HA-         3.50    (#    997:20  Unique         2.29, 2.61 A)
 &rst
  ixpk= 997, nxpk= 20, iat= 564,  -1, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr2= 559, 560,
 &end
#
#   39 GLY  HN           39 GLY  HA-         3.50    (#    998:20  Unique         2.59, 2.79 A)
 &rst
  ixpk= 998, nxpk= 20, iat= 557,  -1, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr2= 559, 560,
 &end
#
#   64 SER  HA           64 SER  HB-         3.50    (#   1004:20  Unique         2.40, 2.75 A)
 &rst
  ixpk= 1004, nxpk= 20, iat= 947,  -1, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr2= 949, 950,
 &end
#
#    0 AMB  20-3:1005    64 SER  HB-         5.00    (#   1005:20  Single Ambig)
 &rst
  ixpk= 1005, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.74, r4= 7.24,
 igr1=1079,1123,1124,
 igr2= 949, 950,
 &end
#
#   76 LYS  HN           76 LYS  HA          3.50    (#   1009:20  Unique         2.34, 2.88 A)
 &rst
  ixpk= 1009, nxpk= 20, iat=1135,1137, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   77 VAL  HN           76 LYS  HA          3.50    (#   1010:20  Preassigned    2.20, 2.58 A)
 &rst
  ixpk= 1010, nxpk= 20, iat=1157,1137, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   28 SER  HA           76 LYS  HA          5.00    (#   1011:20  Unique         2.16, 2.57 A)
 &rst
  ixpk= 1011, nxpk= 20, iat= 417,1137, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50,  &end
#
#    0 AMB  20-3:1013    76 LYS  HA          3.50    (#   1013:20  Single Ambig)
 &rst
  ixpk= 1013, nxpk= 20, iat=  -1,1137, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,
 igr1=1145,1146,1139,1140,
 &end
#
#    0 AMB  20-3:1014    76 LYS  HA          5.00    (#   1014:20  Single Ambig)
 &rst
  ixpk= 1014, nxpk= 20, iat=  -1,1137, r1= 1.30, r2= 1.80, r3= 6.30, r4= 6.80,
 igr1=1142,1143,1142,1143,
 &end
#
#   42 GLU  HA           43 PRO  HD-         3.50    (#   1019:20  Unique         2.15, 2.33 A)
 &rst
  ixpk= 1019, nxpk= 20, iat= 600,  -1, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr2= 614, 615,
 &end
#
#    0 AMB  20-3:1022    43 PRO  HD-         5.00    (#   1022:20  Single Ambig)
 &rst
  ixpk= 1022, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.07, r4= 7.57,
 igr1= 617, 618, 620, 621,
 igr2= 614, 615,
 &end
#
#  105 PHE  HN          105 PHE  HB2         3.50    (#   1034:20  Unique         3.58, 3.62 A)
 &rst
  ixpk= 1034, nxpk= 20, iat=1578,1582, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#  105 PHE  HA          105 PHE  HB2         3.50    (#   1035:20  Unique         2.35, 2.43 A)
 &rst
  ixpk= 1035, nxpk= 20, iat=1580,1582, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#    0 AMB  20-3:1039   101 HIS  QB          3.50    (#   1039:20  Single Ambig)
 &rst
  ixpk= 1039, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,
 igr1=1506, 305,
 igr2=1508,1509,
 &end
#
#  101 HIS  HN          101 HIS  QB          3.50    (#   1041:20  Unique         2.43, 3.09 A)
 &rst
  ixpk= 1041, nxpk= 20, iat=1504,  -1, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr2=1508,1509,
 &end
#
#   42 GLU  HN           41 PRO  HA          3.50    (#   1044:20  Unique         2.25, 2.33 A)
 &rst
  ixpk= 1044, nxpk= 20, iat= 598, 594, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   40 PHE  HA           41 PRO  HA          3.50    (#   1045:20  Unique         2.22, 2.38 A)
 &rst
  ixpk= 1045, nxpk= 20, iat= 566, 594, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   41 PRO  HB+          41 PRO  HA          3.50    (#   1047:20  Unique         2.30, 2.64 A)
 &rst
  ixpk= 1047, nxpk= 20, iat=  -1, 594, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1= 591, 592,
 &end
#
#   41 PRO  HB-          41 PRO  HA          3.50    (#   1048:20  Unique         2.30, 2.64 A)
 &rst
  ixpk= 1048, nxpk= 20, iat=  -1, 594, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1= 591, 592,
 &end
#
#   45 MET  ME           35 CYS  HB+         5.00    (#   1061:20  Preassigned    2.38, 4.18 A)
 &rst
  ixpk= 1061, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.74, r4= 7.24,
 igr1= 652, 653, 654,
 igr2= 517, 518,
 &end
#
#   14 VAL  MGX          35 CYS  HB+         5.00    (#   1062:20  Unique         2.37, 5.84 A)
 &rst
  ixpk= 1062, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.57, r4= 8.07,
 igr1= 207, 208, 209, 211, 212, 213,
 igr2= 517, 518,
 &end
#
#   15 ARG  HG+          15 ARG  QD          2.70    (#   1064:20  Preassigned    2.31, 2.65 A)
 &rst
  ixpk= 1064, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 3.40, r4= 3.90,
 igr1= 224, 225,
 igr2= 227, 228,
 &end
#
#   78 ASP  HA           78 ASP  HB+         3.50    (#   1065:20  Unique         2.41, 2.66 A)
 &rst
  ixpk= 1065, nxpk= 20, iat=1175,  -1, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr2=1177,1178,
 &end
#
#   79 LYS  HN           78 ASP  HB+         3.50    (#   1070:20  Unique         2.11, 3.17 A)
 &rst
  ixpk= 1070, nxpk= 20, iat=1185,  -1, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr2=1177,1178,
 &end
#
#    0 AMB  20-3:1072    65 PHE  HB3         5.00    (#   1072:20  Single Ambig)
 &rst
  ixpk= 1072, nxpk= 20, iat=  -1, 961, r1= 1.30, r2= 1.80, r3= 5.61, r4= 6.11,
 igr1= 956,1075,
 &end
#
#   40 PHE  QD           40 PHE  QB          5.00    (#   1073:20  Preassigned    2.35, 3.09 A)
 &rst
  ixpk= 1073, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.30, r4= 6.80,
 igr1= 572, 580,
 igr2= 568, 569,
 &end
#
#   40 PHE  HA           40 PHE  QB          3.50    (#   1074:20  Preassigned    2.34, 2.73 A)
 &rst
  ixpk= 1074, nxpk= 20, iat= 566,  -1, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr2= 568, 569,
 &end
#
#    0 AMB  20-3:1075     0 AMB  20-2:1075   5.00    (#   1075:20  Double Ambig)
 &rst
  ixpk= 1075, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.74, r4= 7.24,
 igr1= 148,1032,
 igr2= 568, 569, 961,
 &end
#
#   73 ILE  HG1-         65 PHE  HB3         5.00    (#   1076:20  Unique         6.10, 7.23 A)
 &rst
  ixpk= 1076, nxpk= 20, iat=  -1, 961, r1= 1.30, r2= 1.80, r3= 5.61, r4= 6.11,
 igr1=1085,1086,
 &end
#
#   73 ILE  MD1          65 PHE  HB3         5.00    (#   1077:20  Unique         4.41, 5.68 A)
 &rst
  ixpk= 1077, nxpk= 20, iat=  -1, 961, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,
 igr1=1088,1089,1090,
 &end
#
#    0 AMB  20-3:1081     0 AMB  20-2:1081   5.00    (#   1081:20  Double Ambig)
 &rst
  ixpk= 1081, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.07, r4= 7.57,
 igr1=1115,  13,
 igr2=1126,1127,  24,  25,
 &end
#
#    0 AMB  20-3:1089     0 AMB  20-2:1089   3.50    (#   1089:20  Double Ambig)
 &rst
  ixpk= 1089, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.94, r4= 6.44,
 igr1=1189,1190,  15,  16,1195,1196,
 igr2=1198,1199,  24,  25,
 &end
#
#    0 AMB  20-3:1091     0 AMB  20-2:1091   2.70    (#   1091:20  Double Ambig)
 &rst
  ixpk= 1091, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.59, r4= 5.09,
 igr1=1123,1124,1192,1193,1192,1193,
 igr2=1126,1127,1198,1199,
 &end
#
#    0 AMB  20-3:1099     0 AMB  20-2:1099   3.50    (#   1099:20  Double Ambig)
 &rst
  ixpk= 1099, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.94, r4= 6.44,
 igr1=1145,1146,1388,1389,1139,1140,
 igr2=1148,1149,1391,1392,
 &end
#
#    0 AMB  20-3:1100     0 AMB  20-2:1100   2.70    (#   1100:20  Double Ambig)
 &rst
  ixpk= 1100, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.29, r4= 4.79,
 igr1=1142,1143,1385,1386,
 igr2=1148,1149,1391,1392,
 &end
#
#    0 AMB  20-3:1103     0 AMB  20-2:1103   3.50    (#   1103:20  Double Ambig)
 &rst
  ixpk= 1103, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,
 igr1=1580,1487,
 igr2=1583,1274,1275,
 &end
#
#   68 ASP  HA           68 ASP  HB+         3.50    (#   1106:20  Unique         2.18, 2.60 A)
 &rst
  ixpk= 1106, nxpk= 20, iat=1013,  -1, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr2=1015,1016,
 &end
#
#   50 ASP  HA           50 ASP  HB+         3.50    (#   1109:20  Unique         2.43, 2.76 A)
 &rst
  ixpk= 1109, nxpk= 20, iat= 734,  -1, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr2= 736, 737,
 &end
#
#   59 ASN  HD21         59 ASN  HB+         5.00    (#   1111:20  Unique         2.29, 3.56 A)
 &rst
  ixpk= 1111, nxpk= 20, iat= 867,  -1, r1= 1.30, r2= 1.80, r3= 5.61, r4= 6.11,
 igr2= 862, 863,
 &end
#
#   59 ASN  HA           59 ASN  HB+         3.50    (#   1112:20  Unique         2.39, 2.73 A)
 &rst
  ixpk= 1112, nxpk= 20, iat= 860,  -1, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr2= 862, 863,
 &end
#
#   59 ASN  HA           59 ASN  HB-         5.00    (#   1118:20  Unique         2.39, 2.73 A)
 &rst
  ixpk= 1118, nxpk= 20, iat= 860,  -1, r1= 1.30, r2= 1.80, r3= 5.61, r4= 6.11,
 igr2= 862, 863,
 &end
#
#   26 ASN  HA           26 ASN  HB-         5.00    (#   1126:20  Unique         2.17, 2.62 A)
 &rst
  ixpk= 1126, nxpk= 20, iat= 384,  -1, r1= 1.30, r2= 1.80, r3= 5.61, r4= 6.11,
 igr2= 386, 387,
 &end
#
#   82 GLU  HB-          82 GLU  HG+         3.50    (#   1129:20  Unique         2.30, 2.77 A)
 &rst
  ixpk= 1129, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,
 igr1=1234,1235,
 igr2=1237,1238,
 &end
#
#  103 LYS  HA           82 GLU  HG+         5.00    (#   1130:20  Unique         2.22, 3.14 A)
 &rst
  ixpk= 1130, nxpk= 20, iat=1542,  -1, r1= 1.30, r2= 1.80, r3= 5.61, r4= 6.11,
 igr2=1237,1238,
 &end
#
#    0 AMB  20-3:1140     0 AMB  20-2:1140   2.70    (#   1140:20  Double Ambig)
 &rst
  ixpk= 1140, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.29, r4= 4.79,
 igr1=1142,1143, 906, 907,
 igr2=1139,1140,1139,1140,
 &end
#
#    0 AMB  20-3:1157     0 AMB  20-2:1157   5.00    (#   1157:20  Double Ambig)
 &rst
  ixpk= 1157, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 9.53, r4=10.03,
 igr1=1439,1440,1177,1178,
 igr2= 207, 208, 209, 211, 212, 213,1568,1569,1570,1572,
      1573,1574,
 &end
#
#   11 PRO  HA           12 PRO  HD-         3.50    (#   1162:20  Preassigned    2.13, 2.43 A)
 &rst
  ixpk= 1162, nxpk= 20, iat= 172,  -1, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr2= 177, 178,
 &end
#
#   11 PRO  HB-          12 PRO  HD-         5.00    (#   1165:20  Unique         2.25, 3.90 A)
 &rst
  ixpk= 1165, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.30, r4= 6.80,
 igr1= 169, 170,
 igr2= 177, 178,
 &end
#
#    0 AMB  20-3:1166    12 PRO  HD-         3.50    (#   1166:20  Single Ambig)
 &rst
  ixpk= 1166, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.30, r4= 5.80,
 igr1= 180, 181, 183, 184, 617, 618,
 igr2= 177, 178,
 &end
#
#    0 AMB  20-3:1167    12 PRO  HD-         5.00    (#   1167:20  Single Ambig)
 &rst
  ixpk= 1167, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.07, r4= 7.57,
 igr1= 180, 181, 183, 184,
 igr2= 177, 178,
 &end
#
#   41 PRO  HB-          41 PRO  HD-         3.50    (#   1168:20  Unique         2.71, 3.67 A)
 &rst
  ixpk= 1168, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,
 igr1= 591, 592,
 igr2= 585, 586,
 &end
#
#   14 VAL  MGX          35 CYS  HB-         3.50    (#   1169:20  Unique         2.37, 5.84 A)
 &rst
  ixpk= 1169, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.30, r4= 5.80,
 igr1= 207, 208, 209, 211, 212, 213,
 igr2= 517, 518,
 &end
#
#    0 AMB  20-3:1179     0 AMB  20-2:1179   3.50    (#   1179:20  Double Ambig)
 &rst
  ixpk= 1179, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.80, r4= 7.30,
 igr1=1333,1334,1335,1326,1327,1328,1297,1298,1299,
 igr2=1453,1454,1453,1454,1453,1454,
 &end
#
#   38 ASP  HN           38 ASP  QB          5.00    (#   1180:20  Unique         2.36, 3.05 A)
 &rst
  ixpk= 1180, nxpk= 20, iat= 545,  -1, r1= 1.30, r2= 1.80, r3= 5.61, r4= 6.11,
 igr2= 549, 550,
 &end
#
#   39 GLY  HN           38 ASP  QB          3.50    (#   1181:20  Unique         3.57, 4.07 A)
 &rst
  ixpk= 1181, nxpk= 20, iat= 557,  -1, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr2= 549, 550,
 &end
#
#   38 ASP  HA           38 ASP  QB          3.50    (#   1182:20  Unique         2.28, 2.67 A)
 &rst
  ixpk= 1182, nxpk= 20, iat= 547,  -1, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr2= 549, 550,
 &end
#
#   78 ASP  HA           78 ASP  HB-         3.50    (#   1185:20  Unique         2.41, 2.66 A)
 &rst
  ixpk= 1185, nxpk= 20, iat=1175,  -1, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr2=1177,1178,
 &end
#
#   36 ASP  HA           36 ASP  HB2         5.00    (#   1187:20  Unique         2.31, 2.40 A)
 &rst
  ixpk= 1187, nxpk= 20, iat= 525, 527, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50,  &end
#
#    0 AMB  20-3:1204    22 ASN  QB          3.50    (#   1204:20  Single Ambig)
 &rst
  ixpk= 1204, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,
 igr1= 348, 334,
 igr2= 338, 339,
 &end
#
#   22 ASN  HA           22 ASN  QB          5.00    (#   1205:20  Unique         2.29, 2.51 A)
 &rst
  ixpk= 1205, nxpk= 20, iat= 336,  -1, r1= 1.30, r2= 1.80, r3= 5.61, r4= 6.11,
 igr2= 338, 339,
 &end
#
#    0 AMB  20-3:1209    81 ASP  HB-         5.00    (#   1209:20  Single Ambig)
 &rst
  ixpk= 1209, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 9.32, r4= 9.82,
 igr1=1163,1164,1165,1568,1569,1570,1572,1573,1574,1530,
      1531,1532,1534,1535,1536,1530,1531,1532,1534,1535,
      1536,
 igr2=1222,1223,
 &end
#
#    0 AMB  20-3:1219     0 AMB  20-2:1219   5.00    (#   1219:20  Double Ambig)
 &rst
  ixpk= 1219, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.07, r4= 7.57,
 igr1=1378,  81,
 igr2=1368,1369,  37,  38,
 &end
#
#   91 ASN  HA           91 ASN  HB-         5.00    (#   1220:20  Unique         2.24, 2.42 A)
 &rst
  ixpk= 1220, nxpk= 20, iat=1366,  -1, r1= 1.30, r2= 1.80, r3= 5.61, r4= 6.11,
 igr2=1368,1369,
 &end
#
#   58 ASP  HN           58 ASP  HB-         5.00    (#   1221:20  Unique         2.37, 3.01 A)
 &rst
  ixpk= 1221, nxpk= 20, iat= 846,  -1, r1= 1.30, r2= 1.80, r3= 5.61, r4= 6.11,
 igr2= 850, 851,
 &end
#
#   58 ASP  HA           58 ASP  HB-         3.50    (#   1222:20  Unique         2.40, 2.72 A)
 &rst
  ixpk= 1222, nxpk= 20, iat= 848,  -1, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr2= 850, 851,
 &end
#
#   90 GLU  HN           91 ASN  HB-         5.00    (#   1225:20  Unique         4.51, 5.42 A)
 &rst
  ixpk= 1225, nxpk= 20, iat=1349,  -1, r1= 1.30, r2= 1.80, r3= 5.61, r4= 6.11,
 igr2=1368,1369,
 &end
#
#   50 ASP  HA           50 ASP  HB-         3.50    (#   1228:20  Unique         2.43, 2.76 A)
 &rst
  ixpk= 1228, nxpk= 20, iat= 734,  -1, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr2= 736, 737,
 &end
#
#    9 ASN  HA            9 ASN  QB          3.50    (#   1231:20  Unique         2.30, 2.60 A)
 &rst
  ixpk= 1231, nxpk= 20, iat= 134,  -1, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr2= 136, 137,
 &end
#
#    9 ASN  HN            9 ASN  QB          3.50    (#   1232:20  Unique         2.29, 3.13 A)
 &rst
  ixpk= 1232, nxpk= 20, iat= 132,  -1, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr2= 136, 137,
 &end
#
#    9 ASN  HD21          9 ASN  QB          5.00    (#   1233:20  Unique         2.32, 3.71 A)
 &rst
  ixpk= 1233, nxpk= 20, iat= 141,  -1, r1= 1.30, r2= 1.80, r3= 5.61, r4= 6.11,
 igr2= 136, 137,
 &end
#
#   93 ALA  MB            9 ASN  QB          3.50    (#   1234:20  Unique         2.11, 3.64 A)
 &rst
  ixpk= 1234, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,
 igr1=1404,1405,1406,
 igr2= 136, 137,
 &end
#
#   59 ASN  HD21         59 ASN  HB-         5.00    (#   1238:20  Unique         2.29, 3.56 A)
 &rst
  ixpk= 1238, nxpk= 20, iat= 867,  -1, r1= 1.30, r2= 1.80, r3= 5.61, r4= 6.11,
 igr2= 862, 863,
 &end
#
#   96 GLN  HA           96 GLN  HG+         5.00    (#   1249:20  Unique         2.39, 3.01 A)
 &rst
  ixpk= 1249, nxpk= 20, iat=1434,  -1, r1= 1.30, r2= 1.80, r3= 5.61, r4= 6.11,
 igr2=1439,1440,
 &end
#
#   42 GLU  HN           42 GLU  HG+         3.50    (#   1250:20  Unique         2.05, 3.06 A)
 &rst
  ixpk= 1250, nxpk= 20, iat= 598,  -1, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr2= 605, 606,
 &end
#
#   42 GLU  QB           42 GLU  HG+         2.70    (#   1252:20  Preassigned    2.29, 2.71 A)
 &rst
  ixpk= 1252, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 3.40, r4= 3.90,
 igr1= 602, 603,
 igr2= 605, 606,
 &end
#
#   97 ASP  HN           96 GLN  HG+         3.50    (#   1254:20  Preassigned    3.73, 4.09 A)
 &rst
  ixpk= 1254, nxpk= 20, iat=1449,  -1, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr2=1439,1440,
 &end
#
#   97 ASP  HN           96 GLN  HG-         5.00    (#   1258:20  Preassigned    3.73, 4.09 A)
 &rst
  ixpk= 1258, nxpk= 20, iat=1449,  -1, r1= 1.30, r2= 1.80, r3= 5.61, r4= 6.11,
 igr2=1439,1440,
 &end
#
#   43 PRO  HD+          43 PRO  HG+         5.00    (#   1276:20  Unique         2.30, 2.61 A)
 &rst
  ixpk= 1276, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.30, r4= 6.80,
 igr1= 614, 615,
 igr2= 617, 618,
 &end
#
#   97 ASP  HA           97 ASP  HB-         3.50    (#   1317:20  Unique         2.37, 2.47 A)
 &rst
  ixpk= 1317, nxpk= 20, iat=1451,  -1, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr2=1453,1454,
 &end
#
#    0 AMB  20-3:1319    97 ASP  HB-         3.50    (#   1319:20  Single Ambig)
 &rst
  ixpk= 1319, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1=1333,1334,1335,1326,1327,1328,1297,1298,1299,
 igr2=1453,1454,
 &end
#
#   36 ASP  HN           36 ASP  HB3         3.50    (#   1320:20  Unique         2.65, 2.82 A)
 &rst
  ixpk= 1320, nxpk= 20, iat= 523, 528, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   72 LEU  MDY          63 TYR  QB          5.00    (#   1325:20  Unique         2.35, 4.05 A)
 &rst
  ixpk= 1325, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.57, r4= 8.07,
 igr1=1065,1066,1067,1069,1070,1071,
 igr2= 928, 929,
 &end
#
#   60 GLU  HB+          60 GLU  HG-         2.70    (#   1334:20  Unique         2.38, 2.75 A)
 &rst
  ixpk= 1334, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 3.40, r4= 3.90,
 igr1= 876, 877,
 igr2= 879, 880,
 &end
#
#   60 GLU  HA           60 GLU  HG-         3.50    (#   1337:20  Unique         2.40, 2.98 A)
 &rst
  ixpk= 1337, nxpk= 20, iat= 874,  -1, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr2= 879, 880,
 &end
#
#   60 GLU  HB-          60 GLU  HG+         2.70    (#   1338:20  Unique         2.38, 2.75 A)
 &rst
  ixpk= 1338, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 3.40, r4= 3.90,
 igr1= 876, 877,
 igr2= 879, 880,
 &end
#
#   71 GLU  QB           71 GLU  QG          3.50    (#   1340:20  Unique         2.30, 2.73 A)
 &rst
  ixpk= 1340, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,
 igr1=1045,1046,
 igr2=1048,1049,
 &end
#
#   34 ALA  MB           71 GLU  QG          5.00    (#   1341:20  Unique         2.32, 3.75 A)
 &rst
  ixpk= 1341, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.74, r4= 7.24,
 igr1= 507, 508, 509,
 igr2=1048,1049,
 &end
#
#    0 AMB  20-3:1346     0 AMB  20-2:1346   2.70    (#   1346:20  Double Ambig)
 &rst
  ixpk= 1346, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.29, r4= 4.79,
 igr1=1421,1422, 891, 892,
 igr2=1356,1357, 894, 895,
 &end
#
#   94 GLY  HA-          90 GLU  HG+         5.00    (#   1347:20  Unique         4.94, 6.70 A)
 &rst
  ixpk= 1347, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.30, r4= 6.80,
 igr1=1412,1413,
 igr2=1356,1357,
 &end
#
#    0 AMB  20-3:1348     0 AMB  20-2:1348   3.50    (#   1348:20  Double Ambig)
 &rst
  ixpk= 1348, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.95, r4= 5.45,
 igr1=1043,1351,
 igr2=1048,1049,1356,1357,
 &end
#
#   57 GLU  HA           57 GLU  QG          3.50    (#   1353:20  Unique         2.55, 3.42 A)
 &rst
  ixpk= 1353, nxpk= 20, iat= 833,  -1, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr2= 838, 839,
 &end
#
#   57 GLU  HN           57 GLU  QG          3.50    (#   1355:20  Unique         1.95, 2.75 A)
 &rst
  ixpk= 1355, nxpk= 20, iat= 831,  -1, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr2= 838, 839,
 &end
#
#    0 AMB  20-3:1356    57 GLU  QG          2.70    (#   1356:20  Single Ambig)
 &rst
  ixpk= 1356, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 3.64, r4= 4.14,
 igr1= 835, 836, 803,
 igr2= 838, 839,
 &end
#
#   82 GLU  HA           82 GLU  HG-         5.00    (#   1361:20  Unique         2.35, 2.86 A)
 &rst
  ixpk= 1361, nxpk= 20, iat=1232,  -1, r1= 1.30, r2= 1.80, r3= 5.61, r4= 6.11,
 igr2=1237,1238,
 &end
#
#    0 AMB  20-3:1363    90 GLU  HG-         2.70    (#   1363:20  Single Ambig)
 &rst
  ixpk= 1363, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.09, r4= 4.59,
 igr1=1421,1422,1421,1422,1353,1354,
 igr2=1356,1357,
 &end
#
#   55 GLU  HN           55 GLU  QG          3.50    (#   1366:20  Unique         1.91, 2.45 A)
 &rst
  ixpk= 1366, nxpk= 20, iat= 799,  -1, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr2= 806, 807,
 &end
#
#   55 GLU  HA           55 GLU  QG          3.50    (#   1369:20  Unique         3.75, 3.84 A)
 &rst
  ixpk= 1369, nxpk= 20, iat= 801,  -1, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr2= 806, 807,
 &end
#
#   10 VAL  MG2          10 VAL  HB          2.70    (#   1372:20  Unique         2.44, 2.67 A)
 &rst
  ixpk= 1372, nxpk= 20, iat=  -1, 150, r1= 1.30, r2= 1.80, r3= 3.24, r4= 3.74,
 igr1= 156, 157, 158,
 &end
#
#   52 GLU  HN           52 GLU  HG+         5.00    (#   1374:20  Unique         2.49, 3.55 A)
 &rst
  ixpk= 1374, nxpk= 20, iat= 751,  -1, r1= 1.30, r2= 1.80, r3= 5.61, r4= 6.11,
 igr2= 758, 759,
 &end
#
#   52 GLU  HA           52 GLU  HG+         5.00    (#   1375:20  Unique         3.69, 3.98 A)
 &rst
  ixpk= 1375, nxpk= 20, iat= 753,  -1, r1= 1.30, r2= 1.80, r3= 5.61, r4= 6.11,
 igr2= 758, 759,
 &end
#
#   52 GLU  HN           52 GLU  HG-         5.00    (#   1376:20  Unique         2.49, 3.55 A)
 &rst
  ixpk= 1376, nxpk= 20, iat= 751,  -1, r1= 1.30, r2= 1.80, r3= 5.61, r4= 6.11,
 igr2= 758, 759,
 &end
#
#   52 GLU  HA           52 GLU  HG-         5.00    (#   1377:20  Unique         3.69, 3.98 A)
 &rst
  ixpk= 1377, nxpk= 20, iat= 753,  -1, r1= 1.30, r2= 1.80, r3= 5.61, r4= 6.11,
 igr2= 758, 759,
 &end
#
#   96 GLN  HN           95 GLU  QG          5.00    (#   1378:20  Unique         2.67, 3.62 A)
 &rst
  ixpk= 1378, nxpk= 20, iat=1432,  -1, r1= 1.30, r2= 1.80, r3= 5.61, r4= 6.11,
 igr2=1424,1425,
 &end
#
#   88 ILE  MG2          95 GLU  QG          3.50    (#   1381:20  Unique         3.50, 4.65 A)
 &rst
  ixpk= 1381, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,
 igr1=1326,1327,1328,
 igr2=1424,1425,
 &end
#
#   95 GLU  HA           95 GLU  QG          5.00    (#   1382:20  Unique         2.38, 2.81 A)
 &rst
  ixpk= 1382, nxpk= 20, iat=1419,  -1, r1= 1.30, r2= 1.80, r3= 5.61, r4= 6.11,
 igr2=1424,1425,
 &end
#
#   18 GLN  HB-          18 GLN  HG-         2.70    (#   1385:20  Unique         2.33, 2.69 A)
 &rst
  ixpk= 1385, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 3.40, r4= 3.90,
 igr1= 279, 280,
 igr2= 282, 283,
 &end
#
#   29 GLN  HA           29 GLN  QG          5.00    (#   1387:20  Unique         2.32, 2.82 A)
 &rst
  ixpk= 1387, nxpk= 20, iat= 428,  -1, r1= 1.30, r2= 1.80, r3= 5.61, r4= 6.11,
 igr2= 433, 434,
 &end
#
#   41 PRO  HA           41 PRO  HB+         3.50    (#   1388:20  Unique         2.30, 2.64 A)
 &rst
  ixpk= 1388, nxpk= 20, iat= 594,  -1, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr2= 591, 592,
 &end
#
#   42 GLU  HN           41 PRO  HB+         5.00    (#   1390:20  Unique         2.59, 3.05 A)
 &rst
  ixpk= 1390, nxpk= 20, iat= 598,  -1, r1= 1.30, r2= 1.80, r3= 5.61, r4= 6.11,
 igr2= 591, 592,
 &end
#
#   41 PRO  QG           41 PRO  HB+         3.50    (#   1391:20  Unique         2.38, 2.64 A)
 &rst
  ixpk= 1391, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,
 igr1= 588, 589,
 igr2= 591, 592,
 &end
#
#    0 AMB  20-3:1395     0 AMB  20-2:1395   5.00    (#   1395:20  Double Ambig)
 &rst
  ixpk= 1395, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.07, r4= 7.57,
 igr1= 814, 831,
 igr2= 821, 822, 821, 822,
 &end
#
#    0 AMB  20-3:1396    56 GLN  HG-         5.00    (#   1396:20  Single Ambig)
 &rst
  ixpk= 1396, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.30, r4= 6.80,
 igr1= 814, 831,
 igr2= 821, 822,
 &end
#
#   56 GLN  HA           56 GLN  HG-         5.00    (#   1398:20  Unique         2.37, 3.00 A)
 &rst
  ixpk= 1398, nxpk= 20, iat= 816,  -1, r1= 1.30, r2= 1.80, r3= 5.61, r4= 6.11,
 igr2= 821, 822,
 &end
#
#    8 VAL  HN            8 VAL  HB          5.00    (#   1402:20  Unique         2.39, 2.68 A)
 &rst
  ixpk= 1402, nxpk= 20, iat= 116, 120, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50,  &end
#
#    9 ASN  HN            8 VAL  HB          5.00    (#   1403:20  Unique         1.99, 2.31 A)
 &rst
  ixpk= 1403, nxpk= 20, iat= 132, 120, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50,  &end
#
#    0 AMB  20-3:1405     8 VAL  HB          5.00    (#   1405:20  Single Ambig)
 &rst
  ixpk= 1405, nxpk= 20, iat=  -1, 120, r1= 1.30, r2= 1.80, r3= 5.61, r4= 6.11,
 igr1= 118,  99,
 &end
#
#    8 VAL  MG2           8 VAL  HB          2.70    (#   1406:20  Preassigned    2.42, 2.66 A)
 &rst
  ixpk= 1406, nxpk= 20, iat=  -1, 120, r1= 1.30, r2= 1.80, r3= 3.24, r4= 3.74,
 igr1= 126, 127, 128,
 &end
#
#    6 VAL  HN            6 VAL  HB          5.00    (#   1409:20  Unique         2.59, 2.92 A)
 &rst
  ixpk= 1409, nxpk= 20, iat=  81,  85, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50,  &end
#
#   53 PRO  HA           53 PRO  HB+         3.50    (#   1410:20  Unique         2.21, 2.46 A)
 &rst
  ixpk= 1410, nxpk= 20, iat= 776,  -1, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr2= 773, 774,
 &end
#
#    0 AMB  20-3:1414     0 AMB  20-2:1414   3.50    (#   1414:20  Double Ambig)
 &rst
  ixpk= 1414, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.56, r4= 6.06,
 igr1= 652, 653, 654, 645,
 igr2= 648, 649, 648, 649,
 &end
#
#   45 MET  ME           45 MET  HG-         3.50    (#   1418:20  Unique         2.39, 3.70 A)
 &rst
  ixpk= 1418, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,
 igr1= 652, 653, 654,
 igr2= 648, 649,
 &end
#
#    0 AMB  20-3:1419     6 VAL  HB          5.00    (#   1419:20  Single Ambig)
 &rst
  ixpk= 1419, nxpk= 20, iat=  -1,  85, r1= 1.30, r2= 1.80, r3= 5.61, r4= 6.11,
 igr1=  83,  99,
 &end
#
#   21 MET  HA           21 MET  QG          3.50    (#   1420:20  Unique         2.71, 3.25 A)
 &rst
  ixpk= 1420, nxpk= 20, iat= 319,  -1, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr2= 324, 325,
 &end
#
#    0 AMB  20-3:1421    21 MET  QG          2.70    (#   1421:20  Single Ambig)
 &rst
  ixpk= 1421, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 3.96, r4= 4.46,
 igr1= 279, 280, 328, 329, 330,
 igr2= 324, 325,
 &end
#
#  100 ILE  MG2          21 MET  QG          3.50    (#   1422:20  Unique         3.17, 4.06 A)
 &rst
  ixpk= 1422, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,
 igr1=1491,1492,1493,
 igr2= 324, 325,
 &end
#
#    0 AMB  20-3:1423    21 MET  QG          3.50    (#   1423:20  Single Ambig)
 &rst
  ixpk= 1423, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=1530,1531,1532,1534,1535,1536,1530,1531,1532,1534,
      1535,1536, 460, 461, 462,
 igr2= 324, 325,
 &end
#
#   79 LYS  HG+          79 LYS  HB+         2.70    (#   1424:20  Unique         2.27, 2.70 A)
 &rst
  ixpk= 1424, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 3.40, r4= 3.90,
 igr1=1192,1193,
 igr2=1189,1190,
 &end
#
#   21 MET  HB3          21 MET  QG          2.70    (#   1425:20  Unique         2.42, 2.76 A)
 &rst
  ixpk= 1425, nxpk= 20, iat= 322,  -1, r1= 1.30, r2= 1.80, r3= 3.03, r4= 3.53,
 igr2= 324, 325,
 &end
#
#   21 MET  HB2          21 MET  QG          2.70    (#   1426:20  Unique         2.40, 2.46 A)
 &rst
  ixpk= 1426, nxpk= 20, iat= 321,  -1, r1= 1.30, r2= 1.80, r3= 3.03, r4= 3.53,
 igr2= 324, 325,
 &end
#
#    0 AMB  20-3:1427    21 MET  QG          5.00    (#   1427:20  Single Ambig)
 &rst
  ixpk= 1427, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.30, r4= 6.80,
 igr1= 317, 292,
 igr2= 324, 325,
 &end
#
#    0 AMB  20-3:1428     0 AMB  20-2:1428   2.70    (#   1428:20  Double Ambig)
 &rst
  ixpk= 1428, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.09, r4= 4.59,
 igr1= 646, 818, 819,
 igr2= 648, 649, 648, 649,
 &end
#
#   33 LEU  MDX          21 MET  QG          5.00    (#   1432:20  Unique         2.49, 5.01 A)
 &rst
  ixpk= 1432, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.57, r4= 8.07,
 igr1= 493, 494, 495, 497, 498, 499,
 igr2= 324, 325,
 &end
#
#   84 GLU  HA           84 GLU  HB-         5.00    (#   1436:20  Unique         2.48, 2.79 A)
 &rst
  ixpk= 1436, nxpk= 20, iat=1257,  -1, r1= 1.30, r2= 1.80, r3= 5.61, r4= 6.11,
 igr2=1259,1260,
 &end
#
#   58 ASP  HN            0 AMB  20-2:1441   3.50    (#   1441:20  Single Ambig)
 &rst
  ixpk= 1441, nxpk= 20, iat= 846,  -1, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
 igr2= 835, 836, 803,
 &end
#
#   52 GLU  HA           52 GLU  HB3         5.00    (#   1442:20  Preassigned    2.52, 2.59 A)
 &rst
  ixpk= 1442, nxpk= 20, iat= 753, 756, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50,  &end
#
#   57 GLU  HN           57 GLU  QB          2.70    (#   1444:20  Unique         2.52, 3.13 A)
 &rst
  ixpk= 1444, nxpk= 20, iat= 831,  -1, r1= 1.30, r2= 1.80, r3= 3.03, r4= 3.53,
 igr2= 835, 836,
 &end
#
#    0 AMB  20-3:1445    57 GLU  QB          2.70    (#   1445:20  Single Ambig)
 &rst
  ixpk= 1445, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 3.82, r4= 4.32,
 igr1= 838, 839, 821, 822,
 igr2= 835, 836,
 &end
#
#   57 GLU  HA           57 GLU  QB          2.70    (#   1446:20  Unique         2.36, 2.65 A)
 &rst
  ixpk= 1446, nxpk= 20, iat= 833,  -1, r1= 1.30, r2= 1.80, r3= 3.03, r4= 3.53,
 igr2= 835, 836,
 &end
#
#   52 GLU  HA           52 GLU  HB2         5.00    (#   1447:20  Preassigned    2.26, 2.32 A)
 &rst
  ixpk= 1447, nxpk= 20, iat= 753, 755, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50,  &end
#
#   11 PRO  HA           11 PRO  HB+         3.50    (#   1448:20  Preassigned    2.31, 2.68 A)
 &rst
  ixpk= 1448, nxpk= 20, iat= 172,  -1, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr2= 169, 170,
 &end
#
#   12 PRO  HD+          11 PRO  HB+         3.50    (#   1449:20  Preassigned    2.25, 3.90 A)
 &rst
  ixpk= 1449, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,
 igr1= 177, 178,
 igr2= 169, 170,
 &end
#
#   12 PRO  HD-          11 PRO  HB+         5.00    (#   1450:20  Preassigned    2.25, 3.90 A)
 &rst
  ixpk= 1450, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.30, r4= 6.80,
 igr1= 177, 178,
 igr2= 169, 170,
 &end
#
#   52 GLU  HN           52 GLU  HB3         5.00    (#   1451:20  Unique         2.88, 3.30 A)
 &rst
  ixpk= 1451, nxpk= 20, iat= 751, 756, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50,  &end
#
#   11 PRO  HA           11 PRO  HB-         3.50    (#   1452:20  Preassigned    2.31, 2.68 A)
 &rst
  ixpk= 1452, nxpk= 20, iat= 172,  -1, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr2= 169, 170,
 &end
#
#    0 AMB  20-3:1453    11 PRO  HB-         3.50    (#   1453:20  Single Ambig)
 &rst
  ixpk= 1453, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.95, r4= 5.45,
 igr1= 177, 178, 163, 164,
 igr2= 169, 170,
 &end
#
#    0 AMB  20-3:1455     0 AMB  20-2:1455   5.00    (#   1455:20  Double Ambig)
 &rst
  ixpk= 1455, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.07, r4= 7.57,
 igr1= 443,1157,
 igr2= 430, 431, 430, 431,
 &end
#
#    0 AMB  20-3:1456    29 GLN  HB-         3.50    (#   1456:20  Single Ambig)
 &rst
  ixpk= 1456, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,
 igr1= 443,1157,
 igr2= 430, 431,
 &end
#
#   12 PRO  HD-          11 PRO  HB-         5.00    (#   1457:20  Preassigned    2.25, 3.90 A)
 &rst
  ixpk= 1457, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.30, r4= 6.80,
 igr1= 177, 178,
 igr2= 169, 170,
 &end
#
#   60 GLU  HA           60 GLU  HB+         3.50    (#   1464:20  Unique         2.38, 2.74 A)
 &rst
  ixpk= 1464, nxpk= 20, iat= 874,  -1, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr2= 876, 877,
 &end
#
#    0 AMB  20-3:1466     0 AMB  20-2:1466   3.50    (#   1466:20  Double Ambig)
 &rst
  ixpk= 1466, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1= 874, 801,1542,
 igr2= 876, 877, 818, 819,1234,1235,
 &end
#
#    0 AMB  20-3:1467     0 AMB  20-2:1467   5.00    (#   1467:20  Double Ambig)
 &rst
  ixpk= 1467, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.07, r4= 7.57,
 igr1= 814, 831,
 igr2= 818, 819, 818, 819,
 &end
#
#    0 AMB  20-3:1468     0 AMB  20-2:1468   2.70    (#   1468:20  Double Ambig)
 &rst
  ixpk= 1468, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.37, r4= 4.87,
 igr1=  66, 816,1232,
 igr2=  68,  69, 818, 819,1234,1235,
 &end
#
#   53 PRO  HD-          53 PRO  HG+         3.50    (#   1472:20  Unique         2.30, 2.61 A)
 &rst
  ixpk= 1472, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,
 igr1= 767, 768,
 igr2= 770, 771,
 &end
#
#   53 PRO  HD+          53 PRO  HG+         3.50    (#   1476:20  Unique         2.30, 2.61 A)
 &rst
  ixpk= 1476, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,
 igr1= 767, 768,
 igr2= 770, 771,
 &end
#
#   53 PRO  HB+          53 PRO  HG+         3.50    (#   1477:20  Unique         2.39, 2.66 A)
 &rst
  ixpk= 1477, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,
 igr1= 773, 774,
 igr2= 770, 771,
 &end
#
#   32 THR  HN           21 MET  ME          5.00    (#   1528:20  Preassigned    4.50, 5.56 A)
 &rst
  ixpk= 1528, nxpk= 20, iat= 470,  -1, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,
 igr2= 328, 329, 330,
 &end
#
#   33 LEU  HA           21 MET  ME          5.00    (#   1529:20  Preassigned    3.35, 4.82 A)
 &rst
  ixpk= 1529, nxpk= 20, iat= 486,  -1, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,
 igr2= 328, 329, 330,
 &end
#
#    0 AMB  20-3:1537    21 MET  ME          5.00    (#   1537:20  Single Ambig)
 &rst
  ixpk= 1537, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.57, r4= 8.07,
 igr1= 352, 353, 354,1528,
 igr2= 328, 329, 330,
 &end
#
#  100 ILE  MG2          21 MET  ME          5.00    (#   1538:20  Preassigned    6.01, 7.33 A)
 &rst
  ixpk= 1538, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.21, r4= 7.71,
 igr1=1491,1492,1493,
 igr2= 328, 329, 330,
 &end
#
#   31 VAL  MG1          21 MET  ME          2.70    (#   1539:20  Preassigned    2.86, 3.91 A)
 &rst
  ixpk= 1539, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 3.89, r4= 4.39,
 igr1= 460, 461, 462,
 igr2= 328, 329, 330,
 &end
#
#   33 LEU  MDX          21 MET  ME          5.00    (#   1540:20  Preassigned    2.35, 5.52 A)
 &rst
  ixpk= 1540, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.09, r4= 8.59,
 igr1= 493, 494, 495, 497, 498, 499,
 igr2= 328, 329, 330,
 &end
#
#   21 MET  HA           21 MET  ME          5.00    (#   1543:20  Unique         3.27, 4.10 A)
 &rst
  ixpk= 1543, nxpk= 20, iat= 319,  -1, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,
 igr2= 328, 329, 330,
 &end
#
#  102 LEU  HG          102 LEU  HB-         5.00    (#   1580:20  Preassigned    2.31, 2.63 A)
 &rst
  ixpk= 1580, nxpk= 20, iat=1528,  -1, r1= 1.30, r2= 1.80, r3= 5.61, r4= 6.11,
 igr2=1525,1526,
 &end
#
#    0 AMB  20-3:1582   102 LEU  HB-         3.50    (#   1582:20  Single Ambig)
 &rst
  ixpk= 1582, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.94, r4= 6.44,
 igr1=1530,1531,1532,1534,1535,1536,1530,1531,1532,1534,
      1535,1536,
 igr2=1525,1526,
 &end
#
#    0 AMB  20-3:1584   102 LEU  HB-         5.00    (#   1584:20  Single Ambig)
 &rst
  ixpk= 1584, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.30, r4= 6.80,
 igr1= 491, 488,
 igr2=1525,1526,
 &end
#
#  100 ILE  MD1         100 ILE  HB          3.50    (#   1587:20  Unique         2.31, 3.07 A)
 &rst
  ixpk= 1587, nxpk= 20, iat=  -1,1489, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
 igr1=1498,1499,1500,
 &end
#
#    0 AMB  20-3:1590     0 AMB  20-2:1590   3.50    (#   1590:20  Double Ambig)
 &rst
  ixpk= 1590, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.67, r4= 7.17,
 igr1= 405, 406, 407, 409, 410, 411, 405, 406, 407, 409,
       410, 411,
 igr2= 400, 401, 400, 401,
 &end
#
#    0 AMB  20-3:1595    27 LEU  HB-         3.50    (#   1595:20  Single Ambig)
 &rst
  ixpk= 1595, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.94, r4= 6.44,
 igr1= 405, 406, 407, 409, 410, 411, 405, 406, 407, 409,
       410, 411,
 igr2= 400, 401,
 &end
#
#  100 ILE  HG1+        100 ILE  HB          5.00    (#   1597:20  Unique         2.33, 2.75 A)
 &rst
  ixpk= 1597, nxpk= 20, iat=  -1,1489, r1= 1.30, r2= 1.80, r3= 5.61, r4= 6.11,
 igr1=1495,1496,
 &end
#
#  100 ILE  MG2         100 ILE  HB          3.50    (#   1598:20  Unique         2.36, 2.65 A)
 &rst
  ixpk= 1598, nxpk= 20, iat=  -1,1489, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
 igr1=1491,1492,1493,
 &end
#
#    0 AMB  20-3:1616    86 ILE  HB          2.70    (#   1616:20  Single Ambig)
 &rst
  ixpk= 1616, nxpk= 20, iat=  -1,1295, r1= 1.30, r2= 1.80, r3= 3.89, r4= 4.39,
 igr1=1297,1298,1299,1304,1305,1306,1333,1334,1335,
 &end
#
#    0 AMB  20-3:1618    88 ILE  HB          5.00    (#   1618:20  Single Ambig)
 &rst
  ixpk= 1618, nxpk= 20, iat=  -1,1324, r1= 1.30, r2= 1.80, r3= 5.61, r4= 6.11,
 igr1=1320,1339,
 &end
#
#    0 AMB  20-3:1620    88 ILE  HB          3.50    (#   1620:20  Single Ambig)
 &rst
  ixpk= 1620, nxpk= 20, iat=  -1,1324, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,
 igr1=1326,1327,1328,1333,1334,1335,
 &end
#
#    0 AMB  20-3:1621    88 ILE  HB          5.00    (#   1621:20  Single Ambig)
 &rst
  ixpk= 1621, nxpk= 20, iat=  -1,1324, r1= 1.30, r2= 1.80, r3= 6.54, r4= 7.04,
 igr1=1330,1331, 664, 665, 666,
 &end
#
#   73 ILE  HN           73 ILE  HB          3.50    (#   1622:20  Unique         2.50, 2.64 A)
 &rst
  ixpk= 1622, nxpk= 20, iat=1075,1079, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#    0 AMB  20-3:1623    73 ILE  HB          5.00    (#   1623:20  Single Ambig)
 &rst
  ixpk= 1623, nxpk= 20, iat=  -1,1079, r1= 1.30, r2= 1.80, r3= 5.61, r4= 6.11,
 igr1= 945,1094,
 &end
#
#   73 ILE  MG2          73 ILE  HB          2.70    (#   1624:20  Unique         2.43, 2.67 A)
 &rst
  ixpk= 1624, nxpk= 20, iat=  -1,1079, r1= 1.30, r2= 1.80, r3= 3.24, r4= 3.74,
 igr1=1081,1082,1083,
 &end
#
#    7 ILE  HN            7 ILE  HB          3.50    (#   1632:20  Unique         2.42, 2.60 A)
 &rst
  ixpk= 1632, nxpk= 20, iat=  97, 101, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#    7 ILE  HG1+          7 ILE  HB          3.50    (#   1634:20  Unique         2.42, 2.75 A)
 &rst
  ixpk= 1634, nxpk= 20, iat=  -1, 101, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1= 107, 108,
 &end
#
#    7 ILE  HG1-          7 ILE  HB          5.00    (#   1635:20  Unique         2.42, 2.75 A)
 &rst
  ixpk= 1635, nxpk= 20, iat=  -1, 101, r1= 1.30, r2= 1.80, r3= 5.61, r4= 6.11,
 igr1= 107, 108,
 &end
#
#   74 ILE  MG2          74 ILE  HB          2.70    (#   1637:20  Preassigned    2.33, 2.68 A)
 &rst
  ixpk= 1637, nxpk= 20, iat=  -1,1098, r1= 1.30, r2= 1.80, r3= 3.24, r4= 3.74,
 igr1=1100,1101,1102,
 &end
#
#    7 ILE  MG2           7 ILE  HB          2.70    (#   1640:20  Unique         2.40, 2.67 A)
 &rst
  ixpk= 1640, nxpk= 20, iat=  -1, 101, r1= 1.30, r2= 1.80, r3= 3.24, r4= 3.74,
 igr1= 103, 104, 105,
 &end
#
#   54 ILE  MG2          54 ILE  HB          3.50    (#   1641:20  Unique         2.35, 2.66 A)
 &rst
  ixpk= 1641, nxpk= 20, iat=  -1, 784, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
 igr1= 786, 787, 788,
 &end
#
#   54 ILE  HN           54 ILE  HB          3.50    (#   1642:20  Unique         2.46, 2.60 A)
 &rst
  ixpk= 1642, nxpk= 20, iat= 780, 784, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#    0 AMB  20-3:1643    74 ILE  HB          5.00    (#   1643:20  Single Ambig)
 &rst
  ixpk= 1643, nxpk= 20, iat=  -1,1098, r1= 1.30, r2= 1.80, r3= 7.21, r4= 7.71,
 igr1=1107,1108,1109, 493, 494, 495, 497, 498, 499,
 &end
#
#   74 ILE  HN           74 ILE  HB          5.00    (#   1644:20  Preassigned    2.30, 2.42 A)
 &rst
  ixpk= 1644, nxpk= 20, iat=1094,1098, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50,  &end
#
#   84 GLU  HA           84 GLU  QG          3.50    (#   1646:20  Unique         2.32, 2.90 A)
 &rst
  ixpk= 1646, nxpk= 20, iat=1257,  -1, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr2=1262,1263,
 &end
#
#   84 GLU  HB+          84 GLU  QG          2.70    (#   1647:20  Unique         2.25, 2.68 A)
 &rst
  ixpk= 1647, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 3.40, r4= 3.90,
 igr1=1259,1260,
 igr2=1262,1263,
 &end
#
#   99 THR  MG2          84 GLU  QG          3.50    (#   1648:20  Unique         2.55, 4.53 A)
 &rst
  ixpk= 1648, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,
 igr1=1477,1478,1479,
 igr2=1262,1263,
 &end
#
#   21 MET  QG           21 MET  HB2         2.70    (#   1650:20  Unique         2.40, 2.46 A)
 &rst
  ixpk= 1650, nxpk= 20, iat=  -1, 321, r1= 1.30, r2= 1.80, r3= 3.03, r4= 3.53,
 igr1= 324, 325,
 &end
#
#    0 AMB  20-3:1653    21 MET  HB2         3.50    (#   1653:20  Single Ambig)
 &rst
  ixpk= 1653, nxpk= 20, iat=  -1, 321, r1= 1.30, r2= 1.80, r3= 4.84, r4= 5.34,
 igr1= 328, 329, 330, 279, 280, 279, 280,
 &end
#
#   32 THR  HN           31 VAL  HB          5.00    (#   1661:20  Preassigned    3.82, 4.16 A)
 &rst
  ixpk= 1661, nxpk= 20, iat= 470, 458, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50,  &end
#
#   31 VAL  HA           31 VAL  HB          3.50    (#   1662:20  Preassigned    3.00, 3.03 A)
 &rst
  ixpk= 1662, nxpk= 20, iat= 456, 458, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   31 VAL  MG2          31 VAL  HB          5.00    (#   1664:20  Preassigned    2.37, 2.67 A)
 &rst
  ixpk= 1664, nxpk= 20, iat=  -1, 458, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,
 igr1= 464, 465, 466,
 &end
#
#   14 VAL  HA           14 VAL  HB          5.00    (#   1665:20  Preassigned    2.28, 2.38 A)
 &rst
  ixpk= 1665, nxpk= 20, iat= 203, 205, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50,  &end
#
#   89 ALA  MB           14 VAL  HB          5.00    (#   1666:20  Preassigned    2.20, 2.73 A)
 &rst
  ixpk= 1666, nxpk= 20, iat=  -1, 205, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,
 igr1=1343,1344,1345,
 &end
#
#   14 VAL  MGX          14 VAL  HB          2.70    (#   1667:20  Preassigned    2.37, 2.65 A)
 &rst
  ixpk= 1667, nxpk= 20, iat=  -1, 205, r1= 1.30, r2= 1.80, r3= 3.64, r4= 4.14,
 igr1= 207, 208, 209, 211, 212, 213,
 &end
#
#    0 AMB  20-3:1672    45 MET  HB2         3.50    (#   1672:20  Single Ambig)
 &rst
  ixpk= 1672, nxpk= 20, iat=  -1, 645, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1= 658, 641,
 &end
#
#    0 AMB  20-3:1673    90 GLU  QB          5.00    (#   1673:20  Single Ambig)
 &rst
  ixpk= 1673, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.30, r4= 6.80,
 igr1=1364,1339,
 igr2=1353,1354,
 &end
#
#  104 VAL  MGX         104 VAL  HB          3.50    (#   1676:20  Unique         2.30, 2.66 A)
 &rst
  ixpk= 1676, nxpk= 20, iat=  -1,1566, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,
 igr1=1568,1569,1570,1572,1573,1574,
 &end
#
#    0 AMB  20-3:1677   104 VAL  HB          2.70    (#   1677:20  Single Ambig)
 &rst
  ixpk= 1677, nxpk= 20, iat=  -1,1566, r1= 1.30, r2= 1.80, r3= 4.24, r4= 4.74,
 igr1=1568,1569,1570,1572,1573,1574,1163,1164,1165,1530,
      1531,1532,1534,1535,1536,
 &end
#
#   41 PRO  HA           41 PRO  HB-         5.00    (#   1679:20  Unique         2.30, 2.64 A)
 &rst
  ixpk= 1679, nxpk= 20, iat= 594,  -1, r1= 1.30, r2= 1.80, r3= 5.61, r4= 6.11,
 igr2= 591, 592,
 &end
#
#   14 VAL  MGY          96 GLN  HB-         5.00    (#   1680:20  Unique         2.10, 4.69 A)
 &rst
  ixpk= 1680, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.57, r4= 8.07,
 igr1= 207, 208, 209, 211, 212, 213,
 igr2=1436,1437,
 &end
#
#   75 LYS  HG-          75 LYS  QB          3.50    (#   1681:20  Unique         2.27, 2.61 A)
 &rst
  ixpk= 1681, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,
 igr1=1120,1121,
 igr2=1117,1118,
 &end
#
#  103 LYS  HA          103 LYS  HB+         5.00    (#   1683:20  Unique         2.23, 2.62 A)
 &rst
  ixpk= 1683, nxpk= 20, iat=1542,  -1, r1= 1.30, r2= 1.80, r3= 5.61, r4= 6.11,
 igr2=1544,1545,
 &end
#
#    0 AMB  20-3:1686    75 LYS  QB          5.00    (#   1686:20  Single Ambig)
 &rst
  ixpk= 1686, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.30, r4= 6.80,
 igr1=1115, 904,
 igr2=1117,1118,
 &end
#
#  107 LYS  HA          107 LYS  HB-         5.00    (#   1689:20  Unique         2.36, 2.73 A)
 &rst
  ixpk= 1689, nxpk= 20, iat=1610,  -1, r1= 1.30, r2= 1.80, r3= 5.61, r4= 6.11,
 igr2=1612,1613,
 &end
#
#  103 LYS  HN          103 LYS  HB-         5.00    (#   1690:20  Unique         2.40, 3.20 A)
 &rst
  ixpk= 1690, nxpk= 20, iat=1540,  -1, r1= 1.30, r2= 1.80, r3= 5.61, r4= 6.11,
 igr2=1544,1545,
 &end
#
#  103 LYS  HG-         103 LYS  HB-         2.70    (#   1691:20  Unique         2.26, 2.71 A)
 &rst
  ixpk= 1691, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 3.40, r4= 3.90,
 igr1=1547,1548,
 igr2=1544,1545,
 &end
#
#    0 AMB  20-3:1692    95 GLU  HB-         2.70    (#   1692:20  Single Ambig)
 &rst
  ixpk= 1692, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 3.82, r4= 4.32,
 igr1=1356,1357,1424,1425,
 igr2=1421,1422,
 &end
#
#   89 ALA  MB           12 PRO  HB-         3.50    (#   1695:20  Preassigned    2.15, 3.29 A)
 &rst
  ixpk= 1695, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,
 igr1=1343,1344,1345,
 igr2= 183, 184,
 &end
#
#   12 PRO  HA           12 PRO  HB-         5.00    (#   1696:20  Preassigned    2.24, 2.51 A)
 &rst
  ixpk= 1696, nxpk= 20, iat= 186,  -1, r1= 1.30, r2= 1.80, r3= 5.61, r4= 6.11,
 igr2= 183, 184,
 &end
#
#   15 ARG  HA           15 ARG  HB+         3.50    (#   1697:20  Preassigned    2.39, 2.73 A)
 &rst
  ixpk= 1697, nxpk= 20, iat= 219,  -1, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr2= 221, 222,
 &end
#
#   37 ALA  MB           43 PRO  QB          3.50    (#   1698:20  Unique         3.45, 5.10 A)
 &rst
  ixpk= 1698, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,
 igr1= 539, 540, 541,
 igr2= 620, 621,
 &end
#
#   89 ALA  MB           43 PRO  QB          3.50    (#   1699:20  Unique         2.88, 4.87 A)
 &rst
  ixpk= 1699, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,
 igr1=1343,1344,1345,
 igr2= 620, 621,
 &end
#
#   43 PRO  HA           43 PRO  QB          3.50    (#   1700:20  Unique         2.36, 2.58 A)
 &rst
  ixpk= 1700, nxpk= 20, iat= 623,  -1, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr2= 620, 621,
 &end
#
#   12 PRO  HA           12 PRO  HB+         5.00    (#   1701:20  Preassigned    2.24, 2.51 A)
 &rst
  ixpk= 1701, nxpk= 20, iat= 186,  -1, r1= 1.30, r2= 1.80, r3= 5.61, r4= 6.11,
 igr2= 183, 184,
 &end
#
#   89 ALA  MB           12 PRO  HB+         5.00    (#   1705:20  Preassigned    2.15, 3.29 A)
 &rst
  ixpk= 1705, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.74, r4= 7.24,
 igr1=1343,1344,1345,
 igr2= 183, 184,
 &end
#
#   44 THR  HN           43 PRO  QB          3.50    (#   1708:20  Unique         2.40, 2.99 A)
 &rst
  ixpk= 1708, nxpk= 20, iat= 627,  -1, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr2= 620, 621,
 &end
#
#   53 PRO  HG+          53 PRO  HB-         2.70    (#   1715:20  Unique         2.39, 2.66 A)
 &rst
  ixpk= 1715, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 3.40, r4= 3.90,
 igr1= 770, 771,
 igr2= 773, 774,
 &end
#
#   53 PRO  HA           53 PRO  HB-         5.00    (#   1716:20  Unique         2.21, 2.46 A)
 &rst
  ixpk= 1716, nxpk= 20, iat= 776,  -1, r1= 1.30, r2= 1.80, r3= 5.61, r4= 6.11,
 igr2= 773, 774,
 &end
#
#   71 GLU  QG           71 GLU  QB          5.00    (#   1718:20  Unique         2.30, 2.73 A)
 &rst
  ixpk= 1718, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.30, r4= 6.80,
 igr1=1048,1049,
 igr2=1045,1046,
 &end
#
#   92 LYS  HA           92 LYS  HB-         3.50    (#   1719:20  Preassigned    2.23, 2.42 A)
 &rst
  ixpk= 1719, nxpk= 20, iat=1380,  -1, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr2=1382,1383,
 &end
#
#   92 LYS  QG           92 LYS  HB-         2.70    (#   1720:20  Preassigned    2.24, 2.63 A)
 &rst
  ixpk= 1720, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 3.40, r4= 3.90,
 igr1=1385,1386,
 igr2=1382,1383,
 &end
#
#   92 LYS  HN           92 LYS  HB+         5.00    (#   1722:20  Unique         2.46, 3.11 A)
 &rst
  ixpk= 1722, nxpk= 20, iat=1378,  -1, r1= 1.30, r2= 1.80, r3= 5.61, r4= 6.11,
 igr2=1382,1383,
 &end
#
#   92 LYS  HA           92 LYS  HB+         3.50    (#   1723:20  Preassigned    2.23, 2.42 A)
 &rst
  ixpk= 1723, nxpk= 20, iat=1380,  -1, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr2=1382,1383,
 &end
#
#   92 LYS  QG           92 LYS  HB+         3.50    (#   1724:20  Preassigned    2.24, 2.63 A)
 &rst
  ixpk= 1724, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,
 igr1=1385,1386,
 igr2=1382,1383,
 &end
#
#    0 AMB  20-3:1727    79 LYS  HB-         2.70    (#   1727:20  Single Ambig)
 &rst
  ixpk= 1727, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 3.82, r4= 4.32,
 igr1=1192,1193,1192,1193,
 igr2=1189,1190,
 &end
#
#   79 LYS  HN           79 LYS  HB-         5.00    (#   1728:20  Unique         2.23, 2.90 A)
 &rst
  ixpk= 1728, nxpk= 20, iat=1185,  -1, r1= 1.30, r2= 1.80, r3= 5.61, r4= 6.11,
 igr2=1189,1190,
 &end
#
#    0 AMB  20-3:1731    77 VAL  HB          2.70    (#   1731:20  Single Ambig)
 &rst
  ixpk= 1731, nxpk= 20, iat=  -1,1161, r1= 1.30, r2= 1.80, r3= 3.89, r4= 4.39,
 igr1=1163,1164,1165,1167,1168,1169, 464, 465, 466,
 &end
#
#   77 VAL  HN           77 VAL  HB          3.50    (#   1732:20  Unique         2.46, 2.76 A)
 &rst
  ixpk= 1732, nxpk= 20, iat=1157,1161, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   17 ARG  QG           17 ARG  HB+         5.00    (#   1739:20  Preassigned    2.26, 2.74 A)
 &rst
  ixpk= 1739, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.30, r4= 6.80,
 igr1= 258, 259,
 igr2= 255, 256,
 &end
#
#    0 AMB  20-3:1742     0 AMB  20-2:1742   2.70    (#   1742:20  Double Ambig)
 &rst
  ixpk= 1742, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.29, r4= 4.79,
 igr1=1148,1149, 723, 724,
 igr2=1145,1146, 720, 721,
 &end
#
#    0 AMB  20-3:1744     0 AMB  20-2:1744   5.00    (#   1744:20  Double Ambig)
 &rst
  ixpk= 1744, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.49, r4= 8.99,
 igr1= 793, 794, 795,1100,1101,1102,
 igr2= 720, 721,1145,1146,
 &end
#
#   56 GLN  HA           56 GLN  HB-         3.50    (#   1748:20  Unique         2.38, 2.69 A)
 &rst
  ixpk= 1748, nxpk= 20, iat= 816,  -1, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr2= 818, 819,
 &end
#
#    0 AMB  20-3:1755     2 LYS  QD          2.70    (#   1755:20  Single Ambig)
 &rst
  ixpk= 1755, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 3.64, r4= 4.14,
 igr1=  15,  16,  49,
 igr2=  21,  22,
 &end
#
#    0 AMB  20-3:1757     2 LYS  QD          2.70    (#   1757:20  Single Ambig)
 &rst
  ixpk= 1757, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 3.82, r4= 4.32,
 igr1=  18,  19,  55,  56,
 igr2=  21,  22,
 &end
#
#   91 ASN  HB+          92 LYS  QD          2.70    (#   1758:20  Unique         2.54, 4.24 A)
 &rst
  ixpk= 1758, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 3.40, r4= 3.90,
 igr1=1368,1369,
 igr2=1388,1389,
 &end
#
#    0 AMB  20-3:1761    33 LEU  HG          5.00    (#   1761:20  Single Ambig)
 &rst
  ixpk= 1761, nxpk= 20, iat=  -1, 491, r1= 1.30, r2= 1.80, r3= 7.07, r4= 7.57,
 igr1= 493, 494, 495, 497, 498, 499,1060,1061,
 &end
#
#   79 LYS  HG-          79 LYS  QD          2.70    (#   1766:20  Unique         2.32, 2.68 A)
 &rst
  ixpk= 1766, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 3.40, r4= 3.90,
 igr1=1192,1193,
 igr2=1195,1196,
 &end
#
#   79 LYS  HA           79 LYS  QD          5.00    (#   1767:20  Unique         2.20, 3.95 A)
 &rst
  ixpk= 1767, nxpk= 20, iat=1187,  -1, r1= 1.30, r2= 1.80, r3= 5.61, r4= 6.11,
 igr2=1195,1196,
 &end
#
#  103 LYS  QE          103 LYS  HD-         2.70    (#   1768:20  Unique         2.35, 2.67 A)
 &rst
  ixpk= 1768, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 3.40, r4= 3.90,
 igr1=1553,1554,
 igr2=1550,1551,
 &end
#
#   33 LEU  MDX          33 LEU  HG          5.00    (#   1771:20  Preassigned    2.36, 2.66 A)
 &rst
  ixpk= 1771, nxpk= 20, iat=  -1, 491, r1= 1.30, r2= 1.80, r3= 6.74, r4= 7.24,
 igr1= 493, 494, 495, 497, 498, 499,
 &end
#
#  100 ILE  MD1         100 ILE  HG1-        2.70    (#   1772:20  Preassigned    2.33, 2.67 A)
 &rst
  ixpk= 1772, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 3.64, r4= 4.14,
 igr1=1498,1499,1500,
 igr2=1495,1496,
 &end
#
#  100 ILE  MG2         100 ILE  HG1+        3.50    (#   1774:20  Unique         2.49, 3.57 A)
 &rst
  ixpk= 1774, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,
 igr1=1491,1492,1493,
 igr2=1495,1496,
 &end
#
#    0 AMB  20-3:1777     0 AMB  20-2:1777   2.70    (#   1777:20  Double Ambig)
 &rst
  ixpk= 1777, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.25, r4= 5.75,
 igr1=1326,1327,1328,1333,1334,1335,1297,1298,1299,
 igr2=1330,1331,1330,1331,1330,1331,
 &end
#
#    0 AMB  20-3:1779     0 AMB  20-2:1779   2.70    (#   1779:20  Double Ambig)
 &rst
  ixpk= 1779, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.59, r4= 5.09,
 igr1=1304,1305,1306,1297,1298,1299,
 igr2=1301,1302,1301,1302,
 &end
#
#   95 GLU  HA           12 PRO  HG+         5.00    (#   1782:20  Unique         2.37, 3.30 A)
 &rst
  ixpk= 1782, nxpk= 20, iat=1419,  -1, r1= 1.30, r2= 1.80, r3= 5.61, r4= 6.11,
 igr2= 180, 181,
 &end
#
#   12 PRO  HD-          12 PRO  HG+         5.00    (#   1785:20  Unique         2.31, 2.61 A)
 &rst
  ixpk= 1785, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.30, r4= 6.80,
 igr1= 177, 178,
 igr2= 180, 181,
 &end
#
#   17 ARG  HB-          17 ARG  QG          2.70    (#   1786:20  Unique         2.26, 2.74 A)
 &rst
  ixpk= 1786, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 3.40, r4= 3.90,
 igr1= 255, 256,
 igr2= 258, 259,
 &end
#
#   73 ILE  HA           73 ILE  HG1+        5.00    (#   1787:20  Preassigned    2.49, 3.07 A)
 &rst
  ixpk= 1787, nxpk= 20, iat=1077,  -1, r1= 1.30, r2= 1.80, r3= 5.61, r4= 6.11,
 igr2=1085,1086,
 &end
#
#   73 ILE  MG2          73 ILE  HG1+        5.00    (#   1789:20  Unique         2.29, 3.16 A)
 &rst
  ixpk= 1789, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.74, r4= 7.24,
 igr1=1081,1082,1083,
 igr2=1085,1086,
 &end
#
#    0 AMB  20-3:1796     0 AMB  20-2:1796   5.00    (#   1796:20  Double Ambig)
 &rst
  ixpk= 1796, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.94, r4= 8.44,
 igr1= 614, 615, 559, 560,
 igr2= 617, 618, 617, 618,
 &end
#
#   54 ILE  MD1          54 ILE  HG1+        3.50    (#   1799:20  Unique         2.25, 2.65 A)
 &rst
  ixpk= 1799, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,
 igr1= 793, 794, 795,
 igr2= 790, 791,
 &end
#
#   62 LYS  HG+          62 LYS  HD-         5.00    (#   1801:20  Unique         2.40, 2.75 A)
 &rst
  ixpk= 1801, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.30, r4= 6.80,
 igr1= 909, 910,
 igr2= 912, 913,
 &end
#
#   76 LYS  HG+          62 LYS  HD-         3.50    (#   1802:20  Unique         2.89, 4.71 A)
 &rst
  ixpk= 1802, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,
 igr1=1142,1143,
 igr2= 912, 913,
 &end
#
#   43 PRO  HD-          43 PRO  HG-         5.00    (#   1803:20  Preassigned    2.30, 2.61 A)
 &rst
  ixpk= 1803, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.30, r4= 6.80,
 igr1= 614, 615,
 igr2= 617, 618,
 &end
#
#   43 PRO  QB           43 PRO  HG-         2.70    (#   1804:20  Unique         2.34, 2.62 A)
 &rst
  ixpk= 1804, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 3.40, r4= 3.90,
 igr1= 620, 621,
 igr2= 617, 618,
 &end
#
#   37 ALA  MB           43 PRO  HG-         5.00    (#   1805:20  Unique         2.70, 4.22 A)
 &rst
  ixpk= 1805, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.74, r4= 7.24,
 igr1= 539, 540, 541,
 igr2= 617, 618,
 &end
#
#   54 ILE  HN           54 ILE  HG1+        5.00    (#   1806:20  Unique         2.02, 2.85 A)
 &rst
  ixpk= 1806, nxpk= 20, iat= 780,  -1, r1= 1.30, r2= 1.80, r3= 5.61, r4= 6.11,
 igr2= 790, 791,
 &end
#
#    0 AMB  20-3:1807     0 AMB  20-2:1807   2.70    (#   1807:20  Double Ambig)
 &rst
  ixpk= 1807, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.25, r4= 5.75,
 igr1=  58,  59,  60,  51,  52,  53, 126, 127, 128,
 igr2=  55,  56,  55,  56,  55,  56,
 &end
#
#    7 ILE  MD1           7 ILE  HG1+        2.70    (#   1810:20  Unique         2.35, 2.66 A)
 &rst
  ixpk= 1810, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 3.64, r4= 4.14,
 igr1= 110, 111, 112,
 igr2= 107, 108,
 &end
#
#    4 ILE  MD1           4 ILE  HG1-        2.70    (#   1814:20  Preassigned    2.33, 2.65 A)
 &rst
  ixpk= 1814, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 3.64, r4= 4.14,
 igr1=  58,  59,  60,
 igr2=  55,  56,
 &end
#
#    7 ILE  HB            7 ILE  HG1-        5.00    (#   1815:20  Unique         2.42, 2.75 A)
 &rst
  ixpk= 1815, nxpk= 20, iat= 101,  -1, r1= 1.30, r2= 1.80, r3= 5.61, r4= 6.11,
 igr2= 107, 108,
 &end
#
#    7 ILE  MD1           7 ILE  HG1-        2.70    (#   1818:20  Unique         2.35, 2.66 A)
 &rst
  ixpk= 1818, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 3.64, r4= 4.14,
 igr1= 110, 111, 112,
 igr2= 107, 108,
 &end
#
#    0 AMB  20-3:1823     0 AMB  20-2:1823   5.00    (#   1823:20  Double Ambig)
 &rst
  ixpk= 1823, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 9.09, r4= 9.59,
 igr1=1107,1108,1109, 493, 494, 495, 497, 498, 499,
 igr2=1104,1105,1104,1105,
 &end
#
#    0 AMB  20-3:1827    27 LEU  HG          3.50    (#   1827:20  Single Ambig)
 &rst
  ixpk= 1827, nxpk= 20, iat=  -1, 403, r1= 1.30, r2= 1.80, r3= 5.30, r4= 5.80,
 igr1= 405, 406, 407, 409, 410, 411, 405, 406, 407, 409,
       410, 411,
 &end
#
#   41 PRO  HB+          41 PRO  QG          3.50    (#   1835:20  Unique         2.38, 2.64 A)
 &rst
  ixpk= 1835, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,
 igr1= 591, 592,
 igr2= 588, 589,
 &end
#
#   41 PRO  HB-          41 PRO  QG          2.70    (#   1836:20  Unique         2.38, 2.64 A)
 &rst
  ixpk= 1836, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 3.40, r4= 3.90,
 igr1= 591, 592,
 igr2= 588, 589,
 &end
#
#   75 LYS  QB           75 LYS  HG-         3.50    (#   1837:20  Unique         2.27, 2.61 A)
 &rst
  ixpk= 1837, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,
 igr1=1117,1118,
 igr2=1120,1121,
 &end
#
#   75 LYS  QB           75 LYS  HG+         5.00    (#   1838:20  Unique         2.27, 2.61 A)
 &rst
  ixpk= 1838, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.30, r4= 6.80,
 igr1=1117,1118,
 igr2=1120,1121,
 &end
#
#   75 LYS  QB           75 LYS  HG-         3.50    (#   1842:20  Unique         2.27, 2.61 A)
 &rst
  ixpk= 1842, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,
 igr1=1117,1118,
 igr2=1120,1121,
 &end
#
#    0 AMB  20-3:1856     0 AMB  20-2:1856   2.70    (#   1856:20  Double Ambig)
 &rst
  ixpk= 1856, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.29, r4= 4.79,
 igr1=  21,  22,1618,1619,
 igr2=  18,  19,1615,1616,
 &end
#
#    0 AMB  20-3:1859     0 AMB  20-2:1859   2.70    (#   1859:20  Double Ambig)
 &rst
  ixpk= 1859, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.82, r4= 6.32,
 igr1= 720, 721,1145,1146,1139,1140,1117,1118, 912, 913,
      
 igr2= 717, 718,1142,1143,1142,1143,1142,1143,1142,1143,
      
 &end
#
#    0 AMB  20-3:1865     0 AMB  20-2:1865   5.00    (#   1865:20  Double Ambig)
 &rst
  ixpk= 1865, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.94, r4= 8.44,
 igr1=1198,1199, 386, 387,
 igr2=1192,1193,1192,1193,
 &end
#
#    0 AMB  20-3:1866     0 AMB  20-2:1866   2.70    (#   1866:20  Double Ambig)
 &rst
  ixpk= 1866, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.29, r4= 4.79,
 igr1=1189,1190,1195,1196,
 igr2=1192,1193,1192,1193,
 &end
#
#   79 LYS  HB+          79 LYS  HG+         3.50    (#   1867:20  Unique         2.27, 2.70 A)
 &rst
  ixpk= 1867, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,
 igr1=1189,1190,
 igr2=1192,1193,
 &end
#
#   92 LYS  HA           92 LYS  QG          5.00    (#   1873:20  Unique         3.65, 3.99 A)
 &rst
  ixpk= 1873, nxpk= 20, iat=1380,  -1, r1= 1.30, r2= 1.80, r3= 5.61, r4= 6.11,
 igr2=1385,1386,
 &end
#
#    0 AMB  20-3:1874    92 LYS  QG          5.00    (#   1874:20  Single Ambig)
 &rst
  ixpk= 1874, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.57, r4= 8.07,
 igr1=1391,1392, 585, 586,1368,1369,
 igr2=1385,1386,
 &end
#
#   17 ARG  HB-          34 ALA  MB          2.70    (#   1876:20  Unique         2.16, 3.79 A)
 &rst
  ixpk= 1876, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 3.64, r4= 4.14,
 igr1= 255, 256,
 igr2= 507, 508, 509,
 &end
#
#   35 CYS  HN           34 ALA  MB          3.50    (#   1877:20  Unique         2.40, 3.47 A)
 &rst
  ixpk= 1877, nxpk= 20, iat= 513,  -1, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
 igr2= 507, 508, 509,
 &end
#
#   34 ALA  HN           34 ALA  MB          3.50    (#   1878:20  Unique         2.54, 3.30 A)
 &rst
  ixpk= 1878, nxpk= 20, iat= 503,  -1, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
 igr2= 507, 508, 509,
 &end
#
#   34 ALA  HA           34 ALA  MB          3.50    (#   1879:20  Unique         2.37, 2.70 A)
 &rst
  ixpk= 1879, nxpk= 20, iat= 505,  -1, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
 igr2= 507, 508, 509,
 &end
#
#   17 ARG  HD-          34 ALA  MB          5.00    (#   1880:20  Unique         2.38, 4.45 A)
 &rst
  ixpk= 1880, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.74, r4= 7.24,
 igr1= 261, 262,
 igr2= 507, 508, 509,
 &end
#
#    0 AMB  20-3:1882    34 ALA  MB          3.50    (#   1882:20  Single Ambig)
 &rst
  ixpk= 1882, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.30, r4= 5.80,
 igr1=1048,1049, 279, 280,
 igr2= 507, 508, 509,
 &end
#
#   89 ALA  MB           37 ALA  MB          3.50    (#   1883:20  Unique         2.14, 3.32 A)
 &rst
  ixpk= 1883, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1=1343,1344,1345,
 igr2= 539, 540, 541,
 &end
#
#   32 THR  MG2          34 ALA  MB          3.50    (#   1884:20  Unique         3.66, 5.61 A)
 &rst
  ixpk= 1884, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 476, 477, 478,
 igr2= 507, 508, 509,
 &end
#
#   37 ALA  HN           37 ALA  MB          3.50    (#   1886:20  Unique         2.38, 2.97 A)
 &rst
  ixpk= 1886, nxpk= 20, iat= 535,  -1, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
 igr2= 539, 540, 541,
 &end
#
#   38 ASP  HN           37 ALA  MB          3.50    (#   1887:20  Preassigned    3.94, 4.33 A)
 &rst
  ixpk= 1887, nxpk= 20, iat= 545,  -1, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
 igr2= 539, 540, 541,
 &end
#
#   37 ALA  HA           37 ALA  MB          3.50    (#   1888:20  Unique         2.36, 2.62 A)
 &rst
  ixpk= 1888, nxpk= 20, iat= 537,  -1, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
 igr2= 539, 540, 541,
 &end
#
#   36 ASP  HA           37 ALA  MB          5.00    (#   1889:20  Preassigned    4.53, 5.06 A)
 &rst
  ixpk= 1889, nxpk= 20, iat= 525,  -1, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,
 igr2= 539, 540, 541,
 &end
#
#   45 MET  ME           37 ALA  MB          2.70    (#   1890:20  Preassigned    2.52, 4.31 A)
 &rst
  ixpk= 1890, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 3.89, r4= 4.39,
 igr1= 652, 653, 654,
 igr2= 539, 540, 541,
 &end
#
#    0 AMB  20-3:1891    37 ALA  MB          2.70    (#   1891:20  Single Ambig)
 &rst
  ixpk= 1891, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 3.89, r4= 4.39,
 igr1= 205, 617, 618,
 igr2= 539, 540, 541,
 &end
#
#   92 LYS  QD           92 LYS  QG          2.70    (#   1892:20  Unique         2.26, 2.62 A)
 &rst
  ixpk= 1892, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 3.40, r4= 3.90,
 igr1=1388,1389,
 igr2=1385,1386,
 &end
#
#   14 VAL  MGX          37 ALA  MB          3.50    (#   1895:20  Unique         2.38, 4.96 A)
 &rst
  ixpk= 1895, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1= 207, 208, 209, 211, 212, 213,
 igr2= 539, 540, 541,
 &end
#
#   23 ALA  HN           23 ALA  MB          3.50    (#   1899:20  Preassigned    2.84, 3.56 A)
 &rst
  ixpk= 1899, nxpk= 20, iat= 348,  -1, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
 igr2= 352, 353, 354,
 &end
#
#   24 THR  HN           23 ALA  MB          3.50    (#   1900:20  Preassigned    2.34, 3.33 A)
 &rst
  ixpk= 1900, nxpk= 20, iat= 358,  -1, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
 igr2= 352, 353, 354,
 &end
#
#   23 ALA  HA           23 ALA  MB          2.70    (#   1901:20  Preassigned    2.40, 2.68 A)
 &rst
  ixpk= 1901, nxpk= 20, iat= 350,  -1, r1= 1.30, r2= 1.80, r3= 3.24, r4= 3.74,
 igr2= 352, 353, 354,
 &end
#
#    0 AMB  20-3:1902    23 ALA  MB          2.70    (#   1902:20  Single Ambig)
 &rst
  ixpk= 1902, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.39, r4= 5.89,
 igr1=1163,1164,1165, 464, 465, 466,1167,1168,1169,1530,
      1531,1532,1534,1535,1536,1530,1531,1532,1534,1535,
      1536,
 igr2= 352, 353, 354,
 &end
#
#   98 ALA  HN           98 ALA  MB          3.50    (#   1911:20  Preassigned    2.85, 3.46 A)
 &rst
  ixpk= 1911, nxpk= 20, iat=1461,  -1, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
 igr2=1465,1466,1467,
 &end
#
#   99 THR  HN           98 ALA  MB          3.50    (#   1912:20  Preassigned    2.10, 3.03 A)
 &rst
  ixpk= 1912, nxpk= 20, iat=1471,  -1, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
 igr2=1465,1466,1467,
 &end
#
#   98 ALA  HA           98 ALA  MB          2.70    (#   1913:20  Preassigned    2.41, 2.67 A)
 &rst
  ixpk= 1913, nxpk= 20, iat=1463,  -1, r1= 1.30, r2= 1.80, r3= 3.24, r4= 3.74,
 igr2=1465,1466,1467,
 &end
#
#   15 ARG  HA           98 ALA  MB          3.50    (#   1914:20  Preassigned    2.29, 3.02 A)
 &rst
  ixpk= 1914, nxpk= 20, iat= 219,  -1, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
 igr2=1465,1466,1467,
 &end
#
#   14 VAL  MGY          98 ALA  MB          2.70    (#   1916:20  Preassigned    2.72, 4.95 A)
 &rst
  ixpk= 1916, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.37, r4= 4.87,
 igr1= 207, 208, 209, 211, 212, 213,
 igr2=1465,1466,1467,
 &end
#
#   16 ALA  HN           98 ALA  MB          3.50    (#   1917:20  Preassigned    2.68, 3.26 A)
 &rst
  ixpk= 1917, nxpk= 20, iat= 241,  -1, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
 igr2=1465,1466,1467,
 &end
#
#   24 THR  HN           24 THR  MG2         5.00    (#   1922:20  Unique         4.19, 4.50 A)
 &rst
  ixpk= 1922, nxpk= 20, iat= 358,  -1, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,
 igr2= 364, 365, 366,
 &end
#
#   24 THR  HB           24 THR  MG2         2.70    (#   1923:20  Preassigned    2.36, 2.66 A)
 &rst
  ixpk= 1923, nxpk= 20, iat= 362,  -1, r1= 1.30, r2= 1.80, r3= 3.24, r4= 3.74,
 igr2= 364, 365, 366,
 &end
#
#   25 ALA  HN           24 THR  MG2         5.00    (#   1924:20  Unique         2.71, 3.92 A)
 &rst
  ixpk= 1924, nxpk= 20, iat= 372,  -1, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,
 igr2= 364, 365, 366,
 &end
#
#  107 LYS  HB+          24 THR  MG2         5.00    (#   1925:20  Unique         3.34, 5.07 A)
 &rst
  ixpk= 1925, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.74, r4= 7.24,
 igr1=1612,1613,
 igr2= 364, 365, 366,
 &end
#
#    0 AMB  20-3:1927    46 THR  MG2         5.00    (#   1927:20  Single Ambig)
 &rst
  ixpk= 1927, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.09, r4= 8.59,
 igr1=1333,1334,1335,1326,1327,1328,
 igr2= 664, 665, 666,
 &end
#
#   84 GLU  HN           83 ALA  MB          3.50    (#   1930:20  Unique         2.21, 3.35 A)
 &rst
  ixpk= 1930, nxpk= 20, iat=1255,  -1, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
 igr2=1249,1250,1251,
 &end
#
#   83 ALA  HA           83 ALA  MB          5.00    (#   1931:20  Preassigned    2.36, 2.69 A)
 &rst
  ixpk= 1931, nxpk= 20, iat=1247,  -1, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,
 igr2=1249,1250,1251,
 &end
#
#   82 GLU  HA           83 ALA  MB          5.00    (#   1932:20  Preassigned    4.09, 4.74 A)
 &rst
  ixpk= 1932, nxpk= 20, iat=1232,  -1, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,
 igr2=1249,1250,1251,
 &end
#
#   49 LYS  QD           83 ALA  MB          5.00    (#   1933:20  Unique         3.89, 5.18 A)
 &rst
  ixpk= 1933, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.74, r4= 7.24,
 igr1= 720, 721,
 igr2=1249,1250,1251,
 &end
#
#  102 LEU  HB-          83 ALA  MB          2.70    (#   1934:20  Unique         2.26, 4.28 A)
 &rst
  ixpk= 1934, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 3.64, r4= 4.14,
 igr1=1525,1526,
 igr2=1249,1250,1251,
 &end
#
#   54 ILE  MD1          83 ALA  MB          3.50    (#   1936:20  Preassigned    3.69, 5.59 A)
 &rst
  ixpk= 1936, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 793, 794, 795,
 igr2=1249,1250,1251,
 &end
#
#   20 THR  HN           20 THR  MG2         5.00    (#   1939:20  Preassigned    4.42, 4.77 A)
 &rst
  ixpk= 1939, nxpk= 20, iat= 303,  -1, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,
 igr2= 309, 310, 311,
 &end
#
#   24 THR  HA           24 THR  MG2         3.50    (#   1940:20  Unique         2.27, 3.03 A)
 &rst
  ixpk= 1940, nxpk= 20, iat= 360,  -1, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
 igr2= 364, 365, 366,
 &end
#
#  107 LYS  HA           24 THR  MG2         5.00    (#   1942:20  Unique         2.31, 3.30 A)
 &rst
  ixpk= 1942, nxpk= 20, iat=1610,  -1, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,
 igr2= 364, 365, 366,
 &end
#
#    0 AMB  20-3:1946    24 THR  MG2         3.50    (#   1946:20  Single Ambig)
 &rst
  ixpk= 1946, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.36, r4= 6.86,
 igr1= 405, 406, 407, 409, 410, 411, 405, 406, 407, 409,
       410, 411,
 igr2= 364, 365, 366,
 &end
#
#   44 THR  HN           44 THR  MG2         5.00    (#   1951:20  Preassigned    4.37, 4.66 A)
 &rst
  ixpk= 1951, nxpk= 20, iat= 627,  -1, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,
 igr2= 633, 634, 635,
 &end
#
#   45 MET  HN           44 THR  MG2         3.50    (#   1952:20  Preassigned    3.44, 4.19 A)
 &rst
  ixpk= 1952, nxpk= 20, iat= 641,  -1, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
 igr2= 633, 634, 635,
 &end
#
#   44 THR  HA           44 THR  MG2         2.70    (#   1957:20  Preassigned    2.41, 3.09 A)
 &rst
  ixpk= 1957, nxpk= 20, iat= 629,  -1, r1= 1.30, r2= 1.80, r3= 3.24, r4= 3.74,
 igr2= 633, 634, 635,
 &end
#
#   44 THR  HB           44 THR  MG2         2.70    (#   1958:20  Preassigned    2.42, 2.68 A)
 &rst
  ixpk= 1958, nxpk= 20, iat= 631,  -1, r1= 1.30, r2= 1.80, r3= 3.24, r4= 3.74,
 igr2= 633, 634, 635,
 &end
#
#   83 ALA  HN           83 ALA  MB          3.50    (#   1966:20  Preassigned    2.86, 3.42 A)
 &rst
  ixpk= 1966, nxpk= 20, iat=1245,  -1, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
 igr2=1249,1250,1251,
 &end
#
#   49 LYS  QE           83 ALA  MB          3.50    (#   1967:20  Preassigned    2.65, 4.52 A)
 &rst
  ixpk= 1967, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,
 igr1= 723, 724,
 igr2=1249,1250,1251,
 &end
#
#   21 MET  HN           20 THR  MG2         3.50    (#   1970:20  Unique         2.63, 3.67 A)
 &rst
  ixpk= 1970, nxpk= 20, iat= 317,  -1, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
 igr2= 309, 310, 311,
 &end
#
#   20 THR  HA           20 THR  MG2         3.50    (#   1971:20  Unique         2.37, 3.11 A)
 &rst
  ixpk= 1971, nxpk= 20, iat= 305,  -1, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
 igr2= 309, 310, 311,
 &end
#
#   20 THR  HB           20 THR  MG2         2.70    (#   1972:20  Unique         2.41, 2.67 A)
 &rst
  ixpk= 1972, nxpk= 20, iat= 307,  -1, r1= 1.30, r2= 1.80, r3= 3.24, r4= 3.74,
 igr2= 309, 310, 311,
 &end
#
#  101 HIS  QB           20 THR  MG2         3.50    (#   1973:20  Unique         2.29, 4.11 A)
 &rst
  ixpk= 1973, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,
 igr1=1508,1509,
 igr2= 309, 310, 311,
 &end
#
#   10 VAL  HA           10 VAL  MG1         3.50    (#   1986:20  Preassigned    2.48, 3.14 A)
 &rst
  ixpk= 1986, nxpk= 20, iat= 148,  -1, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
 igr2= 152, 153, 154,
 &end
#
#   11 PRO  HD+          10 VAL  MG1         3.50    (#   1987:20  Preassigned    2.79, 4.27 A)
 &rst
  ixpk= 1987, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,
 igr1= 163, 164,
 igr2= 152, 153, 154,
 &end
#
#   39 GLY  HA-          10 VAL  MG1         5.00    (#   1988:20  Preassigned    2.37, 4.27 A)
 &rst
  ixpk= 1988, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.74, r4= 7.24,
 igr1= 559, 560,
 igr2= 152, 153, 154,
 &end
#
#   10 VAL  HB           10 VAL  MG1         3.50    (#   1989:20  Preassigned    2.39, 2.65 A)
 &rst
  ixpk= 1989, nxpk= 20, iat= 150,  -1, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
 igr2= 152, 153, 154,
 &end
#
#  107 LYS  HN          106 ALA  MB          5.00    (#   1997:20  Preassigned    4.36, 4.51 A)
 &rst
  ixpk= 1997, nxpk= 20, iat=1608,  -1, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,
 igr2=1602,1603,1604,
 &end
#
#  106 ALA  HA          106 ALA  MB          2.70    (#   1998:20  Preassigned    2.41, 2.65 A)
 &rst
  ixpk= 1998, nxpk= 20, iat=1600,  -1, r1= 1.30, r2= 1.80, r3= 3.24, r4= 3.74,
 igr2=1602,1603,1604,
 &end
#
#  106 ALA  HN          106 ALA  MB          5.00    (#   2003:20  Preassigned    2.42, 2.87 A)
 &rst
  ixpk= 2003, nxpk= 20, iat=1598,  -1, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,
 igr2=1602,1603,1604,
 &end
#
#    0 AMB  20-3:2005   106 ALA  MB          3.50    (#   2005:20  Single Ambig)
 &rst
  ixpk= 2005, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.30, r4= 5.80,
 igr1=1195,1196,1612,1613,
 igr2=1602,1603,1604,
 &end
#
#   79 LYS  HN           25 ALA  MB          5.00    (#   2008:20  Preassigned    2.51, 3.79 A)
 &rst
  ixpk= 2008, nxpk= 20, iat=1185,  -1, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,
 igr2= 376, 377, 378,
 &end
#
#   78 ASP  HA           25 ALA  MB          3.50    (#   2009:20  Preassigned    3.38, 4.35 A)
 &rst
  ixpk= 2009, nxpk= 20, iat=1175,  -1, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
 igr2= 376, 377, 378,
 &end
#
#  104 VAL  HB          104 VAL  MGY         2.70    (#   2010:20  Preassigned    2.30, 2.66 A)
 &rst
  ixpk= 2010, nxpk= 20, iat=1566,  -1, r1= 1.30, r2= 1.80, r3= 3.64, r4= 4.14,
 igr2=1568,1569,1570,1572,1573,1574,
 &end
#
#  104 VAL  MGX          25 ALA  MB          2.70    (#   2011:20  Preassigned    2.15, 5.29 A)
 &rst
  ixpk= 2011, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.37, r4= 4.87,
 igr1=1568,1569,1570,1572,1573,1574,
 igr2= 376, 377, 378,
 &end
#
#   25 ALA  HN           25 ALA  MB          3.50    (#   2012:20  Preassigned    2.42, 2.95 A)
 &rst
  ixpk= 2012, nxpk= 20, iat= 372,  -1, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
 igr2= 376, 377, 378,
 &end
#
#   26 ASN  HN           25 ALA  MB          5.00    (#   2013:20  Preassigned    2.00, 3.22 A)
 &rst
  ixpk= 2013, nxpk= 20, iat= 382,  -1, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,
 igr2= 376, 377, 378,
 &end
#
#  106 ALA  HA           25 ALA  MB          3.50    (#   2014:20  Preassigned    2.17, 2.84 A)
 &rst
  ixpk= 2014, nxpk= 20, iat=1600,  -1, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
 igr2= 376, 377, 378,
 &end
#
#   25 ALA  HA           25 ALA  MB          3.50    (#   2015:20  Preassigned    2.41, 2.67 A)
 &rst
  ixpk= 2015, nxpk= 20, iat= 374,  -1, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
 igr2= 376, 377, 378,
 &end
#
#   77 VAL  MG1          25 ALA  MB          3.50    (#   2016:20  Preassigned    5.19, 6.92 A)
 &rst
  ixpk= 2016, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1=1163,1164,1165,
 igr2= 376, 377, 378,
 &end
#
#   93 ALA  HN           93 ALA  MB          3.50    (#   2017:20  Unique         2.44, 2.97 A)
 &rst
  ixpk= 2017, nxpk= 20, iat=1400,  -1, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
 igr2=1404,1405,1406,
 &end
#
#    0 AMB  20-3:2018    93 ALA  MB          2.70    (#   2018:20  Single Ambig)
 &rst
  ixpk= 2018, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 3.64, r4= 4.14,
 igr1= 172,1402,
 igr2=1404,1405,1406,
 &end
#
#   12 PRO  HD+          93 ALA  MB          3.50    (#   2019:20  Preassigned    3.69, 5.01 A)
 &rst
  ixpk= 2019, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,
 igr1= 177, 178,
 igr2=1404,1405,1406,
 &end
#
#   12 PRO  HD-          93 ALA  MB          5.00    (#   2020:20  Preassigned    3.69, 5.01 A)
 &rst
  ixpk= 2020, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.74, r4= 7.24,
 igr1= 177, 178,
 igr2=1404,1405,1406,
 &end
#
#    9 ASN  QB           93 ALA  MB          3.50    (#   2021:20  Unique         2.11, 3.64 A)
 &rst
  ixpk= 2021, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,
 igr1= 136, 137,
 igr2=1404,1405,1406,
 &end
#
#   11 PRO  QG           93 ALA  MB          2.70    (#   2022:20  Preassigned    2.42, 4.19 A)
 &rst
  ixpk= 2022, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 3.64, r4= 4.14,
 igr1= 166, 167,
 igr2=1404,1405,1406,
 &end
#
#    0 AMB  20-3:2023     0 AMB  20-2:2023   3.50    (#   2023:20  Double Ambig)
 &rst
  ixpk= 2023, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.77, r4= 8.27,
 igr1=1528, 376, 377, 378, 352, 353, 354,1465,1466,1467,
      
 igr2=1568,1569,1570,1572,1573,1574, 207, 208, 209, 211,
       212, 213,
 &end
#
#   14 VAL  HB           14 VAL  MGY         3.50    (#   2026:20  Preassigned    2.37, 2.65 A)
 &rst
  ixpk= 2026, nxpk= 20, iat= 205,  -1, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,
 igr2= 207, 208, 209, 211, 212, 213,
 &end
#
#   17 ARG  HN           16 ALA  MB          5.00    (#   2041:20  Preassigned    3.38, 4.26 A)
 &rst
  ixpk= 2041, nxpk= 20, iat= 251,  -1, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,
 igr2= 245, 246, 247,
 &end
#
#   35 CYS  HA           16 ALA  MB          5.00    (#   2046:20  Unique         4.26, 4.78 A)
 &rst
  ixpk= 2046, nxpk= 20, iat= 515,  -1, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,
 igr2= 245, 246, 247,
 &end
#
#   16 ALA  HN           16 ALA  MB          2.70    (#   2047:20  Unique         2.44, 2.93 A)
 &rst
  ixpk= 2047, nxpk= 20, iat= 241,  -1, r1= 1.30, r2= 1.80, r3= 3.24, r4= 3.74,
 igr2= 245, 246, 247,
 &end
#
#   36 ASP  HA           45 MET  ME          5.00    (#   2068:20  Preassigned    4.27, 5.76 A)
 &rst
  ixpk= 2068, nxpk= 20, iat= 525,  -1, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,
 igr2= 652, 653, 654,
 &end
#
#   70 SER  HA           45 MET  ME          3.50    (#   2069:20  Preassigned    3.48, 5.22 A)
 &rst
  ixpk= 2069, nxpk= 20, iat=1032,  -1, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
 igr2= 652, 653, 654,
 &end
#
#   89 ALA  MB           45 MET  ME          3.50    (#   2072:20  Preassigned    3.14, 5.36 A)
 &rst
  ixpk= 2072, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1=1343,1344,1345,
 igr2= 652, 653, 654,
 &end
#
#   14 VAL  MGX          45 MET  ME          3.50    (#   2073:20  Preassigned    2.55, 5.35 A)
 &rst
  ixpk= 2073, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1= 207, 208, 209, 211, 212, 213,
 igr2= 652, 653, 654,
 &end
#
#    0 AMB  20-3:2074    45 MET  ME          3.50    (#   2074:20  Single Ambig)
 &rst
  ixpk= 2074, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,
 igr1= 535, 513,
 igr2= 652, 653, 654,
 &end
#
#   45 MET  HN           45 MET  ME          5.00    (#   2075:20  Preassigned    5.49, 6.02 A)
 &rst
  ixpk= 2075, nxpk= 20, iat= 641,  -1, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,
 igr2= 652, 653, 654,
 &end
#
#   70 SER  QB           45 MET  ME          5.00    (#   2076:20  Unique         2.49, 5.66 A)
 &rst
  ixpk= 2076, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.74, r4= 7.24,
 igr1=1034,1035,
 igr2= 652, 653, 654,
 &end
#
#   35 CYS  HB+          45 MET  ME          3.50    (#   2077:20  Preassigned    2.38, 4.18 A)
 &rst
  ixpk= 2077, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,
 igr1= 517, 518,
 igr2= 652, 653, 654,
 &end
#
#   35 CYS  HB-          45 MET  ME          3.50    (#   2078:20  Preassigned    2.38, 4.18 A)
 &rst
  ixpk= 2078, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,
 igr1= 517, 518,
 igr2= 652, 653, 654,
 &end
#
#   37 ALA  MB           45 MET  ME          2.70    (#   2087:20  Preassigned    2.52, 4.31 A)
 &rst
  ixpk= 2087, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 3.89, r4= 4.39,
 igr1= 539, 540, 541,
 igr2= 652, 653, 654,
 &end
#
#   85 TYR  QE          100 ILE  MD1         5.00    (#   2092:20  Preassigned    3.68, 6.07 A)
 &rst
  ixpk= 2092, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.74, r4= 7.24,
 igr1=1280,1285,
 igr2=1498,1499,1500,
 &end
#
#   47 TRP  HZ3         100 ILE  MD1         5.00    (#   2093:20  Preassigned    2.14, 3.08 A)
 &rst
  ixpk= 2093, nxpk= 20, iat= 689,  -1, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,
 igr2=1498,1499,1500,
 &end
#
#  100 ILE  HB          100 ILE  MD1         3.50    (#   2094:20  Preassigned    2.31, 3.07 A)
 &rst
  ixpk= 2094, nxpk= 20, iat=1489,  -1, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
 igr2=1498,1499,1500,
 &end
#
#   34 ALA  HN          100 ILE  MD1         5.00    (#   2100:20  Unique         2.72, 3.86 A)
 &rst
  ixpk= 2100, nxpk= 20, iat= 503,  -1, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,
 igr2=1498,1499,1500,
 &end
#
#  100 ILE  HG1+        100 ILE  MD1         2.70    (#   2102:20  Unique         2.33, 2.67 A)
 &rst
  ixpk= 2102, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 3.64, r4= 4.14,
 igr1=1495,1496,
 igr2=1498,1499,1500,
 &end
#
#  100 ILE  MG2         100 ILE  MD1         3.50    (#   2105:20  Unique         2.20, 3.61 A)
 &rst
  ixpk= 2105, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1=1491,1492,1493,
 igr2=1498,1499,1500,
 &end
#
#   33 LEU  MDX         100 ILE  MD1         3.50    (#   2107:20  Unique         2.43, 5.36 A)
 &rst
  ixpk= 2107, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1= 493, 494, 495, 497, 498, 499,
 igr2=1498,1499,1500,
 &end
#
#    0 AMB  20-3:2172    88 ILE  HG1-        2.70    (#   2172:20  Single Ambig)
 &rst
  ixpk= 2172, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.37, r4= 4.87,
 igr1=1326,1327,1328,1333,1334,1335,1297,1298,1299,
 igr2=1330,1331,
 &end
#
#   54 ILE  MD1          54 ILE  HG1-        3.50    (#   2179:20  Unique         2.25, 2.65 A)
 &rst
  ixpk= 2179, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,
 igr1= 793, 794, 795,
 igr2= 790, 791,
 &end
#
#  102 LEU  HB+         102 LEU  MDY         3.50    (#   2188:20  Unique         2.32, 3.42 A)
 &rst
  ixpk= 2188, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.30, r4= 5.80,
 igr1=1525,1526,
 igr2=1530,1531,1532,1534,1535,1536,
 &end
#
#    0 AMB  20-3:2190   102 LEU  MDY         2.70    (#   2190:20  Single Ambig)
 &rst
  ixpk= 2190, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.25, r4= 5.75,
 igr1= 493, 494, 495, 497, 498, 499,1107,1108,1109,
 igr2=1530,1531,1532,1534,1535,1536,
 &end
#
#   33 LEU  MDY         102 LEU  MDY         5.00    (#   2191:20  Unique         2.14, 4.86 A)
 &rst
  ixpk= 2191, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 9.09, r4= 9.59,
 igr1= 493, 494, 495, 497, 498, 499,
 igr2=1530,1531,1532,1534,1535,1536,
 &end
#
#    0 AMB  20-3:2194   102 LEU  MDY         3.50    (#   2194:20  Single Ambig)
 &rst
  ixpk= 2194, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.94, r4= 6.44,
 igr1=1528, 352, 353, 354,
 igr2=1530,1531,1532,1534,1535,1536,
 &end
#
#  102 LEU  HB-         102 LEU  MDY         3.50    (#   2195:20  Unique         2.32, 3.42 A)
 &rst
  ixpk= 2195, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.30, r4= 5.80,
 igr1=1525,1526,
 igr2=1530,1531,1532,1534,1535,1536,
 &end
#
#  104 VAL  MGX         102 LEU  MDY         3.50    (#   2196:20  Unique         2.10, 5.67 A)
 &rst
  ixpk= 2196, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.36, r4= 6.86,
 igr1=1568,1569,1570,1572,1573,1574,
 igr2=1530,1531,1532,1534,1535,1536,
 &end
#
#   24 THR  HB           27 LEU  MDY         3.50    (#   2197:20  Unique         2.21, 4.24 A)
 &rst
  ixpk= 2197, nxpk= 20, iat= 362,  -1, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,
 igr2= 405, 406, 407, 409, 410, 411,
 &end
#
#   27 LEU  HB-          27 LEU  MDY         3.50    (#   2198:20  Preassigned    2.34, 3.31 A)
 &rst
  ixpk= 2198, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.30, r4= 5.80,
 igr1= 400, 401,
 igr2= 405, 406, 407, 409, 410, 411,
 &end
#
#   24 THR  MG2          27 LEU  MDY         3.50    (#   2199:20  Preassigned    2.20, 4.87 A)
 &rst
  ixpk= 2199, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1= 364, 365, 366,
 igr2= 405, 406, 407, 409, 410, 411,
 &end
#
#   37 ALA  HA           14 VAL  MGX         5.00    (#   2203:20  Unique         2.87, 4.46 A)
 &rst
  ixpk= 2203, nxpk= 20, iat= 537,  -1, r1= 1.30, r2= 1.80, r3= 6.74, r4= 7.24,
 igr2= 207, 208, 209, 211, 212, 213,
 &end
#
#   15 ARG  HN           14 VAL  MGX         3.50    (#   2204:20  Unique         2.70, 4.61 A)
 &rst
  ixpk= 2204, nxpk= 20, iat= 217,  -1, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,
 igr2= 207, 208, 209, 211, 212, 213,
 &end
#
#   35 CYS  HB+          14 VAL  MGX         3.50    (#   2205:20  Unique         2.37, 5.84 A)
 &rst
  ixpk= 2205, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.30, r4= 5.80,
 igr1= 517, 518,
 igr2= 207, 208, 209, 211, 212, 213,
 &end
#
#    0 AMB  20-3:2206    14 VAL  MGX         3.50    (#   2206:20  Single Ambig)
 &rst
  ixpk= 2206, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.94, r4= 6.44,
 igr1= 517, 518,1439,1440,
 igr2= 207, 208, 209, 211, 212, 213,
 &end
#
#   45 MET  ME           14 VAL  MGX         5.00    (#   2207:20  Preassigned    2.55, 5.35 A)
 &rst
  ixpk= 2207, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.09, r4= 8.59,
 igr1= 652, 653, 654,
 igr2= 207, 208, 209, 211, 212, 213,
 &end
#
#   14 VAL  HB           14 VAL  MGX         3.50    (#   2208:20  Preassigned    2.37, 2.65 A)
 &rst
  ixpk= 2208, nxpk= 20, iat= 205,  -1, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,
 igr2= 207, 208, 209, 211, 212, 213,
 &end
#
#   37 ALA  MB           14 VAL  MGX         2.70    (#   2210:20  Preassigned    2.38, 4.96 A)
 &rst
  ixpk= 2210, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.37, r4= 4.87,
 igr1= 539, 540, 541,
 igr2= 207, 208, 209, 211, 212, 213,
 &end
#
#   89 ALA  MB           14 VAL  MGX         3.50    (#   2211:20  Unique         2.39, 4.19 A)
 &rst
  ixpk= 2211, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1=1343,1344,1345,
 igr2= 207, 208, 209, 211, 212, 213,
 &end
#
#   23 ALA  HN          102 LEU  MDX         5.00    (#   2212:20  Preassigned    3.85, 5.77 A)
 &rst
  ixpk= 2212, nxpk= 20, iat= 348,  -1, r1= 1.30, r2= 1.80, r3= 6.74, r4= 7.24,
 igr2=1530,1531,1532,1534,1535,1536,
 &end
#
#  102 LEU  HA          102 LEU  MDX         2.70    (#   2213:20  Preassigned    2.27, 3.68 A)
 &rst
  ixpk= 2213, nxpk= 20, iat=1523,  -1, r1= 1.30, r2= 1.80, r3= 3.64, r4= 4.14,
 igr2=1530,1531,1532,1534,1535,1536,
 &end
#
#   21 MET  HB3         102 LEU  MDX         3.50    (#   2214:20  Preassigned    2.37, 4.61 A)
 &rst
  ixpk= 2214, nxpk= 20, iat= 322,  -1, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,
 igr2=1530,1531,1532,1534,1535,1536,
 &end
#
#    0 AMB  20-3:2215   102 LEU  MDX         2.70    (#   2215:20  Single Ambig)
 &rst
  ixpk= 2215, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.59, r4= 5.09,
 igr1=1528, 352, 353, 354,
 igr2=1530,1531,1532,1534,1535,1536,
 &end
#
#   22 ASN  HA          102 LEU  MDX         5.00    (#   2217:20  Preassigned    2.25, 4.66 A)
 &rst
  ixpk= 2217, nxpk= 20, iat= 336,  -1, r1= 1.30, r2= 1.80, r3= 6.74, r4= 7.24,
 igr2=1530,1531,1532,1534,1535,1536,
 &end
#
#  102 LEU  HB+         102 LEU  MDX         3.50    (#   2218:20  Unique         2.32, 3.42 A)
 &rst
  ixpk= 2218, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.30, r4= 5.80,
 igr1=1525,1526,
 igr2=1530,1531,1532,1534,1535,1536,
 &end
#
#   33 LEU  MDX         102 LEU  MDX         3.50    (#   2220:20  Preassigned    2.14, 4.86 A)
 &rst
  ixpk= 2220, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.36, r4= 6.86,
 igr1= 493, 494, 495, 497, 498, 499,
 igr2=1530,1531,1532,1534,1535,1536,
 &end
#
#   30 SER  HA           77 VAL  MG2         3.50    (#   2223:20  Unique         3.58, 4.61 A)
 &rst
  ixpk= 2223, nxpk= 20, iat= 445,  -1, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
 igr2=1167,1168,1169,
 &end
#
#   77 VAL  HA           77 VAL  MG2         3.50    (#   2224:20  Unique         2.35, 3.12 A)
 &rst
  ixpk= 2224, nxpk= 20, iat=1159,  -1, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
 igr2=1167,1168,1169,
 &end
#
#   77 VAL  HB           77 VAL  MG2         2.70    (#   2225:20  Unique         2.43, 2.67 A)
 &rst
  ixpk= 2225, nxpk= 20, iat=1161,  -1, r1= 1.30, r2= 1.80, r3= 3.24, r4= 3.74,
 igr2=1167,1168,1169,
 &end
#
#   74 ILE  HB           77 VAL  MG2         5.00    (#   2226:20  Unique         2.31, 3.15 A)
 &rst
  ixpk= 2226, nxpk= 20, iat=1098,  -1, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,
 igr2=1167,1168,1169,
 &end
#
#   74 ILE  HN           77 VAL  MG2         5.00    (#   2229:20  Preassigned    4.45, 5.36 A)
 &rst
  ixpk= 2229, nxpk= 20, iat=1094,  -1, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,
 igr2=1167,1168,1169,
 &end
#
#   77 VAL  HN           77 VAL  MG2         3.50    (#   2230:20  Preassigned    2.11, 3.30 A)
 &rst
  ixpk= 2230, nxpk= 20, iat=1157,  -1, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
 igr2=1167,1168,1169,
 &end
#
#   27 LEU  HA           27 LEU  MDX         3.50    (#   2231:20  Unique         2.14, 3.77 A)
 &rst
  ixpk= 2231, nxpk= 20, iat= 398,  -1, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,
 igr2= 405, 406, 407, 409, 410, 411,
 &end
#
#   27 LEU  HB+          27 LEU  MDX         3.50    (#   2232:20  Preassigned    2.34, 3.31 A)
 &rst
  ixpk= 2232, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.30, r4= 5.80,
 igr1= 400, 401,
 igr2= 405, 406, 407, 409, 410, 411,
 &end
#
#   27 LEU  HG           27 LEU  MDX         3.50    (#   2233:20  Preassigned    2.38, 2.67 A)
 &rst
  ixpk= 2233, nxpk= 20, iat= 403,  -1, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,
 igr2= 405, 406, 407, 409, 410, 411,
 &end
#
#   27 LEU  HB-          27 LEU  MDX         3.50    (#   2234:20  Preassigned    2.34, 3.31 A)
 &rst
  ixpk= 2234, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.30, r4= 5.80,
 igr1= 400, 401,
 igr2= 405, 406, 407, 409, 410, 411,
 &end
#
#   24 THR  MG2          27 LEU  MDX         2.70    (#   2235:20  Preassigned    2.20, 4.87 A)
 &rst
  ixpk= 2235, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.37, r4= 4.87,
 igr1= 364, 365, 366,
 igr2= 405, 406, 407, 409, 410, 411,
 &end
#
#    0 AMB  20-3:2237     0 AMB  20-2:2237   3.50    (#   2237:20  Double Ambig)
 &rst
  ixpk= 2237, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.77, r4= 6.27,
 igr1=1104,1105,1167,1168,1169,
 igr2= 909, 910, 909, 910,
 &end
#
#   78 ASP  HN           77 VAL  MG1         3.50    (#   2238:20  Unique         2.19, 3.36 A)
 &rst
  ixpk= 2238, nxpk= 20, iat=1173,  -1, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
 igr2=1163,1164,1165,
 &end
#
#   77 VAL  HN           77 VAL  MG1         5.00    (#   2239:20  Preassigned    4.39, 4.66 A)
 &rst
  ixpk= 2239, nxpk= 20, iat=1157,  -1, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,
 igr2=1163,1164,1165,
 &end
#
#   77 VAL  HA           77 VAL  MG1         2.70    (#   2240:20  Unique         2.30, 3.14 A)
 &rst
  ixpk= 2240, nxpk= 20, iat=1159,  -1, r1= 1.30, r2= 1.80, r3= 3.24, r4= 3.74,
 igr2=1163,1164,1165,
 &end
#
#    0 AMB  20-3:2241    77 VAL  MG1         3.50    (#   2241:20  Single Ambig)
 &rst
  ixpk= 2241, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1=1161, 400, 401,
 igr2=1163,1164,1165,
 &end
#
#   23 ALA  MB           77 VAL  MG1         2.70    (#   2242:20  Unique         2.08, 3.49 A)
 &rst
  ixpk= 2242, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 3.89, r4= 4.39,
 igr1= 352, 353, 354,
 igr2=1163,1164,1165,
 &end
#
#   99 THR  HA           99 THR  MG2         3.50    (#   2250:20  Unique         2.63, 3.24 A)
 &rst
  ixpk= 2250, nxpk= 20, iat=1473,  -1, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
 igr2=1477,1478,1479,
 &end
#
#   99 THR  HB           99 THR  MG2         2.70    (#   2251:20  Unique         2.44, 2.68 A)
 &rst
  ixpk= 2251, nxpk= 20, iat=1475,  -1, r1= 1.30, r2= 1.80, r3= 3.24, r4= 3.74,
 igr2=1477,1478,1479,
 &end
#
#    0 AMB  20-3:2252     0 AMB  20-2:2252   2.70    (#   2252:20  Double Ambig)
 &rst
  ixpk= 2252, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.91, r4= 5.41,
 igr1= 183, 184, 180, 181,1262,1263,
 igr2=1343,1344,1345,1477,1478,1479,
 &end
#
#   33 LEU  HN           32 THR  MG2         3.50    (#   2259:20  Unique         2.89, 3.63 A)
 &rst
  ixpk= 2259, nxpk= 20, iat= 484,  -1, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
 igr2= 476, 477, 478,
 &end
#
#   32 THR  HA           32 THR  MG2         3.50    (#   2260:20  Unique         2.42, 3.10 A)
 &rst
  ixpk= 2260, nxpk= 20, iat= 472,  -1, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
 igr2= 476, 477, 478,
 &end
#
#   32 THR  HB           32 THR  MG2         2.70    (#   2261:20  Preassigned    2.42, 2.67 A)
 &rst
  ixpk= 2261, nxpk= 20, iat= 474,  -1, r1= 1.30, r2= 1.80, r3= 3.24, r4= 3.74,
 igr2= 476, 477, 478,
 &end
#
#   71 GLU  QB           32 THR  MG2         2.70    (#   2262:20  Unique         2.51, 4.05 A)
 &rst
  ixpk= 2262, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 3.64, r4= 4.14,
 igr1=1045,1046,
 igr2= 476, 477, 478,
 &end
#
#    0 AMB  20-3:2263     0 AMB  20-2:2263   3.50    (#   2263:20  Double Ambig)
 &rst
  ixpk= 2263, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1= 454, 426,1094,
 igr2= 464, 465, 466, 460, 461, 462,
 &end
#
#   31 VAL  HA            0 AMB  20-2:2264   3.50    (#   2264:20  Single Ambig)
 &rst
  ixpk= 2264, nxpk= 20, iat= 456,  -1, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,
 igr2= 464, 465, 466, 460, 461, 462,
 &end
#
#   31 VAL  HB            0 AMB  20-2:2265   3.50    (#   2265:20  Single Ambig)
 &rst
  ixpk= 2265, nxpk= 20, iat= 458,  -1, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,
 igr2= 464, 465, 466, 460, 461, 462,
 &end
#
#    0 AMB  20-3:2266     0 AMB  20-2:2266   3.50    (#   2266:20  Double Ambig)
 &rst
  ixpk= 2266, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.30, r4= 5.80,
 igr1= 491,1098,
 igr2= 460, 461, 462, 464, 465, 466,
 &end
#
#   23 ALA  MB            0 AMB  20-2:2267   3.50    (#   2267:20  Single Ambig)
 &rst
  ixpk= 2267, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1= 352, 353, 354,
 igr2= 464, 465, 466, 460, 461, 462,
 &end
#
#    0 AMB  20-3:2270    31 VAL  MG1         3.50    (#   2270:20  Single Ambig)
 &rst
  ixpk= 2270, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.06, r4= 6.56,
 igr1= 493, 494, 495, 497, 498, 499,1107,1108,1109,
 igr2= 460, 461, 462,
 &end
#
#   33 LEU  MDY          31 VAL  MG1         3.50    (#   2271:20  Unique         2.31, 5.38 A)
 &rst
  ixpk= 2271, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1= 493, 494, 495, 497, 498, 499,
 igr2= 460, 461, 462,
 &end
#
#   73 ILE  HG1+         32 THR  MG2         3.50    (#   2275:20  Unique         2.24, 3.86 A)
 &rst
  ixpk= 2275, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,
 igr1=1085,1086,
 igr2= 476, 477, 478,
 &end
#
#    0 AMB  20-3:2276     0 AMB  20-2:2276   3.50    (#   2276:20  Double Ambig)
 &rst
  ixpk= 2276, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.94, r4= 6.44,
 igr1=1085,1086, 588, 589,
 igr2= 476, 477, 478, 122, 123, 124,
 &end
#
#    6 VAL  HA            6 VAL  MG1         5.00    (#   2282:20  Preassigned    2.43, 3.15 A)
 &rst
  ixpk= 2282, nxpk= 20, iat=  83,  -1, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,
 igr2=  87,  88,  89,
 &end
#
#   32 THR  HN           31 VAL  MG1         3.50    (#   2283:20  Preassigned    2.49, 3.54 A)
 &rst
  ixpk= 2283, nxpk= 20, iat= 470,  -1, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
 igr2= 460, 461, 462,
 &end
#
#   21 MET  ME           31 VAL  MG1         3.50    (#   2284:20  Preassigned    2.86, 3.91 A)
 &rst
  ixpk= 2284, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 328, 329, 330,
 igr2= 460, 461, 462,
 &end
#
#   21 MET  HB3          31 VAL  MG1         5.00    (#   2285:20  Preassigned    3.69, 5.12 A)
 &rst
  ixpk= 2285, nxpk= 20, iat= 322,  -1, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,
 igr2= 460, 461, 462,
 &end
#
#   49 LYS  HN           48 THR  MG2         5.00    (#   2290:20  Preassigned    4.27, 5.03 A)
 &rst
  ixpk= 2290, nxpk= 20, iat= 710,  -1, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,
 igr2= 702, 703, 704,
 &end
#
#   48 THR  HA           48 THR  MG2         3.50    (#   2292:20  Preassigned    2.40, 3.16 A)
 &rst
  ixpk= 2292, nxpk= 20, iat= 698,  -1, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
 igr2= 702, 703, 704,
 &end
#
#   53 PRO  HA           48 THR  MG2         3.50    (#   2293:20  Preassigned    2.16, 3.44 A)
 &rst
  ixpk= 2293, nxpk= 20, iat= 776,  -1, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
 igr2= 702, 703, 704,
 &end
#
#   48 THR  HB           48 THR  MG2         2.70    (#   2294:20  Preassigned    2.40, 2.67 A)
 &rst
  ixpk= 2294, nxpk= 20, iat= 700,  -1, r1= 1.30, r2= 1.80, r3= 3.24, r4= 3.74,
 igr2= 702, 703, 704,
 &end
#
#    8 VAL  HN            8 VAL  MG2         5.00    (#   2297:20  Preassigned    2.44, 3.78 A)
 &rst
  ixpk= 2297, nxpk= 20, iat= 116,  -1, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,
 igr2= 126, 127, 128,
 &end
#
#    8 VAL  HA            8 VAL  MG2         2.70    (#   2298:20  Preassigned    2.44, 3.13 A)
 &rst
  ixpk= 2298, nxpk= 20, iat= 118,  -1, r1= 1.30, r2= 1.80, r3= 3.24, r4= 3.74,
 igr2= 126, 127, 128,
 &end
#
#    8 VAL  HB            8 VAL  MG2         5.00    (#   2299:20  Preassigned    2.42, 2.66 A)
 &rst
  ixpk= 2299, nxpk= 20, iat= 120,  -1, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,
 igr2= 126, 127, 128,
 &end
#
#  101 HIS  HN          100 ILE  MG2         3.50    (#   2309:20  Unique         2.25, 3.45 A)
 &rst
  ixpk= 2309, nxpk= 20, iat=1504,  -1, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
 igr2=1491,1492,1493,
 &end
#
#  100 ILE  HA          100 ILE  MG2         3.50    (#   2310:20  Unique         2.40, 2.92 A)
 &rst
  ixpk= 2310, nxpk= 20, iat=1487,  -1, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
 igr2=1491,1492,1493,
 &end
#
#   19 SER  HA          100 ILE  MG2         5.00    (#   2311:20  Unique         2.37, 4.05 A)
 &rst
  ixpk= 2311, nxpk= 20, iat= 294,  -1, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,
 igr2=1491,1492,1493,
 &end
#
#    0 AMB  20-3:2312     0 AMB  20-2:2312   3.50    (#   2312:20  Double Ambig)
 &rst
  ixpk= 2312, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.94, r4= 6.44,
 igr1=  71,  72, 324, 325,
 igr2=  51,  52,  53,1491,1492,1493,
 &end
#
#  100 ILE  HG1+        100 ILE  MG2         3.50    (#   2313:20  Unique         2.49, 3.57 A)
 &rst
  ixpk= 2313, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,
 igr1=1495,1496,
 igr2=1491,1492,1493,
 &end
#
#    0 AMB  20-3:2314     0 AMB  20-2:2314   3.50    (#   2314:20  Double Ambig)
 &rst
  ixpk= 2314, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.94, r4= 6.44,
 igr1=  55,  56,1495,1496,
 igr2=  51,  52,  53,1491,1492,1493,
 &end
#
#    0 AMB  20-3:2315   100 ILE  MG2         3.50    (#   2315:20  Single Ambig)
 &rst
  ixpk= 2315, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1=1498,1499,1500, 245, 246, 247,
 igr2=1491,1492,1493,
 &end
#
#   33 LEU  MDX         100 ILE  MG2         3.50    (#   2316:20  Unique         2.29, 5.75 A)
 &rst
  ixpk= 2316, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1= 493, 494, 495, 497, 498, 499,
 igr2=1491,1492,1493,
 &end
#
#    4 ILE  HB            4 ILE  MG2         3.50    (#   2317:20  Preassigned    2.38, 2.68 A)
 &rst
  ixpk= 2317, nxpk= 20, iat=  49,  -1, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
 igr2=  51,  52,  53,
 &end
#
#    0 AMB  20-3:2318     0 AMB  20-2:2318   3.50    (#   2318:20  Double Ambig)
 &rst
  ixpk= 2318, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.94, r4= 6.44,
 igr1=  55,  56,1525,1526,
 igr2=  51,  52,  53,1491,1492,1493,
 &end
#
#    4 ILE  HA            4 ILE  MG2         5.00    (#   2321:20  Unique         2.44, 3.04 A)
 &rst
  ixpk= 2321, nxpk= 20, iat=  47,  -1, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,
 igr2=  51,  52,  53,
 &end
#
#    8 VAL  HN            7 ILE  MG2         3.50    (#   2324:20  Unique         2.78, 3.95 A)
 &rst
  ixpk= 2324, nxpk= 20, iat= 116,  -1, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
 igr2= 103, 104, 105,
 &end
#
#    0 AMB  20-3:2326     7 ILE  MG2         3.50    (#   2326:20  Single Ambig)
 &rst
  ixpk= 2326, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,
 igr1=  99, 118,
 igr2= 103, 104, 105,
 &end
#
#    7 ILE  HB            7 ILE  MG2         2.70    (#   2327:20  Unique         2.40, 2.67 A)
 &rst
  ixpk= 2327, nxpk= 20, iat= 101,  -1, r1= 1.30, r2= 1.80, r3= 3.24, r4= 3.74,
 igr2= 103, 104, 105,
 &end
#
#    0 AMB  20-3:2328     7 ILE  MG2         3.50    (#   2328:20  Single Ambig)
 &rst
  ixpk= 2328, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,
 igr1= 107, 108, 152, 153, 154,
 igr2= 103, 104, 105,
 &end
#
#    0 AMB  20-3:2332    74 ILE  MG2         3.50    (#   2332:20  Single Ambig)
 &rst
  ixpk= 2332, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,
 igr1=1096,1115,
 igr2=1100,1101,1102,
 &end
#
#   63 TYR  QB           74 ILE  MG2         3.50    (#   2333:20  Unique         3.38, 5.12 A)
 &rst
  ixpk= 2333, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,
 igr1= 928, 929,
 igr2=1100,1101,1102,
 &end
#
#   74 ILE  HB           74 ILE  MG2         3.50    (#   2334:20  Unique         2.33, 2.68 A)
 &rst
  ixpk= 2334, nxpk= 20, iat=1098,  -1, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
 igr2=1100,1101,1102,
 &end
#
#   74 ILE  MD1          74 ILE  MG2         3.50    (#   2335:20  Unique         2.16, 3.84 A)
 &rst
  ixpk= 2335, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1=1107,1108,1109,
 igr2=1100,1101,1102,
 &end
#
#   73 ILE  HN           73 ILE  MD1         3.50    (#   2345:20  Unique         2.16, 3.27 A)
 &rst
  ixpk= 2345, nxpk= 20, iat=1075,  -1, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
 igr2=1088,1089,1090,
 &end
#
#   64 SER  HB+          73 ILE  MD1         5.00    (#   2346:20  Unique         2.97, 4.77 A)
 &rst
  ixpk= 2346, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.74, r4= 7.24,
 igr1= 949, 950,
 igr2=1088,1089,1090,
 &end
#
#   73 ILE  HG1-         73 ILE  MD1         2.70    (#   2347:20  Preassigned    2.35, 2.66 A)
 &rst
  ixpk= 2347, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 3.64, r4= 4.14,
 igr1=1085,1086,
 igr2=1088,1089,1090,
 &end
#
#   86 ILE  HN           54 ILE  MD1         5.00    (#   2348:20  Preassigned    4.25, 5.46 A)
 &rst
  ixpk= 2348, nxpk= 20, iat=1291,  -1, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,
 igr2= 793, 794, 795,
 &end
#
#   54 ILE  HG1+         54 ILE  MD1         3.50    (#   2349:20  Unique         2.25, 2.65 A)
 &rst
  ixpk= 2349, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,
 igr1= 790, 791,
 igr2= 793, 794, 795,
 &end
#
#    0 AMB  20-3:2352     0 AMB  20-2:2352   2.70    (#   2352:20  Double Ambig)
 &rst
  ixpk= 2352, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.09, r4= 4.59,
 igr1= 784,1295,
 igr2= 793, 794, 795,1304,1305,1306,
 &end
#
#    0 AMB  20-3:2353     0 AMB  20-2:2353   3.50    (#   2353:20  Double Ambig)
 &rst
  ixpk= 2353, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.94, r4= 6.44,
 igr1= 714, 715,1301,1302,
 igr2= 793, 794, 795,1304,1305,1306,
 &end
#
#    0 AMB  20-3:2356    54 ILE  MD1         3.50    (#   2356:20  Single Ambig)
 &rst
  ixpk= 2356, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1=1278,1287, 691,
 igr2= 793, 794, 795,
 &end
#
#   85 TYR  QE           54 ILE  MD1         3.50    (#   2357:20  Unique         2.27, 4.54 A)
 &rst
  ixpk= 2357, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,
 igr1=1280,1285,
 igr2= 793, 794, 795,
 &end
#
#   47 TRP  HB2          54 ILE  MD1         5.00    (#   2358:20  Preassigned    2.18, 3.63 A)
 &rst
  ixpk= 2358, nxpk= 20, iat= 676,  -1, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,
 igr2= 793, 794, 795,
 &end
#
#   47 TRP  HB3          54 ILE  MD1         5.00    (#   2359:20  Preassigned    3.76, 5.24 A)
 &rst
  ixpk= 2359, nxpk= 20, iat= 677,  -1, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,
 igr2= 793, 794, 795,
 &end
#
#   54 ILE  MG2          54 ILE  MD1         3.50    (#   2360:20  Unique         2.08, 3.77 A)
 &rst
  ixpk= 2360, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 786, 787, 788,
 igr2= 793, 794, 795,
 &end
#
#   72 LEU  MDX          54 ILE  MD1         3.50    (#   2361:20  Unique         3.69, 6.21 A)
 &rst
  ixpk= 2361, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1=1065,1066,1067,1069,1070,1071,
 igr2= 793, 794, 795,
 &end
#
#    4 ILE  HG1-          4 ILE  MD1         2.70    (#   2362:20  Unique         2.33, 2.65 A)
 &rst
  ixpk= 2362, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 3.64, r4= 4.14,
 igr1=  55,  56,
 igr2=  58,  59,  60,
 &end
#
#    0 AMB  20-3:2366     4 ILE  MD1         3.50    (#   2366:20  Single Ambig)
 &rst
  ixpk= 2366, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.30, r4= 5.80,
 igr1=  55,  56,  18,  19,
 igr2=  58,  59,  60,
 &end
#
#    0 AMB  20-3:2368     7 ILE  MD1         5.00    (#   2368:20  Single Ambig)
 &rst
  ixpk= 2368, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.74, r4= 7.24,
 igr1=  99,  83,
 igr2= 110, 111, 112,
 &end
#
#    7 ILE  HB            7 ILE  MD1         3.50    (#   2369:20  Unique         2.38, 3.23 A)
 &rst
  ixpk= 2369, nxpk= 20, iat= 101,  -1, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
 igr2= 110, 111, 112,
 &end
#
#    7 ILE  HG1+          7 ILE  MD1         2.70    (#   2370:20  Unique         2.35, 2.66 A)
 &rst
  ixpk= 2370, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 3.64, r4= 4.14,
 igr1= 107, 108,
 igr2= 110, 111, 112,
 &end
#
#    7 ILE  HG1-          7 ILE  MD1         2.70    (#   2371:20  Unique         2.35, 2.66 A)
 &rst
  ixpk= 2371, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 3.64, r4= 4.14,
 igr1= 107, 108,
 igr2= 110, 111, 112,
 &end
#
#   72 LEU  MDX          72 LEU  HB+         5.00    (#   2416:20  Unique         2.21, 3.27 A)
 &rst
  ixpk= 2416, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.57, r4= 8.07,
 igr1=1065,1066,1067,1069,1070,1071,
 igr2=1060,1061,
 &end
#
#   61 GLU  HA           61 GLU  QB          3.50    (#   2474:20  Unique         2.32, 2.77 A)
 &rst
  ixpk= 2474, nxpk= 20, iat= 889,  -1, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr2= 891, 892,
 &end
#
#   64 SER  HN           64 SER  HB-         5.00    (#   2475:20  Unique         2.94, 3.49 A)
 &rst
  ixpk= 2475, nxpk= 20, iat= 945,  -1, r1= 1.30, r2= 1.80, r3= 5.61, r4= 6.11,
 igr2= 949, 950,
 &end
#
#    0 AMB  20-3:2477    64 SER  HB-         5.00    (#   2477:20  Single Ambig)
 &rst
  ixpk= 2477, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.30, r4= 6.80,
 igr1= 956,1075,
 igr2= 949, 950,
 &end
#
#    0 AMB  20-3:2481     0 AMB  20-2:2481   5.00    (#   2481:20  Double Ambig)
 &rst
  ixpk= 2481, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.07, r4= 7.57,
 igr1=1542, 294,
 igr2=1550,1551,1495,1496,
 &end
#
#   43 PRO  HD+          43 PRO  HG-         5.00    (#   2491:20  Unique         2.30, 2.61 A)
 &rst
  ixpk= 2491, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.30, r4= 6.80,
 igr1= 614, 615,
 igr2= 617, 618,
 &end
#
#   62 LYS  HB+          75 LYS  HG+         2.70    (#   2499:20  Unique         3.20, 4.39 A)
 &rst
  ixpk= 2499, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 3.40, r4= 3.90,
 igr1= 906, 907,
 igr2=1120,1121,
 &end
#
#   33 LEU  HN           33 LEU  MDY         5.00    (#   2506:20  Unique         2.27, 4.38 A)
 &rst
  ixpk= 2506, nxpk= 20, iat= 484,  -1, r1= 1.30, r2= 1.80, r3= 6.74, r4= 7.24,
 igr2= 493, 494, 495, 497, 498, 499,
 &end
#
#   47 TRP  HZ3          33 LEU  MDY         5.00    (#   2507:20  Preassigned    2.34, 4.56 A)
 &rst
  ixpk= 2507, nxpk= 20, iat= 689,  -1, r1= 1.30, r2= 1.80, r3= 6.74, r4= 7.24,
 igr2= 493, 494, 495, 497, 498, 499,
 &end
#
#    0 AMB  20-3:2508    33 LEU  MDY         3.50    (#   2508:20  Single Ambig)
 &rst
  ixpk= 2508, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.30, r4= 5.80,
 igr1= 488, 491,
 igr2= 493, 494, 495, 497, 498, 499,
 &end
#
#   33 LEU  HB3          33 LEU  MDY         5.00    (#   2509:20  Preassigned    2.26, 3.34 A)
 &rst
  ixpk= 2509, nxpk= 20, iat= 489,  -1, r1= 1.30, r2= 1.80, r3= 6.74, r4= 7.24,
 igr2= 493, 494, 495, 497, 498, 499,
 &end
#
#  100 ILE  MG2          33 LEU  MDY         3.50    (#   2510:20  Unique         2.29, 5.75 A)
 &rst
  ixpk= 2510, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1=1491,1492,1493,
 igr2= 493, 494, 495, 497, 498, 499,
 &end
#
#    0 AMB  20-3:2511    33 LEU  MDY         2.70    (#   2511:20  Single Ambig)
 &rst
  ixpk= 2511, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.84, r4= 6.34,
 igr1=1530,1531,1532,1534,1535,1536,1530,1531,1532,1534,
      1535,1536, 460, 461, 462,1104,1105,
 igr2= 493, 494, 495, 497, 498, 499,
 &end
#
#    0 AMB  20-3:2517    72 LEU  MDX         2.70    (#   2517:20  Single Ambig)
 &rst
  ixpk= 2517, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.59, r4= 5.09,
 igr1=1063, 793, 794, 795,
 igr2=1065,1066,1067,1069,1070,1071,
 &end
#
#    0 AMB  20-3:2518    72 LEU  MDX         3.50    (#   2518:20  Single Ambig)
 &rst
  ixpk= 2518, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.04, r4= 7.54,
 igr1=1060,1061, 786, 787, 788, 493, 494, 495, 497, 498,
       499,
 igr2=1065,1066,1067,1069,1070,1071,
 &end
#
#   72 LEU  HB-          72 LEU  MDX         5.00    (#   2519:20  Unique         2.21, 3.27 A)
 &rst
  ixpk= 2519, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.57, r4= 8.07,
 igr1=1060,1061,
 igr2=1065,1066,1067,1069,1070,1071,
 &end
#
#    0 AMB  20-3:2521    72 LEU  MDX         3.50    (#   2521:20  Single Ambig)
 &rst
  ixpk= 2521, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.80, r4= 7.30,
 igr1= 493, 494, 495, 497, 498, 499,1107,1108,1109,
 igr2=1065,1066,1067,1069,1070,1071,
 &end
#
#   33 LEU  HN           33 LEU  MDX         5.00    (#   2523:20  Unique         2.27, 4.38 A)
 &rst
  ixpk= 2523, nxpk= 20, iat= 484,  -1, r1= 1.30, r2= 1.80, r3= 6.74, r4= 7.24,
 igr2= 493, 494, 495, 497, 498, 499,
 &end
#
#  100 ILE  MG2          33 LEU  MDX         3.50    (#   2529:20  Unique         2.29, 5.75 A)
 &rst
  ixpk= 2529, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1=1491,1492,1493,
 igr2= 493, 494, 495, 497, 498, 499,
 &end
#
#    0 AMB  20-3:2530    33 LEU  MDX         2.70    (#   2530:20  Single Ambig)
 &rst
  ixpk= 2530, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.84, r4= 6.34,
 igr1=1530,1531,1532,1534,1535,1536,1530,1531,1532,1534,
      1535,1536, 460, 461, 462,1104,1105,
 igr2= 493, 494, 495, 497, 498, 499,
 &end
#
#   21 MET  ME           33 LEU  MDX         5.00    (#   2536:20  Unique         2.35, 5.52 A)
 &rst
  ixpk= 2536, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.09, r4= 8.59,
 igr1= 328, 329, 330,
 igr2= 493, 494, 495, 497, 498, 499,
 &end
#
#    0 AMB  20-3:2549    62 LYS  HG-         5.00    (#   2549:20  Single Ambig)
 &rst
  ixpk= 2549, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.07, r4= 7.57,
 igr1= 906, 907,1142,1143,
 igr2= 909, 910,
 &end
#
#   79 LYS  HN          104 VAL  MGX         3.50    (#   2563:20  Preassigned    3.50, 5.33 A)
 &rst
  ixpk= 2563, nxpk= 20, iat=1185,  -1, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,
 igr2=1568,1569,1570,1572,1573,1574,
 &end
#
#   25 ALA  HN          104 VAL  MGX         3.50    (#   2564:20  Preassigned    2.17, 4.76 A)
 &rst
  ixpk= 2564, nxpk= 20, iat= 372,  -1, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,
 igr2=1568,1569,1570,1572,1573,1574,
 &end
#
#  104 VAL  HA          104 VAL  MGX         3.50    (#   2565:20  Preassigned    2.38, 3.15 A)
 &rst
  ixpk= 2565, nxpk= 20, iat=1564,  -1, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,
 igr2=1568,1569,1570,1572,1573,1574,
 &end
#
#   25 ALA  HA          104 VAL  MGX         5.00    (#   2566:20  Preassigned    2.29, 4.04 A)
 &rst
  ixpk= 2566, nxpk= 20, iat= 374,  -1, r1= 1.30, r2= 1.80, r3= 6.74, r4= 7.24,
 igr2=1568,1569,1570,1572,1573,1574,
 &end
#
#  104 VAL  HB          104 VAL  MGX         3.50    (#   2567:20  Preassigned    2.30, 2.66 A)
 &rst
  ixpk= 2567, nxpk= 20, iat=1566,  -1, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,
 igr2=1568,1569,1570,1572,1573,1574,
 &end
#
#   25 ALA  MB          104 VAL  MGX         3.50    (#   2568:20  Unique         2.15, 5.29 A)
 &rst
  ixpk= 2568, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1= 376, 377, 378,
 igr2=1568,1569,1570,1572,1573,1574,
 &end
#
#   79 LYS  HA          104 VAL  MGX         3.50    (#   2571:20  Preassigned    2.24, 3.93 A)
 &rst
  ixpk= 2571, nxpk= 20, iat=1187,  -1, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,
 igr2=1568,1569,1570,1572,1573,1574,
 &end
#
#   35 CYS  HB-          14 VAL  MGY         5.00    (#   2611:20  Preassigned    2.37, 5.84 A)
 &rst
  ixpk= 2611, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.57, r4= 8.07,
 igr1= 517, 518,
 igr2= 207, 208, 209, 211, 212, 213,
 &end
#
#   89 ALA  HN           88 ILE  MG2         3.50    (#   2623:20  Unique         2.66, 3.36 A)
 &rst
  ixpk= 2623, nxpk= 20, iat=1339,  -1, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
 igr2=1326,1327,1328,
 &end
#
#   74 ILE  HN           73 ILE  MG2         2.70    (#   2628:20  Preassigned    3.12, 3.81 A)
 &rst
  ixpk= 2628, nxpk= 20, iat=1094,  -1, r1= 1.30, r2= 1.80, r3= 3.24, r4= 3.74,
 igr2=1081,1082,1083,
 &end
#
#   30 SER  QB           73 ILE  MG2         3.50    (#   2629:20  Unique         2.56, 4.34 A)
 &rst
  ixpk= 2629, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,
 igr1= 447, 448,
 igr2=1081,1082,1083,
 &end
#
#   73 ILE  HA           73 ILE  MG2         3.50    (#   2635:20  Unique         2.33, 2.99 A)
 &rst
  ixpk= 2635, nxpk= 20, iat=1077,  -1, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
 igr2=1081,1082,1083,
 &end
#
#    0 AMB  20-3:2636    73 ILE  MG2         3.50    (#   2636:20  Single Ambig)
 &rst
  ixpk= 2636, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1=1079,1123,1124,
 igr2=1081,1082,1083,
 &end
#
#   73 ILE  HG1-         73 ILE  MG2         3.50    (#   2637:20  Unique         2.29, 3.16 A)
 &rst
  ixpk= 2637, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,
 igr1=1085,1086,
 igr2=1081,1082,1083,
 &end
#
#   75 LYS  HN           74 ILE  MG2         5.00    (#   2640:20  Unique         2.13, 3.09 A)
 &rst
  ixpk= 2640, nxpk= 20, iat=1113,  -1, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,
 igr2=1100,1101,1102,
 &end
#
#   54 ILE  HN           54 ILE  MG2         5.00    (#   2645:20  Preassigned    4.38, 4.56 A)
 &rst
  ixpk= 2645, nxpk= 20, iat= 780,  -1, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,
 igr2= 786, 787, 788,
 &end
#
#   54 ILE  HG1-         54 ILE  MG2         5.00    (#   2646:20  Unique         2.31, 3.41 A)
 &rst
  ixpk= 2646, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.74, r4= 7.24,
 igr1= 790, 791,
 igr2= 786, 787, 788,
 &end
#
#    0 AMB  20-3:2648    54 ILE  MG2         3.50    (#   2648:20  Single Ambig)
 &rst
  ixpk= 2648, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.30, r4= 5.80,
 igr1= 868, 691, 932, 941,
 igr2= 786, 787, 788,
 &end
#
#   85 TYR  QE           54 ILE  MG2         3.50    (#   2649:20  Unique         3.73, 5.97 A)
 &rst
  ixpk= 2649, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,
 igr1=1280,1285,
 igr2= 786, 787, 788,
 &end
#
#   47 TRP  HH2          54 ILE  MG2         5.00    (#   2650:20  Unique         5.62, 7.00 A)
 &rst
  ixpk= 2650, nxpk= 20, iat= 687,  -1, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,
 igr2= 786, 787, 788,
 &end
#
#   54 ILE  HA           54 ILE  MG2         3.50    (#   2651:20  Unique         2.40, 3.04 A)
 &rst
  ixpk= 2651, nxpk= 20, iat= 782,  -1, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
 igr2= 786, 787, 788,
 &end
#
#   54 ILE  HB           54 ILE  MG2         2.70    (#   2652:20  Preassigned    2.35, 2.66 A)
 &rst
  ixpk= 2652, nxpk= 20, iat= 784,  -1, r1= 1.30, r2= 1.80, r3= 3.24, r4= 3.74,
 igr2= 786, 787, 788,
 &end
#
#   54 ILE  MD1          54 ILE  MG2         3.50    (#   2653:20  Unique         2.08, 3.77 A)
 &rst
  ixpk= 2653, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 793, 794, 795,
 igr2= 786, 787, 788,
 &end
#
#    0 AMB  20-3:2657    54 ILE  MG2         5.00    (#   2657:20  Single Ambig)
 &rst
  ixpk= 2657, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.74, r4= 7.24,
 igr1= 799, 831,
 igr2= 786, 787, 788,
 &end
#
#   56 GLN  HG-          54 ILE  MG2         5.00    (#   2658:20  Unique         2.83, 5.14 A)
 &rst
  ixpk= 2658, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.74, r4= 7.24,
 igr1= 821, 822,
 igr2= 786, 787, 788,
 &end
#
#   63 TYR  QE           74 ILE  MD1         5.00    (#   2681:20  Unique         4.35, 6.35 A)
 &rst
  ixpk= 2681, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.74, r4= 7.24,
 igr1= 934, 939,
 igr2=1107,1108,1109,
 &end
#
#   74 ILE  HB           74 ILE  MD1         3.50    (#   2683:20  Unique         2.36, 3.08 A)
 &rst
  ixpk= 2683, nxpk= 20, iat=1098,  -1, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
 igr2=1107,1108,1109,
 &end
#
#   74 ILE  HG1+         74 ILE  MD1         2.70    (#   2684:20  Preassigned    2.31, 2.67 A)
 &rst
  ixpk= 2684, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 3.64, r4= 4.14,
 igr1=1104,1105,
 igr2=1107,1108,1109,
 &end
#
#   74 ILE  MG2          74 ILE  MD1         2.70    (#   2685:20  Preassigned    2.16, 3.84 A)
 &rst
  ixpk= 2685, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 3.89, r4= 4.39,
 igr1=1100,1101,1102,
 igr2=1107,1108,1109,
 &end
#
#   72 LEU  MDX          74 ILE  MD1         3.50    (#   2688:20  Preassigned    2.55, 5.67 A)
 &rst
  ixpk= 2688, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1=1065,1066,1067,1069,1070,1071,
 igr2=1107,1108,1109,
 &end
#
#   53 PRO  HD-          53 PRO  HB-         5.00    (#   2750:20  Unique         2.69, 3.66 A)
 &rst
  ixpk= 2750, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.30, r4= 6.80,
 igr1= 767, 768,
 igr2= 773, 774,
 &end
#
#    0 AMB  20-3:2762    62 LYS  HD-         5.00    (#   2762:20  Single Ambig)
 &rst
  ixpk= 2762, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.30, r4= 6.80,
 igr1= 904,1115,
 igr2= 912, 913,
 &end
#
#   42 GLU  HN           40 PHE  HA          5.00    (#   2782:20  Preassigned    3.20, 3.39 A)
 &rst
  ixpk= 2782, nxpk= 20, iat= 598, 566, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50,  &end
#
#   24 THR  HN           23 ALA  HA          3.50    (#   2796:20  Preassigned    2.39, 2.53 A)
 &rst
  ixpk= 2796, nxpk= 20, iat= 358, 350, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#    0 AMB  20-3:2798    86 ILE  MD1         5.00    (#   2798:20  Single Ambig)
 &rst
  ixpk= 2798, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.74, r4= 7.24,
 igr1= 698,1473,
 igr2=1304,1305,1306,
 &end
#
#    0 AMB  20-3:2807    95 GLU  HA          2.70    (#   2807:20  Single Ambig)
 &rst
  ixpk= 2807, nxpk= 20, iat=  -1,1419, r1= 1.30, r2= 1.80, r3= 3.64, r4= 4.14,
 igr1=1421,1422,1421,1422,1353,1354,
 &end
#
#    0 AMB  20-3:2808    95 GLU  HA          2.70    (#   2808:20  Single Ambig)
 &rst
  ixpk= 2808, nxpk= 20, iat=  -1,1419, r1= 1.30, r2= 1.80, r3= 3.40, r4= 3.90,
 igr1=1424,1425,1356,1357,
 &end
#
#   90 GLU  HA           95 GLU  HA          3.50    (#   2810:20  Preassigned    2.13, 2.19 A)
 &rst
  ixpk= 2810, nxpk= 20, iat=1351,1419, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   88 ILE  MD1          47 TRP  HA          5.00    (#   2812:20  Preassigned    2.46, 5.55 A)
 &rst
  ixpk= 2812, nxpk= 20, iat=  -1, 674, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,
 igr1=1333,1334,1335,
 &end
#
#   87 CYS  HA           47 TRP  HA          5.00    (#   2813:20  Unique         2.18, 2.27 A)
 &rst
  ixpk= 2813, nxpk= 20, iat=1312, 674, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50,  &end
#
#    0 AMB  20-3:2814    22 ASN  HA          5.00    (#   2814:20  Single Ambig)
 &rst
  ixpk= 2814, nxpk= 20, iat=  -1, 336, r1= 1.30, r2= 1.80, r3= 7.57, r4= 8.07,
 igr1=1530,1531,1532,1534,1535,1536,1530,1531,1532,1534,
      1535,1536,
 &end
#
#   20 THR  MG2          22 ASN  HA          5.00    (#   2815:20  Preassigned    4.98, 6.54 A)
 &rst
  ixpk= 2815, nxpk= 20, iat=  -1, 336, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,
 igr1= 309, 310, 311,
 &end
#
#  103 LYS  HN           22 ASN  HA          5.00    (#   2818:20  Unique         2.55, 2.91 A)
 &rst
  ixpk= 2818, nxpk= 20, iat=1540, 336, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50,  &end
#
#   10 VAL  MG1          10 VAL  HA          5.00    (#   2819:20  Preassigned    2.48, 3.14 A)
 &rst
  ixpk= 2819, nxpk= 20, iat=  -1, 148, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,
 igr1= 152, 153, 154,
 &end
#
#   10 VAL  HB           10 VAL  HA          3.50    (#   2820:20  Preassigned    3.00, 3.02 A)
 &rst
  ixpk= 2820, nxpk= 20, iat= 150, 148, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   10 VAL  MG2          10 VAL  HA          5.00    (#   2822:20  Preassigned    2.44, 3.10 A)
 &rst
  ixpk= 2822, nxpk= 20, iat=  -1, 148, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,
 igr1= 156, 157, 158,
 &end
#
#   11 PRO  HD+          10 VAL  HA          2.70    (#   2826:20  Preassigned    2.18, 2.34 A)
 &rst
  ixpk= 2826, nxpk= 20, iat=  -1, 148, r1= 1.30, r2= 1.80, r3= 3.03, r4= 3.53,
 igr1= 163, 164,
 &end
#
#   11 PRO  HD-          10 VAL  HA          3.50    (#   2827:20  Preassigned    2.18, 2.34 A)
 &rst
  ixpk= 2827, nxpk= 20, iat=  -1, 148, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1= 163, 164,
 &end
#
#   10 VAL  MG1          10 VAL  HB          3.50    (#   2830:20  Preassigned    2.39, 2.65 A)
 &rst
  ixpk= 2830, nxpk= 20, iat=  -1, 150, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
 igr1= 152, 153, 154,
 &end
#
#   10 VAL  MG2          10 VAL  HB          3.50    (#   2831:20  Preassigned    2.44, 2.67 A)
 &rst
  ixpk= 2831, nxpk= 20, iat=  -1, 150, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
 igr1= 156, 157, 158,
 &end
#
#   40 PHE  HN           10 VAL  HB          3.50    (#   2834:20  Preassigned    2.04, 2.21 A)
 &rst
  ixpk= 2834, nxpk= 20, iat= 564, 150, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#    0 AMB  20-3:2850    74 ILE  HA          3.50    (#   2850:20  Single Ambig)
 &rst
  ixpk= 2850, nxpk= 20, iat=  -1,1096, r1= 1.30, r2= 1.80, r3= 4.58, r4= 5.08,
 igr1=1104,1105,1100,1101,1102,
 &end
#
#   21 MET  QG           33 LEU  MDX         5.00    (#   2865:20  Preassigned    2.49, 5.01 A)
 &rst
  ixpk= 2865, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.57, r4= 8.07,
 igr1= 324, 325,
 igr2= 493, 494, 495, 497, 498, 499,
 &end
#
#   33 LEU  HG           33 LEU  MDX         2.70    (#   2867:20  Preassigned    2.36, 2.66 A)
 &rst
  ixpk= 2867, nxpk= 20, iat= 491,  -1, r1= 1.30, r2= 1.80, r3= 3.64, r4= 4.14,
 igr2= 493, 494, 495, 497, 498, 499,
 &end
#
#    0 AMB  20-3:2868    33 LEU  MDX         3.50    (#   2868:20  Single Ambig)
 &rst
  ixpk= 2868, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.94, r4= 6.44,
 igr1= 489,1498,1499,1500,
 igr2= 493, 494, 495, 497, 498, 499,
 &end
#
#   21 MET  ME           33 LEU  MDX         5.00    (#   2875:20  Unique         2.35, 5.52 A)
 &rst
  ixpk= 2875, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.09, r4= 8.59,
 igr1= 328, 329, 330,
 igr2= 493, 494, 495, 497, 498, 499,
 &end
#
#   33 LEU  HA           33 LEU  MDX         3.50    (#   2876:20  Preassigned    3.81, 4.75 A)
 &rst
  ixpk= 2876, nxpk= 20, iat= 486,  -1, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,
 igr2= 493, 494, 495, 497, 498, 499,
 &end
#
#   85 TYR  HB-          33 LEU  MDX         5.00    (#   2877:20  Unique         4.53, 7.08 A)
 &rst
  ixpk= 2877, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.57, r4= 8.07,
 igr1=1274,1275,
 igr2= 493, 494, 495, 497, 498, 499,
 &end
#
#   47 TRP  HN           46 THR  HB          5.00    (#   2878:20  Preassigned    2.26, 2.90 A)
 &rst
  ixpk= 2878, nxpk= 20, iat= 672, 662, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50,  &end
#
#   46 THR  MG2          46 THR  HB          3.50    (#   2879:20  Preassigned    2.33, 2.66 A)
 &rst
  ixpk= 2879, nxpk= 20, iat=  -1, 662, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
 igr1= 664, 665, 666,
 &end
#
#   46 THR  HA           46 THR  HB          5.00    (#   2880:20  Preassigned    2.29, 2.44 A)
 &rst
  ixpk= 2880, nxpk= 20, iat= 660, 662, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50,  &end
#
#   88 ILE  HA           88 ILE  MG2         5.00    (#   2882:20  Unique         2.43, 3.12 A)
 &rst
  ixpk= 2882, nxpk= 20, iat=1322,  -1, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,
 igr2=1326,1327,1328,
 &end
#
#    0 AMB  20-3:2883    88 ILE  MG2         3.50    (#   2883:20  Single Ambig)
 &rst
  ixpk= 2883, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.30, r4= 5.80,
 igr1=1356,1357,1424,1425,
 igr2=1326,1327,1328,
 &end
#
#    0 AMB  20-3:2884    88 ILE  MG2         3.50    (#   2884:20  Single Ambig)
 &rst
  ixpk= 2884, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.94, r4= 6.44,
 igr1=1353,1354,1421,1422,1421,1422,1436,1437,
 igr2=1326,1327,1328,
 &end
#
#   88 ILE  HB           88 ILE  MG2         3.50    (#   2885:20  Unique         2.40, 2.67 A)
 &rst
  ixpk= 2885, nxpk= 20, iat=1324,  -1, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
 igr2=1326,1327,1328,
 &end
#
#    0 AMB  20-3:2886     0 AMB  20-2:2886   3.50    (#   2886:20  Double Ambig)
 &rst
  ixpk= 2886, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.94, r4= 6.44,
 igr1=1330,1331,1330,1331,
 igr2=1326,1327,1328,1297,1298,1299,
 &end
#
#    0 AMB  20-3:2889     7 ILE  MG2         5.00    (#   2889:20  Single Ambig)
 &rst
  ixpk= 2889, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.74, r4= 7.24,
 igr1=  99, 118,
 igr2= 103, 104, 105,
 &end
#
#    7 ILE  HB            7 ILE  MG2         3.50    (#   2890:20  Unique         2.40, 2.67 A)
 &rst
  ixpk= 2890, nxpk= 20, iat= 101,  -1, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
 igr2= 103, 104, 105,
 &end
#
#    0 AMB  20-3:2891     7 ILE  MG2         3.50    (#   2891:20  Single Ambig)
 &rst
  ixpk= 2891, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,
 igr1= 107, 108, 152, 153, 154,
 igr2= 103, 104, 105,
 &end
#
#   97 ASP  HB+          86 ILE  MG2         3.50    (#   2894:20  Unique         2.85, 4.55 A)
 &rst
  ixpk= 2894, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,
 igr1=1453,1454,
 igr2=1297,1298,1299,
 &end
#
#   97 ASP  HB-          86 ILE  MG2         3.50    (#   2895:20  Unique         2.85, 4.55 A)
 &rst
  ixpk= 2895, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,
 igr1=1453,1454,
 igr2=1297,1298,1299,
 &end
#
#   86 ILE  HB           86 ILE  MG2         3.50    (#   2896:20  Unique         2.37, 2.67 A)
 &rst
  ixpk= 2896, nxpk= 20, iat=1295,  -1, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
 igr2=1297,1298,1299,
 &end
#
#   86 ILE  HG1+         86 ILE  MG2         5.00    (#   2897:20  Unique         2.39, 3.52 A)
 &rst
  ixpk= 2897, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.74, r4= 7.24,
 igr1=1301,1302,
 igr2=1297,1298,1299,
 &end
#
#   73 ILE  HB           73 ILE  MG2         2.70    (#   2899:20  Preassigned    2.43, 2.67 A)
 &rst
  ixpk= 2899, nxpk= 20, iat=1079,  -1, r1= 1.30, r2= 1.80, r3= 3.24, r4= 3.74,
 igr2=1081,1082,1083,
 &end
#
#   73 ILE  HG1-         73 ILE  MG2         3.50    (#   2900:20  Unique         2.29, 3.16 A)
 &rst
  ixpk= 2900, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,
 igr1=1085,1086,
 igr2=1081,1082,1083,
 &end
#
#   31 VAL  MG1          33 LEU  HN          5.00    (#      0:10  Preassigned    4.27, 5.68 A)
 &rst
  ixpk= 0, nxpk= 10, iat=  -1, 484, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,
 igr1= 460, 461, 462,
 &end
#
#   74 ILE  HN           33 LEU  HN          5.00    (#      2:10  Preassigned    4.20, 4.47 A)
 &rst
  ixpk= 2, nxpk= 10, iat=1094, 484, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50,  &end
#
#   32 THR  HN           33 LEU  HN          5.00    (#      3:10  Preassigned    4.40, 4.49 A)
 &rst
  ixpk= 3, nxpk= 10, iat= 470, 484, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50,  &end
#
#   32 THR  HA           33 LEU  HN          2.70    (#      4:10  Unique         2.18, 2.21 A)
 &rst
  ixpk= 4, nxpk= 10, iat= 472, 484, r1= 1.30, r2= 1.80, r3= 2.70, r4= 3.20,  &end
#
#   73 ILE  HA           33 LEU  HN          5.00    (#      5:10  Preassigned    3.44, 3.58 A)
 &rst
  ixpk= 5, nxpk= 10, iat=1077, 484, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50,  &end
#
#   33 LEU  HA           33 LEU  HN          3.50    (#      6:10  Unique         2.83, 2.88 A)
 &rst
  ixpk= 6, nxpk= 10, iat= 486, 484, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   33 LEU  HG           33 LEU  HN          3.50    (#      7:10  Preassigned    2.62, 2.91 A)
 &rst
  ixpk= 7, nxpk= 10, iat= 491, 484, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   33 LEU  HB3          33 LEU  HN          3.50    (#      8:10  Unique         3.55, 3.60 A)
 &rst
  ixpk= 8, nxpk= 10, iat= 489, 484, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   32 THR  MG2          33 LEU  HN          3.50    (#      9:10  Unique         2.89, 3.63 A)
 &rst
  ixpk= 9, nxpk= 10, iat=  -1, 484, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
 igr1= 476, 477, 478,
 &end
#
#   33 LEU  MDX          33 LEU  HN          5.00    (#     10:10  Unique         2.27, 4.38 A)
 &rst
  ixpk= 10, nxpk= 10, iat=  -1, 484, r1= 1.30, r2= 1.80, r3= 6.74, r4= 7.24,
 igr1= 493, 494, 495, 497, 498, 499,
 &end
#
#   33 LEU  MDY          33 LEU  HN          5.00    (#     11:10  Preassigned    2.27, 4.38 A)
 &rst
  ixpk= 11, nxpk= 10, iat=  -1, 484, r1= 1.30, r2= 1.80, r3= 6.74, r4= 7.24,
 igr1= 493, 494, 495, 497, 498, 499,
 &end
#
#   50 ASP  HB-          50 ASP  HN          5.00    (#     19:10  Unique         2.36, 3.41 A)
 &rst
  ixpk= 19, nxpk= 10, iat=  -1, 732, r1= 1.30, r2= 1.80, r3= 5.61, r4= 6.11,
 igr1= 736, 737,
 &end
#
#   84 GLU  HB-          50 ASP  HN          5.00    (#     20:10  Unique         2.90, 4.38 A)
 &rst
  ixpk= 20, nxpk= 10, iat=  -1, 732, r1= 1.30, r2= 1.80, r3= 5.61, r4= 6.11,
 igr1=1259,1260,
 &end
#
#   51 GLY  HN           50 ASP  HN          3.50    (#     23:10  Preassigned    3.04, 3.41 A)
 &rst
  ixpk= 23, nxpk= 10, iat= 744, 732, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   84 GLU  HN           50 ASP  HN          5.00    (#     24:10  Unique         2.59, 3.17 A)
 &rst
  ixpk= 24, nxpk= 10, iat=1255, 732, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50,  &end
#
#   50 ASP  HA           50 ASP  HN          3.50    (#     26:10  Unique         2.21, 2.38 A)
 &rst
  ixpk= 26, nxpk= 10, iat= 734, 732, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   49 LYS  HA           50 ASP  HN          3.50    (#     27:10  Unique         2.11, 2.31 A)
 &rst
  ixpk= 27, nxpk= 10, iat= 712, 732, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   50 ASP  HB+          50 ASP  HN          3.50    (#     28:10  Unique         2.36, 3.41 A)
 &rst
  ixpk= 28, nxpk= 10, iat=  -1, 732, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1= 736, 737,
 &end
#
#   84 GLU  HB+          50 ASP  HN          5.00    (#     29:10  Preassigned    2.90, 4.38 A)
 &rst
  ixpk= 29, nxpk= 10, iat=  -1, 732, r1= 1.30, r2= 1.80, r3= 5.61, r4= 6.11,
 igr1=1259,1260,
 &end
#
#    0 AMB  10-2:30      50 ASP  HN          3.50    (#     30:10  Single Ambig)
 &rst
  ixpk= 30, nxpk= 10, iat=  -1, 732, r1= 1.30, r2= 1.80, r3= 4.58, r4= 5.08,
 igr1=1249,1250,1251,1301,1302,
 &end
#
#   86 ILE  MD1          50 ASP  HN          6.00    (#     31:10  Preassigned    2.65, 5.78 A)
 &rst
  ixpk= 31, nxpk= 10, iat=  -1, 732, r1= 1.30, r2= 1.80, r3= 7.21, r4= 7.71,
 igr1=1304,1305,1306,
 &end
#
#   85 TYR  QD           85 TYR  HN          5.00    (#     38:10  Preassigned    3.13, 3.76 A)
 &rst
  ixpk= 38, nxpk= 10, iat=  -1,1270, r1= 1.30, r2= 1.80, r3= 5.61, r4= 6.11,
 igr1=1278,1287,
 &end
#
#   85 TYR  QE           85 TYR  HN          6.00    (#     39:10  Preassigned    5.28, 5.69 A)
 &rst
  ixpk= 39, nxpk= 10, iat=  -1,1270, r1= 1.30, r2= 1.80, r3= 6.73, r4= 7.23,
 igr1=1280,1285,
 &end
#
#   85 TYR  HA           85 TYR  HN          3.50    (#     40:10  Unique         2.89, 2.91 A)
 &rst
  ixpk= 40, nxpk= 10, iat=1272,1270, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#    0 AMB  10-2:41      85 TYR  HN          3.50    (#     41:10  Single Ambig)
 &rst
  ixpk= 41, nxpk= 10, iat=  -1,1270, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1=1506,1293,
 &end
#
#   84 GLU  HA           85 TYR  HN          3.50    (#     42:10  Unique         2.20, 2.29 A)
 &rst
  ixpk= 42, nxpk= 10, iat=1257,1270, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   85 TYR  HB+          85 TYR  HN          3.50    (#     43:10  Unique         2.37, 3.04 A)
 &rst
  ixpk= 43, nxpk= 10, iat=  -1,1270, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1=1274,1275,
 &end
#
#   85 TYR  HB-          85 TYR  HN          3.50    (#     44:10  Unique         2.37, 3.04 A)
 &rst
  ixpk= 44, nxpk= 10, iat=  -1,1270, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1=1274,1275,
 &end
#
#    0 AMB  10-2:45      85 TYR  HN          3.50    (#     45:10  Single Ambig)
 &rst
  ixpk= 45, nxpk= 10, iat=  -1,1270, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
 igr1=1489,1262,1263,
 &end
#
#    0 AMB  10-2:46      85 TYR  HN          5.00    (#     46:10  Single Ambig)
 &rst
  ixpk= 46, nxpk= 10, iat=  -1,1270, r1= 1.30, r2= 1.80, r3= 6.74, r4= 7.24,
 igr1=1477,1478,1479,1491,1492,1493,
 &end
#
#    0 AMB  10-2:48      89 ALA  HN          5.00    (#     48:10  Single Ambig)
 &rst
  ixpk= 48, nxpk= 10, iat=  -1,1339, r1= 1.30, r2= 1.80, r3= 6.74, r4= 7.24,
 igr1= 180, 181,1353,1354, 183, 184,
 &end
#
#    0 AMB  10-2:49      89 ALA  HN          5.00    (#     49:10  Single Ambig)
 &rst
  ixpk= 49, nxpk= 10, iat=  -1,1339, r1= 1.30, r2= 1.80, r3= 6.74, r4= 7.24,
 igr1=1436,1437, 645, 652, 653, 654,
 &end
#
#    0 AMB  10-2:50      89 ALA  HN          5.00    (#     50:10  Single Ambig)
 &rst
  ixpk= 50, nxpk= 10, iat=  -1,1339, r1= 1.30, r2= 1.80, r3= 7.07, r4= 7.57,
 igr1=1330,1331, 539, 540, 541, 664, 665, 666,
 &end
#
#   89 ALA  MB           89 ALA  HN          3.50    (#     51:10  Unique         2.63, 3.30 A)
 &rst
  ixpk= 51, nxpk= 10, iat=  -1,1339, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
 igr1=1343,1344,1345,
 &end
#
#   96 GLN  HN           89 ALA  HN          5.00    (#     56:10  Unique         2.94, 3.01 A)
 &rst
  ixpk= 56, nxpk= 10, iat=1432,1339, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50,  &end
#
#   97 ASP  HA           89 ALA  HN          5.00    (#     58:10  Unique         3.03, 3.28 A)
 &rst
  ixpk= 58, nxpk= 10, iat=1451,1339, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50,  &end
#
#   89 ALA  HA           89 ALA  HN          5.00    (#     59:10  Unique         2.90, 2.96 A)
 &rst
  ixpk= 59, nxpk= 10, iat=1341,1339, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50,  &end
#
#   88 ILE  HA           89 ALA  HN          2.70    (#     60:10  Unique         2.19, 2.26 A)
 &rst
  ixpk= 60, nxpk= 10, iat=1322,1339, r1= 1.30, r2= 1.80, r3= 2.70, r4= 3.20,  &end
#
#   14 VAL  MGX          89 ALA  HN          3.50    (#     62:10  Unique         2.46, 4.46 A)
 &rst
  ixpk= 62, nxpk= 10, iat=  -1,1339, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,
 igr1= 207, 208, 209, 211, 212, 213,
 &end
#
#   14 VAL  MGY          89 ALA  HN          2.70    (#     63:10  Preassigned    2.46, 4.46 A)
 &rst
  ixpk= 63, nxpk= 10, iat=  -1,1339, r1= 1.30, r2= 1.80, r3= 3.64, r4= 4.14,
 igr1= 207, 208, 209, 211, 212, 213,
 &end
#
#   52 GLU  HN           51 GLY  HN          3.50    (#     77:10  Unique         2.13, 2.41 A)
 &rst
  ixpk= 77, nxpk= 10, iat= 751, 744, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   48 THR  HA           51 GLY  HN          6.00    (#     79:10  Unique         4.24, 4.75 A)
 &rst
  ixpk= 79, nxpk= 10, iat= 698, 744, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,  &end
#
#   51 GLY  HA+          51 GLY  HN          3.50    (#     81:10  Unique         2.30, 2.74 A)
 &rst
  ixpk= 81, nxpk= 10, iat=  -1, 744, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1= 746, 747,
 &end
#
#   50 ASP  HB-          51 GLY  HN          5.00    (#     82:10  Unique         2.48, 3.85 A)
 &rst
  ixpk= 82, nxpk= 10, iat=  -1, 744, r1= 1.30, r2= 1.80, r3= 5.61, r4= 6.11,
 igr1= 736, 737,
 &end
#
#   86 ILE  MD1          51 GLY  HN          6.00    (#     84:10  Preassigned    3.51, 6.21 A)
 &rst
  ixpk= 84, nxpk= 10, iat=  -1, 744, r1= 1.30, r2= 1.80, r3= 7.21, r4= 7.71,
 igr1=1304,1305,1306,
 &end
#
#   50 ASP  HN           51 GLY  HN          3.50    (#     85:10  Unique         3.04, 3.41 A)
 &rst
  ixpk= 85, nxpk= 10, iat= 732, 744, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   49 LYS  HN           51 GLY  HN          5.00    (#     86:10  Preassigned    3.70, 3.87 A)
 &rst
  ixpk= 86, nxpk= 10, iat= 710, 744, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50,  &end
#
#   50 ASP  HA           51 GLY  HN          3.50    (#     87:10  Unique         2.61, 3.11 A)
 &rst
  ixpk= 87, nxpk= 10, iat= 734, 744, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   48 THR  HB           51 GLY  HN          3.50    (#     88:10  Preassigned    2.56, 3.37 A)
 &rst
  ixpk= 88, nxpk= 10, iat= 700, 744, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   45 MET  HG+          47 TRP  HE1         5.00    (#     89:10  Unique         3.30, 4.48 A)
 &rst
  ixpk= 89, nxpk= 10, iat=  -1, 682, r1= 1.30, r2= 1.80, r3= 5.61, r4= 6.11,
 igr1= 648, 649,
 &end
#
#   47 TRP  HZ2          47 TRP  HE1         3.50    (#     90:10  Preassigned    2.85, 2.89 A)
 &rst
  ixpk= 90, nxpk= 10, iat= 685, 682, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   47 TRP  HD1          47 TRP  HE1         3.50    (#    103:10  Preassigned    2.45, 2.49 A)
 &rst
  ixpk= 103, nxpk= 10, iat= 680, 682, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   45 MET  ME           47 TRP  HE1         5.00    (#    105:10  Preassigned    2.12, 3.45 A)
 &rst
  ixpk= 105, nxpk= 10, iat=  -1, 682, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,
 igr1= 652, 653, 654,
 &end
#
#   70 SER  HA           47 TRP  HE1         5.00    (#    107:10  Preassigned    4.27, 4.79 A)
 &rst
  ixpk= 107, nxpk= 10, iat=1032, 682, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50,  &end
#
#   78 ASP  HA           78 ASP  HN          3.50    (#    126:10  Unique         2.81, 2.87 A)
 &rst
  ixpk= 126, nxpk= 10, iat=1175,1173, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#  102 LEU  HB+          83 ALA  HN          3.50    (#    128:10  Unique         2.38, 3.41 A)
 &rst
  ixpk= 128, nxpk= 10, iat=  -1,1245, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1=1525,1526,
 &end
#
#   82 GLU  HN           83 ALA  HN          5.00    (#    129:10  Unique         4.56, 4.62 A)
 &rst
  ixpk= 129, nxpk= 10, iat=1230,1245, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50,  &end
#
#   83 ALA  HA           83 ALA  HN          3.50    (#    130:10  Unique         2.90, 2.93 A)
 &rst
  ixpk= 130, nxpk= 10, iat=1247,1245, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   82 GLU  HA           83 ALA  HN          2.70    (#    132:10  Unique         2.19, 2.23 A)
 &rst
  ixpk= 132, nxpk= 10, iat=1232,1245, r1= 1.30, r2= 1.80, r3= 2.70, r4= 3.20,  &end
#
#   82 GLU  HG+          83 ALA  HN          3.50    (#    133:10  Unique         2.69, 3.20 A)
 &rst
  ixpk= 133, nxpk= 10, iat=  -1,1245, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1=1237,1238,
 &end
#
#   82 GLU  HB+          83 ALA  HN          5.00    (#    134:10  Unique         4.20, 4.32 A)
 &rst
  ixpk= 134, nxpk= 10, iat=  -1,1245, r1= 1.30, r2= 1.80, r3= 5.61, r4= 6.11,
 igr1=1234,1235,
 &end
#
#   82 GLU  HG-          83 ALA  HN          3.50    (#    135:10  Unique         2.69, 3.20 A)
 &rst
  ixpk= 135, nxpk= 10, iat=  -1,1245, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1=1237,1238,
 &end
#
#  102 LEU  HB-          83 ALA  HN          5.00    (#    136:10  Unique         2.38, 3.41 A)
 &rst
  ixpk= 136, nxpk= 10, iat=  -1,1245, r1= 1.30, r2= 1.80, r3= 5.61, r4= 6.11,
 igr1=1525,1526,
 &end
#
#   83 ALA  MB           83 ALA  HN          3.50    (#    137:10  Unique         2.86, 3.42 A)
 &rst
  ixpk= 137, nxpk= 10, iat=  -1,1245, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
 igr1=1249,1250,1251,
 &end
#
#    0 AMB  10-2:138     83 ALA  HN          3.50    (#    138:10  Single Ambig)
 &rst
  ixpk= 138, nxpk= 10, iat=  -1,1245, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1=1530,1531,1532,1534,1535,1536,1530,1531,1532,1534,
      1535,1536,1568,1569,1570,1572,1573,1574,
 &end
#
#   77 VAL  HA           78 ASP  HN          2.70    (#    143:10  Unique         2.08, 2.20 A)
 &rst
  ixpk= 143, nxpk= 10, iat=1159,1173, r1= 1.30, r2= 1.80, r3= 2.70, r4= 3.20,  &end
#
#   77 VAL  MG2          78 ASP  HN          5.00    (#    144:10  Unique         4.06, 4.90 A)
 &rst
  ixpk= 144, nxpk= 10, iat=  -1,1173, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,
 igr1=1167,1168,1169,
 &end
#
#    0 AMB  10-2:145     78 ASP  HN          6.00    (#    145:10  Single Ambig)
 &rst
  ixpk= 145, nxpk= 10, iat=  -1,1173, r1= 1.30, r2= 1.80, r3= 6.73, r4= 7.23,
 igr1=1218,1157,
 &end
#
#    0 AMB  10-2:146     78 ASP  HN          5.00    (#    146:10  Single Ambig)
 &rst
  ixpk= 146, nxpk= 10, iat=  -1,1173, r1= 1.30, r2= 1.80, r3= 5.61, r4= 6.11,
 igr1= 374, 417,
 &end
#
#   81 ASP  HB+          78 ASP  HN          5.00    (#    147:10  Unique         2.33, 3.30 A)
 &rst
  ixpk= 147, nxpk= 10, iat=  -1,1173, r1= 1.30, r2= 1.80, r3= 5.61, r4= 6.11,
 igr1=1222,1223,
 &end
#
#   78 ASP  HB-          78 ASP  HN          3.50    (#    148:10  Unique         3.00, 3.45 A)
 &rst
  ixpk= 148, nxpk= 10, iat=  -1,1173, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1=1177,1178,
 &end
#
#  104 VAL  MGX          78 ASP  HN          5.00    (#    149:10  Unique         3.65, 4.93 A)
 &rst
  ixpk= 149, nxpk= 10, iat=  -1,1173, r1= 1.30, r2= 1.80, r3= 6.74, r4= 7.24,
 igr1=1568,1569,1570,1572,1573,1574,
 &end
#
#    0 AMB  10-2:150    103 LYS  HN          5.00    (#    150:10  Single Ambig)
 &rst
  ixpk= 150, nxpk= 10, iat=  -1,1540, r1= 1.30, r2= 1.80, r3= 5.61, r4= 6.11,
 igr1= 334, 348,
 &end
#
#   22 ASN  HA          103 LYS  HN          3.50    (#    151:10  Unique         2.55, 2.91 A)
 &rst
  ixpk= 151, nxpk= 10, iat= 336,1540, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   20 THR  HA          103 LYS  HN          5.00    (#    152:10  Unique         4.76, 4.98 A)
 &rst
  ixpk= 152, nxpk= 10, iat= 305,1540, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50,  &end
#
#  102 LEU  HA          103 LYS  HN          2.70    (#    153:10  Unique         2.18, 2.24 A)
 &rst
  ixpk= 153, nxpk= 10, iat=1523,1540, r1= 1.30, r2= 1.80, r3= 2.70, r4= 3.20,  &end
#
#  103 LYS  HA          103 LYS  HN          3.50    (#    154:10  Unique         2.94, 2.98 A)
 &rst
  ixpk= 154, nxpk= 10, iat=1542,1540, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#    0 AMB  10-2:155    103 LYS  HN          5.00    (#    155:10  Single Ambig)
 &rst
  ixpk= 155, nxpk= 10, iat=  -1,1540, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,
 igr1= 322,1234,1235,
 &end
#
#  103 LYS  HB-         103 LYS  HN          3.50    (#    156:10  Unique         2.40, 3.20 A)
 &rst
  ixpk= 156, nxpk= 10, iat=  -1,1540, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1=1544,1545,
 &end
#
#    0 AMB  10-2:157    103 LYS  HN          3.50    (#    157:10  Single Ambig)
 &rst
  ixpk= 157, nxpk= 10, iat=  -1,1540, r1= 1.30, r2= 1.80, r3= 4.58, r4= 5.08,
 igr1=1547,1548, 309, 310, 311,
 &end
#
#  103 LYS  HG-         103 LYS  HN          3.50    (#    158:10  Unique         2.12, 2.97 A)
 &rst
  ixpk= 158, nxpk= 10, iat=  -1,1540, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1=1547,1548,
 &end
#
#    0 AMB  10-2:159    103 LYS  HN          3.50    (#    159:10  Single Ambig)
 &rst
  ixpk= 159, nxpk= 10, iat=  -1,1540, r1= 1.30, r2= 1.80, r3= 5.30, r4= 5.80,
 igr1=1530,1531,1532,1534,1535,1536,1530,1531,1532,1534,
      1535,1536,
 &end
#
#  104 VAL  HN          103 LYS  HN          5.00    (#    160:10  Unique         3.69, 4.07 A)
 &rst
  ixpk= 160, nxpk= 10, iat=1562,1540, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50,  &end
#
#  103 LYS  HA           83 ALA  HN          5.00    (#    161:10  Unique         3.69, 3.94 A)
 &rst
  ixpk= 161, nxpk= 10, iat=1542,1245, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50,  &end
#
#   82 GLU  HB-          83 ALA  HN          5.00    (#    162:10  Unique         4.20, 4.32 A)
 &rst
  ixpk= 162, nxpk= 10, iat=  -1,1245, r1= 1.30, r2= 1.80, r3= 5.61, r4= 6.11,
 igr1=1234,1235,
 &end
#
#  105 PHE  HN           25 ALA  HN          5.00    (#    206:10  Unique         2.88, 3.47 A)
 &rst
  ixpk= 206, nxpk= 10, iat=1578, 372, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50,  &end
#
#   24 THR  HA           25 ALA  HN          2.70    (#    207:10  Unique         2.20, 2.30 A)
 &rst
  ixpk= 207, nxpk= 10, iat= 360, 372, r1= 1.30, r2= 1.80, r3= 2.70, r4= 3.20,  &end
#
#  104 VAL  HA           25 ALA  HN          5.00    (#    209:10  Preassigned    3.72, 4.71 A)
 &rst
  ixpk= 209, nxpk= 10, iat=1564, 372, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50,  &end
#
#    0 AMB  10-2:210     25 ALA  HN          2.70    (#    210:10  Single Ambig)
 &rst
  ixpk= 210, nxpk= 10, iat=  -1, 372, r1= 1.30, r2= 1.80, r3= 3.53, r4= 4.03,
 igr1= 376, 377, 378,1615,1616,
 &end
#
#    0 AMB  10-2:211     25 ALA  HN          6.00    (#    211:10  Single Ambig)
 &rst
  ixpk= 211, nxpk= 10, iat=  -1, 372, r1= 1.30, r2= 1.80, r3= 6.73, r4= 7.23,
 igr1= 362,1187,
 &end
#
#   79 LYS  HG-          25 ALA  HN          5.00    (#    212:10  Preassigned    5.00, 5.99 A)
 &rst
  ixpk= 212, nxpk= 10, iat=  -1, 372, r1= 1.30, r2= 1.80, r3= 5.61, r4= 6.11,
 igr1=1192,1193,
 &end
#
#  104 VAL  MGY          25 ALA  HN          5.00    (#    213:10  Unique         2.17, 4.76 A)
 &rst
  ixpk= 213, nxpk= 10, iat=  -1, 372, r1= 1.30, r2= 1.80, r3= 6.74, r4= 7.24,
 igr1=1568,1569,1570,1572,1573,1574,
 &end
#
#   36 ASP  HN           37 ALA  HN          5.00    (#    218:10  Preassigned    3.51, 4.22 A)
 &rst
  ixpk= 218, nxpk= 10, iat= 523, 535, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50,  &end
#
#   37 ALA  HA           37 ALA  HN          3.50    (#    219:10  Unique         2.91, 2.95 A)
 &rst
  ixpk= 219, nxpk= 10, iat= 537, 535, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   36 ASP  HA           37 ALA  HN          2.70    (#    220:10  Unique         2.14, 2.25 A)
 &rst
  ixpk= 220, nxpk= 10, iat= 525, 535, r1= 1.30, r2= 1.80, r3= 2.70, r4= 3.20,  &end
#
#   36 ASP  HB2          37 ALA  HN          5.00    (#    221:10  Preassigned    3.07, 3.81 A)
 &rst
  ixpk= 221, nxpk= 10, iat= 527, 535, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50,  &end
#
#   37 ALA  MB           37 ALA  HN          3.50    (#    223:10  Unique         2.38, 2.97 A)
 &rst
  ixpk= 223, nxpk= 10, iat=  -1, 535, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
 igr1= 539, 540, 541,
 &end
#
#   24 THR  HB           25 ALA  HN          5.00    (#    224:10  Preassigned    3.86, 4.15 A)
 &rst
  ixpk= 224, nxpk= 10, iat= 362, 372, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50,  &end
#
#   25 ALA  HA           25 ALA  HN          3.50    (#    225:10  Unique         2.30, 2.78 A)
 &rst
  ixpk= 225, nxpk= 10, iat= 374, 372, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#    0 AMB  10-2:226     25 ALA  HN          3.50    (#    226:10  Single Ambig)
 &rst
  ixpk= 226, nxpk= 10, iat=  -1, 372, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,
 igr1= 364, 365, 366, 352, 353, 354,
 &end
#
#  104 VAL  MGX          25 ALA  HN          3.50    (#    227:10  Unique         2.17, 4.76 A)
 &rst
  ixpk= 227, nxpk= 10, iat=  -1, 372, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,
 igr1=1568,1569,1570,1572,1573,1574,
 &end
#
#   24 THR  HN           25 ALA  HN          5.00    (#    228:10  Unique         3.56, 4.44 A)
 &rst
  ixpk= 228, nxpk= 10, iat= 358, 372, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50,  &end
#
#   36 ASP  HB3          37 ALA  HN          5.00    (#    236:10  Preassigned    4.14, 4.46 A)
 &rst
  ixpk= 236, nxpk= 10, iat= 528, 535, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50,  &end
#
#   45 MET  ME           37 ALA  HN          5.00    (#    237:10  Unique         2.62, 4.55 A)
 &rst
  ixpk= 237, nxpk= 10, iat=  -1, 535, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,
 igr1= 652, 653, 654,
 &end
#
#   15 ARG  HB+          16 ALA  HN          5.00    (#    241:10  Preassigned    2.36, 3.40 A)
 &rst
  ixpk= 241, nxpk= 10, iat=  -1, 241, r1= 1.30, r2= 1.80, r3= 5.61, r4= 6.11,
 igr1= 221, 222,
 &end
#
#   15 ARG  HB-          16 ALA  HN          5.00    (#    242:10  Preassigned    2.36, 3.40 A)
 &rst
  ixpk= 242, nxpk= 10, iat=  -1, 241, r1= 1.30, r2= 1.80, r3= 5.61, r4= 6.11,
 igr1= 221, 222,
 &end
#
#   15 ARG  HG-          16 ALA  HN          3.50    (#    243:10  Preassigned    3.70, 4.14 A)
 &rst
  ixpk= 243, nxpk= 10, iat=  -1, 241, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1= 224, 225,
 &end
#
#   98 ALA  MB           16 ALA  HN          2.70    (#    245:10  Preassigned    2.68, 3.26 A)
 &rst
  ixpk= 245, nxpk= 10, iat=  -1, 241, r1= 1.30, r2= 1.80, r3= 3.24, r4= 3.74,
 igr1=1465,1466,1467,
 &end
#
#   16 ALA  MB           16 ALA  HN          2.70    (#    246:10  Preassigned    2.44, 2.93 A)
 &rst
  ixpk= 246, nxpk= 10, iat=  -1, 241, r1= 1.30, r2= 1.80, r3= 3.24, r4= 3.74,
 igr1= 245, 246, 247,
 &end
#
#   15 ARG  HN           16 ALA  HN          6.00    (#    248:10  Preassigned    4.27, 4.39 A)
 &rst
  ixpk= 248, nxpk= 10, iat= 217, 241, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,  &end
#
#    0 AMB  10-2:256     73 ILE  HN          3.50    (#    256:10  Single Ambig)
 &rst
  ixpk= 256, nxpk= 10, iat=  -1,1075, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
 igr1= 945,1056,1094,
 &end
#
#   73 ILE  HA           73 ILE  HN          3.50    (#    257:10  Unique         2.96, 2.98 A)
 &rst
  ixpk= 257, nxpk= 10, iat=1077,1075, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   72 LEU  HA           73 ILE  HN          2.70    (#    258:10  Unique         2.13, 2.16 A)
 &rst
  ixpk= 258, nxpk= 10, iat=1058,1075, r1= 1.30, r2= 1.80, r3= 2.70, r4= 3.20,  &end
#
#   73 ILE  HB           73 ILE  HN          2.70    (#    259:10  Unique         2.50, 2.64 A)
 &rst
  ixpk= 259, nxpk= 10, iat=1079,1075, r1= 1.30, r2= 1.80, r3= 2.70, r4= 3.20,  &end
#
#   73 ILE  MD1          73 ILE  HN          3.50    (#    260:10  Unique         2.16, 3.27 A)
 &rst
  ixpk= 260, nxpk= 10, iat=  -1,1075, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
 igr1=1088,1089,1090,
 &end
#
#   73 ILE  MG2          73 ILE  HN          5.00    (#    261:10  Unique         4.37, 4.63 A)
 &rst
  ixpk= 261, nxpk= 10, iat=  -1,1075, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,
 igr1=1081,1082,1083,
 &end
#
#   72 LEU  MDY          73 ILE  HN          3.50    (#    262:10  Unique         2.99, 4.89 A)
 &rst
  ixpk= 262, nxpk= 10, iat=  -1,1075, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,
 igr1=1065,1066,1067,1069,1070,1071,
 &end
#
#   65 PHE  HA           73 ILE  HN          5.00    (#    269:10  Unique         3.14, 3.38 A)
 &rst
  ixpk= 269, nxpk= 10, iat= 958,1075, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50,  &end
#
#  101 HIS  HA          102 LEU  HN          2.70    (#    272:10  Unique         2.15, 2.19 A)
 &rst
  ixpk= 272, nxpk= 10, iat=1506,1521, r1= 1.30, r2= 1.80, r3= 2.70, r4= 3.20,  &end
#
#   84 GLU  HA          102 LEU  HN          5.00    (#    273:10  Unique         2.91, 3.22 A)
 &rst
  ixpk= 273, nxpk= 10, iat=1257,1521, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50,  &end
#
#  101 HIS  QB          102 LEU  HN          3.50    (#    274:10  Unique         3.55, 4.08 A)
 &rst
  ixpk= 274, nxpk= 10, iat=  -1,1521, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1=1508,1509,
 &end
#
#  102 LEU  HB+         102 LEU  HN          3.50    (#    275:10  Unique         2.32, 2.70 A)
 &rst
  ixpk= 275, nxpk= 10, iat=  -1,1521, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1=1525,1526,
 &end
#
#    0 AMB  10-2:276    102 LEU  HN          5.00    (#    276:10  Single Ambig)
 &rst
  ixpk= 276, nxpk= 10, iat=  -1,1521, r1= 1.30, r2= 1.80, r3= 6.92, r4= 7.42,
 igr1=1528, 309, 310, 311,1498,1499,1500,
 &end
#
#  102 LEU  HB-         102 LEU  HN          3.50    (#    277:10  Unique         2.32, 2.70 A)
 &rst
  ixpk= 277, nxpk= 10, iat=  -1,1521, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1=1525,1526,
 &end
#
#    0 AMB  10-2:278    102 LEU  HN          3.50    (#    278:10  Single Ambig)
 &rst
  ixpk= 278, nxpk= 10, iat=  -1,1521, r1= 1.30, r2= 1.80, r3= 5.30, r4= 5.80,
 igr1=1530,1531,1532,1534,1535,1536,1530,1531,1532,1534,
      1535,1536,
 &end
#
#  100 ILE  HG1+        100 ILE  HN          5.00    (#    285:10  Unique         2.22, 2.93 A)
 &rst
  ixpk= 285, nxpk= 10, iat=  -1,1485, r1= 1.30, r2= 1.80, r3= 5.61, r4= 6.11,
 igr1=1495,1496,
 &end
#
#   85 TYR  HN          100 ILE  HN          5.00    (#    286:10  Unique         3.24, 3.37 A)
 &rst
  ixpk= 286, nxpk= 10, iat=1270,1485, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50,  &end
#
#   87 CYS  HN          100 ILE  HN          6.00    (#    287:10  Unique         4.09, 4.39 A)
 &rst
  ixpk= 287, nxpk= 10, iat=1310,1485, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,  &end
#
#   99 THR  HN          100 ILE  HN          6.00    (#    288:10  Unique         4.27, 4.32 A)
 &rst
  ixpk= 288, nxpk= 10, iat=1471,1485, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,  &end
#
#   86 ILE  HA          100 ILE  HN          5.00    (#    289:10  Preassigned    3.63, 3.66 A)
 &rst
  ixpk= 289, nxpk= 10, iat=1293,1485, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50,  &end
#
#   99 THR  HA          100 ILE  HN          2.70    (#    290:10  Unique         2.16, 2.21 A)
 &rst
  ixpk= 290, nxpk= 10, iat=1473,1485, r1= 1.30, r2= 1.80, r3= 2.70, r4= 3.20,  &end
#
#  100 ILE  HA          100 ILE  HN          5.00    (#    292:10  Unique         2.98, 3.00 A)
 &rst
  ixpk= 292, nxpk= 10, iat=1487,1485, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50,  &end
#
#  100 ILE  HB          100 ILE  HN          3.50    (#    293:10  Unique         2.56, 2.93 A)
 &rst
  ixpk= 293, nxpk= 10, iat=1489,1485, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#  100 ILE  HG1-        100 ILE  HN          5.00    (#    294:10  Unique         2.22, 2.93 A)
 &rst
  ixpk= 294, nxpk= 10, iat=  -1,1485, r1= 1.30, r2= 1.80, r3= 5.61, r4= 6.11,
 igr1=1495,1496,
 &end
#
#    0 AMB  10-2:295    100 ILE  HN          5.00    (#    295:10  Single Ambig)
 &rst
  ixpk= 295, nxpk= 10, iat=  -1,1485, r1= 1.30, r2= 1.80, r3= 6.74, r4= 7.24,
 igr1= 245, 246, 247,1498,1499,1500,
 &end
#
#    0 AMB  10-2:296    100 ILE  HN          5.00    (#    296:10  Single Ambig)
 &rst
  ixpk= 296, nxpk= 10, iat=  -1,1485, r1= 1.30, r2= 1.80, r3= 6.54, r4= 7.04,
 igr1=1301,1302,1249,1250,1251,
 &end
#
#    0 AMB  10-2:297    100 ILE  HN          3.50    (#    297:10  Single Ambig)
 &rst
  ixpk= 297, nxpk= 10, iat=  -1,1485, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,
 igr1=1477,1478,1479,1491,1492,1493,
 &end
#
#  105 PHE  QD          105 PHE  HN          5.00    (#    298:10  Preassigned    2.39, 3.41 A)
 &rst
  ixpk= 298, nxpk= 10, iat=  -1,1578, r1= 1.30, r2= 1.80, r3= 5.61, r4= 6.11,
 igr1=1586,1594,
 &end
#
#  104 VAL  HN          105 PHE  HN          5.00    (#    299:10  Unique         4.26, 4.57 A)
 &rst
  ixpk= 299, nxpk= 10, iat=1562,1578, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50,  &end
#
#   25 ALA  HN          105 PHE  HN          3.50    (#    301:10  Preassigned    2.88, 3.47 A)
 &rst
  ixpk= 301, nxpk= 10, iat= 372,1578, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   24 THR  HA          105 PHE  HN          3.50    (#    302:10  Preassigned    2.95, 3.26 A)
 &rst
  ixpk= 302, nxpk= 10, iat= 360,1578, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#  105 PHE  HB2         105 PHE  HN          3.50    (#    304:10  Preassigned    3.58, 3.62 A)
 &rst
  ixpk= 304, nxpk= 10, iat=1582,1578, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#  105 PHE  HB3         105 PHE  HN          3.50    (#    305:10  Preassigned    2.78, 2.91 A)
 &rst
  ixpk= 305, nxpk= 10, iat=1583,1578, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#    0 AMB  10-2:307    105 PHE  HN          6.00    (#    307:10  Single Ambig)
 &rst
  ixpk= 307, nxpk= 10, iat=  -1,1578, r1= 1.30, r2= 1.80, r3= 8.09, r4= 8.59,
 igr1= 352, 353, 354, 364, 365, 366,
 &end
#
#  104 VAL  MGY         105 PHE  HN          3.50    (#    308:10  Unique         2.67, 4.39 A)
 &rst
  ixpk= 308, nxpk= 10, iat=  -1,1578, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,
 igr1=1568,1569,1570,1572,1573,1574,
 &end
#
#  104 VAL  MGX         105 PHE  HN          3.50    (#    309:10  Unique         2.67, 4.39 A)
 &rst
  ixpk= 309, nxpk= 10, iat=  -1,1578, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,
 igr1=1568,1569,1570,1572,1573,1574,
 &end
#
#   59 ASN  HN           55 GLU  HN          5.00    (#    310:10  Preassigned    4.00, 4.30 A)
 &rst
  ixpk= 310, nxpk= 10, iat= 858, 799, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50,  &end
#
#   55 GLU  HA           55 GLU  HN          3.50    (#    311:10  Unique         2.81, 2.86 A)
 &rst
  ixpk= 311, nxpk= 10, iat= 801, 799, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   46 THR  HB           55 GLU  HN          5.00    (#    312:10  Unique         4.84, 5.04 A)
 &rst
  ixpk= 312, nxpk= 10, iat= 662, 799, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50,  &end
#
#   54 ILE  HA           55 GLU  HN          2.70    (#    313:10  Unique         2.56, 2.64 A)
 &rst
  ixpk= 313, nxpk= 10, iat= 782, 799, r1= 1.30, r2= 1.80, r3= 2.70, r4= 3.20,  &end
#
#   55 GLU  QG           55 GLU  HN          3.50    (#    314:10  Unique         1.91, 2.45 A)
 &rst
  ixpk= 314, nxpk= 10, iat=  -1, 799, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1= 806, 807,
 &end
#
#    0 AMB  10-2:315     55 GLU  HN          3.50    (#    315:10  Single Ambig)
 &rst
  ixpk= 315, nxpk= 10, iat=  -1, 799, r1= 1.30, r2= 1.80, r3= 4.58, r4= 5.08,
 igr1= 803, 821, 822, 835, 836,
 &end
#
#    0 AMB  10-2:316     55 GLU  HN          2.70    (#    316:10  Single Ambig)
 &rst
  ixpk= 316, nxpk= 10, iat=  -1, 799, r1= 1.30, r2= 1.80, r3= 3.24, r4= 3.74,
 igr1= 804, 770, 771,
 &end
#
#    0 AMB  10-2:317     55 GLU  HN          5.00    (#    317:10  Single Ambig)
 &rst
  ixpk= 317, nxpk= 10, iat=  -1, 799, r1= 1.30, r2= 1.80, r3= 6.54, r4= 7.04,
 igr1= 790, 791, 702, 703, 704,
 &end
#
#   54 ILE  MG2          55 GLU  HN          5.00    (#    318:10  Unique         4.58, 5.17 A)
 &rst
  ixpk= 318, nxpk= 10, iat=  -1, 799, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,
 igr1= 786, 787, 788,
 &end
#
#   72 LEU  HA           72 LEU  HN          5.00    (#    328:10  Unique         2.95, 2.96 A)
 &rst
  ixpk= 328, nxpk= 10, iat=1058,1056, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50,  &end
#
#   71 GLU  HN           72 LEU  HN          5.00    (#    329:10  Unique         4.47, 4.58 A)
 &rst
  ixpk= 329, nxpk= 10, iat=1041,1056, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50,  &end
#
#   54 ILE  HB           55 GLU  HN          5.00    (#    331:10  Unique         4.20, 4.38 A)
 &rst
  ixpk= 331, nxpk= 10, iat= 784, 799, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50,  &end
#
#   32 THR  HA           74 ILE  HN          3.50    (#    338:10  Preassigned    3.00, 3.46 A)
 &rst
  ixpk= 338, nxpk= 10, iat= 472,1094, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#    0 AMB  10-2:340     74 ILE  HN          3.50    (#    340:10  Single Ambig)
 &rst
  ixpk= 340, nxpk= 10, iat=  -1,1094, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1=1098, 491,
 &end
#
#   74 ILE  HG1+         74 ILE  HN          3.50    (#    342:10  Unique         2.45, 3.25 A)
 &rst
  ixpk= 342, nxpk= 10, iat=  -1,1094, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1=1104,1105,
 &end
#
#    0 AMB  10-2:343     74 ILE  HN          5.00    (#    343:10  Single Ambig)
 &rst
  ixpk= 343, nxpk= 10, iat=  -1,1094, r1= 1.30, r2= 1.80, r3= 7.21, r4= 7.71,
 igr1=1167,1168,1169, 460, 461, 462, 464, 465, 466,
 &end
#
#   74 ILE  HG1-         74 ILE  HN          3.50    (#    344:10  Unique         2.45, 3.25 A)
 &rst
  ixpk= 344, nxpk= 10, iat=  -1,1094, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1=1104,1105,
 &end
#
#   73 ILE  MG2          74 ILE  HN          5.00    (#    345:10  Preassigned    3.12, 3.81 A)
 &rst
  ixpk= 345, nxpk= 10, iat=  -1,1094, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,
 igr1=1081,1082,1083,
 &end
#
#   33 LEU  HN           74 ILE  HN          5.00    (#    346:10  Unique         4.20, 4.47 A)
 &rst
  ixpk= 346, nxpk= 10, iat= 484,1094, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50,  &end
#
#   34 ALA  HA           72 LEU  HN          5.00    (#    347:10  Unique         2.84, 3.02 A)
 &rst
  ixpk= 347, nxpk= 10, iat= 505,1056, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50,  &end
#
#   71 GLU  HA           72 LEU  HN          3.50    (#    348:10  Unique         2.07, 2.18 A)
 &rst
  ixpk= 348, nxpk= 10, iat=1043,1056, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   71 GLU  QB           72 LEU  HN          5.00    (#    349:10  Unique         2.89, 3.61 A)
 &rst
  ixpk= 349, nxpk= 10, iat=  -1,1056, r1= 1.30, r2= 1.80, r3= 5.61, r4= 6.11,
 igr1=1045,1046,
 &end
#
#    0 AMB  10-2:350     72 LEU  HN          5.00    (#    350:10  Single Ambig)
 &rst
  ixpk= 350, nxpk= 10, iat=  -1,1056, r1= 1.30, r2= 1.80, r3= 6.74, r4= 7.24,
 igr1= 507, 508, 509,1498,1499,1500,
 &end
#
#   32 THR  MG2          72 LEU  HN          5.00    (#    351:10  Unique         3.55, 4.46 A)
 &rst
  ixpk= 351, nxpk= 10, iat=  -1,1056, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,
 igr1= 476, 477, 478,
 &end
#
#    0 AMB  10-2:352     72 LEU  HN          3.50    (#    352:10  Single Ambig)
 &rst
  ixpk= 352, nxpk= 10, iat=  -1,1056, r1= 1.30, r2= 1.80, r3= 4.95, r4= 5.45,
 igr1=1060,1061, 493, 494, 495, 497, 498, 499,
 &end
#
#   72 LEU  HB-          72 LEU  HN          3.50    (#    353:10  Unique         2.49, 2.85 A)
 &rst
  ixpk= 353, nxpk= 10, iat=  -1,1056, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1=1060,1061,
 &end
#
#  107 LYS  HN          106 ALA  HN          5.00    (#    358:10  Unique         3.49, 3.53 A)
 &rst
  ixpk= 358, nxpk= 10, iat=1608,1598, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50,  &end
#
#  105 PHE  HA          106 ALA  HN          3.50    (#    360:10  Unique         2.15, 2.19 A)
 &rst
  ixpk= 360, nxpk= 10, iat=1580,1598, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#  106 ALA  HA          106 ALA  HN          5.00    (#    361:10  Unique         2.85, 2.89 A)
 &rst
  ixpk= 361, nxpk= 10, iat=1600,1598, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50,  &end
#
#    0 AMB  10-2:362    106 ALA  HN          3.50    (#    362:10  Single Ambig)
 &rst
  ixpk= 362, nxpk= 10, iat=  -1,1598, r1= 1.30, r2= 1.80, r3= 4.58, r4= 5.08,
 igr1=1602,1603,1604,1615,1616,
 &end
#
#    0 AMB  10-2:365     74 ILE  HN          5.00    (#    365:10  Single Ambig)
 &rst
  ixpk= 365, nxpk= 10, iat=  -1,1094, r1= 1.30, r2= 1.80, r3= 7.21, r4= 7.71,
 igr1=1107,1108,1109, 493, 494, 495, 497, 498, 499,
 &end
#
#    8 VAL  HN            7 ILE  HN          5.00    (#    366:10  Unique         3.60, 4.26 A)
 &rst
  ixpk= 366, nxpk= 10, iat= 116,  97, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50,  &end
#
#    0 AMB  10-2:368      7 ILE  HN          2.70    (#    368:10  Single Ambig)
 &rst
  ixpk= 368, nxpk= 10, iat=  -1,  97, r1= 1.30, r2= 1.80, r3= 3.03, r4= 3.53,
 igr1=  83,  99,
 &end
#
#    6 VAL  HB            7 ILE  HN          5.00    (#    369:10  Unique         1.92, 3.87 A)
 &rst
  ixpk= 369, nxpk= 10, iat=  85,  97, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50,  &end
#
#    7 ILE  HB            7 ILE  HN          2.70    (#    370:10  Unique         2.42, 2.60 A)
 &rst
  ixpk= 370, nxpk= 10, iat= 101,  97, r1= 1.30, r2= 1.80, r3= 2.70, r4= 3.20,  &end
#
#    7 ILE  HG1+          7 ILE  HN          3.50    (#    371:10  Unique         1.97, 3.17 A)
 &rst
  ixpk= 371, nxpk= 10, iat=  -1,  97, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1= 107, 108,
 &end
#
#    7 ILE  HG1-          7 ILE  HN          3.50    (#    372:10  Unique         1.97, 3.17 A)
 &rst
  ixpk= 372, nxpk= 10, iat=  -1,  97, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1= 107, 108,
 &end
#
#    0 AMB  10-2:373      7 ILE  HN          3.50    (#    373:10  Single Ambig)
 &rst
  ixpk= 373, nxpk= 10, iat=  -1,  97, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1=  87,  88,  89,  51,  52,  53, 126, 127, 128,
 &end
#
#    7 ILE  MG2           7 ILE  HN          5.00    (#    374:10  Unique         4.38, 4.61 A)
 &rst
  ixpk= 374, nxpk= 10, iat=  -1,  97, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,
 igr1= 103, 104, 105,
 &end
#
#   34 ALA  HN           17 ARG  HN          5.00    (#    407:10  Preassigned    3.72, 4.67 A)
 &rst
  ixpk= 407, nxpk= 10, iat= 503, 251, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50,  &end
#
#   17 ARG  HB+          17 ARG  HN          3.50    (#    409:10  Unique         2.05, 2.87 A)
 &rst
  ixpk= 409, nxpk= 10, iat=  -1, 251, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1= 255, 256,
 &end
#
#   98 ALA  MB           17 ARG  HN          5.00    (#    410:10  Preassigned    5.60, 6.71 A)
 &rst
  ixpk= 410, nxpk= 10, iat=  -1, 251, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,
 igr1=1465,1466,1467,
 &end
#
#   35 CYS  HA           17 ARG  HN          3.50    (#    411:10  Unique         2.07, 2.39 A)
 &rst
  ixpk= 411, nxpk= 10, iat= 515, 251, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   17 ARG  HA           17 ARG  HN          3.50    (#    412:10  Unique         2.54, 2.77 A)
 &rst
  ixpk= 412, nxpk= 10, iat= 253, 251, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   17 ARG  HB-          17 ARG  HN          3.50    (#    413:10  Unique         2.05, 2.87 A)
 &rst
  ixpk= 413, nxpk= 10, iat=  -1, 251, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1= 255, 256,
 &end
#
#  100 ILE  HG1+         17 ARG  HN          5.00    (#    414:10  Unique         3.63, 5.10 A)
 &rst
  ixpk= 414, nxpk= 10, iat=  -1, 251, r1= 1.30, r2= 1.80, r3= 5.61, r4= 6.11,
 igr1=1495,1496,
 &end
#
#   17 ARG  QG           17 ARG  HN          5.00    (#    415:10  Unique         2.09, 3.44 A)
 &rst
  ixpk= 415, nxpk= 10, iat=  -1, 251, r1= 1.30, r2= 1.80, r3= 5.61, r4= 6.11,
 igr1= 258, 259,
 &end
#
#   20 THR  HA          101 HIS  HN          3.50    (#    417:10  Preassigned    2.34, 2.60 A)
 &rst
  ixpk= 417, nxpk= 10, iat= 305,1504, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   19 SER  HA          101 HIS  HN          5.00    (#    420:10  Unique         3.61, 3.86 A)
 &rst
  ixpk= 420, nxpk= 10, iat= 294,1504, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50,  &end
#
#  101 HIS  QB          101 HIS  HN          2.70    (#    421:10  Unique         2.43, 3.09 A)
 &rst
  ixpk= 421, nxpk= 10, iat=  -1,1504, r1= 1.30, r2= 1.80, r3= 3.03, r4= 3.53,
 igr1=1508,1509,
 &end
#
#  100 ILE  HG1-        101 HIS  HN          5.00    (#    422:10  Unique         4.47, 5.17 A)
 &rst
  ixpk= 422, nxpk= 10, iat=  -1,1504, r1= 1.30, r2= 1.80, r3= 5.61, r4= 6.11,
 igr1=1495,1496,
 &end
#
#  100 ILE  MG2         101 HIS  HN          3.50    (#    423:10  Unique         2.25, 3.45 A)
 &rst
  ixpk= 423, nxpk= 10, iat=  -1,1504, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
 igr1=1491,1492,1493,
 &end
#
#  100 ILE  HA          101 HIS  HN          2.70    (#    430:10  Unique         2.20, 2.26 A)
 &rst
  ixpk= 430, nxpk= 10, iat=1487,1504, r1= 1.30, r2= 1.80, r3= 2.70, r4= 3.20,  &end
#
#    0 AMB  10-2:431    101 HIS  HN          5.00    (#    431:10  Single Ambig)
 &rst
  ixpk= 431, nxpk= 10, iat=  -1,1504, r1= 1.30, r2= 1.80, r3= 7.46, r4= 7.96,
 igr1= 309, 310, 311, 245, 246, 247,1547,1548,1498,1499,
      1500,
 &end
#
#    0 AMB  10-2:432     75 LYS  HN          5.00    (#    432:10  Single Ambig)
 &rst
  ixpk= 432, nxpk= 10, iat=  -1,1113, r1= 1.30, r2= 1.80, r3= 6.74, r4= 7.24,
 igr1= 906, 907,1142,1143,1142,1143,
 &end
#
#    0 AMB  10-2:433     75 LYS  HN          3.50    (#    433:10  Single Ambig)
 &rst
  ixpk= 433, nxpk= 10, iat=  -1,1113, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
 igr1=1123,1124,1098,
 &end
#
#    0 AMB  10-2:434     75 LYS  HN          5.00    (#    434:10  Single Ambig)
 &rst
  ixpk= 434, nxpk= 10, iat=  -1,1113, r1= 1.30, r2= 1.80, r3= 6.30, r4= 6.80,
 igr1= 906, 907,1104,1105,
 &end
#
#    9 ASN  HN            8 VAL  HN          5.00    (#    440:10  Preassigned    1.82, 2.13 A)
 &rst
  ixpk= 440, nxpk= 10, iat= 132, 116, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50,  &end
#
#    7 ILE  HN            8 VAL  HN          5.00    (#    441:10  Preassigned    3.60, 4.26 A)
 &rst
  ixpk= 441, nxpk= 10, iat=  97, 116, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50,  &end
#
#    7 ILE  HA            8 VAL  HN          2.70    (#    444:10  Preassigned    2.13, 2.19 A)
 &rst
  ixpk= 444, nxpk= 10, iat=  99, 116, r1= 1.30, r2= 1.80, r3= 2.70, r4= 3.20,  &end
#
#    0 AMB  10-2:446      8 VAL  HN          6.00    (#    446:10  Single Ambig)
 &rst
  ixpk= 446, nxpk= 10, iat=  -1, 116, r1= 1.30, r2= 1.80, r3= 7.56, r4= 8.06,
 igr1= 107, 108,  55,  56,
 &end
#
#    0 AMB  10-2:447      8 VAL  HN          5.00    (#    447:10  Single Ambig)
 &rst
  ixpk= 447, nxpk= 10, iat=  -1, 116, r1= 1.30, r2= 1.80, r3= 6.54, r4= 7.04,
 igr1= 107, 108, 152, 153, 154,
 &end
#
#   10 VAL  MG2           8 VAL  HN          6.00    (#    448:10  Unique         3.99, 5.29 A)
 &rst
  ixpk= 448, nxpk= 10, iat=  -1, 116, r1= 1.30, r2= 1.80, r3= 7.21, r4= 7.71,
 igr1= 156, 157, 158,
 &end
#
#    8 VAL  MG2           8 VAL  HN          5.00    (#    449:10  Preassigned    2.44, 3.78 A)
 &rst
  ixpk= 449, nxpk= 10, iat=  -1, 116, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,
 igr1= 126, 127, 128,
 &end
#
#    7 ILE  MG2           8 VAL  HN          3.50    (#    450:10  Unique         2.78, 3.95 A)
 &rst
  ixpk= 450, nxpk= 10, iat=  -1, 116, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
 igr1= 103, 104, 105,
 &end
#
#   75 LYS  HG+          75 LYS  HN          3.50    (#    456:10  Unique         2.13, 2.92 A)
 &rst
  ixpk= 456, nxpk= 10, iat=  -1,1113, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1=1120,1121,
 &end
#
#   63 TYR  HA           75 LYS  HN          5.00    (#    458:10  Unique         2.63, 2.92 A)
 &rst
  ixpk= 458, nxpk= 10, iat= 926,1113, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50,  &end
#
#    0 AMB  10-2:459     75 LYS  HN          2.70    (#    459:10  Single Ambig)
 &rst
  ixpk= 459, nxpk= 10, iat=  -1,1113, r1= 1.30, r2= 1.80, r3= 3.03, r4= 3.53,
 igr1=1096,1115,
 &end
#
#    0 AMB  10-2:460     75 LYS  HN          3.50    (#    460:10  Single Ambig)
 &rst
  ixpk= 460, nxpk= 10, iat=  -1,1113, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,
 igr1=1117,1118,1139,1140,
 &end
#
#   74 ILE  MG2          75 LYS  HN          3.50    (#    461:10  Unique         2.13, 3.09 A)
 &rst
  ixpk= 461, nxpk= 10, iat=  -1,1113, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
 igr1=1100,1101,1102,
 &end
#
#    8 VAL  MG1          10 VAL  HN          6.00    (#    467:10  Unique         3.46, 5.88 A)
 &rst
  ixpk= 467, nxpk= 10, iat=  -1, 146, r1= 1.30, r2= 1.80, r3= 7.21, r4= 7.71,
 igr1= 122, 123, 124,
 &end
#
#    0 AMB  10-2:473      5 GLN  HN          5.00    (#    473:10  Single Ambig)
 &rst
  ixpk= 473, nxpk= 10, iat=  -1,  64, r1= 1.30, r2= 1.80, r3= 5.61, r4= 6.11,
 igr1=  81,  45,
 &end
#
#    4 ILE  HA            5 GLN  HN          3.50    (#    475:10  Unique         2.43, 3.25 A)
 &rst
  ixpk= 475, nxpk= 10, iat=  47,  64, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#    0 AMB  10-2:476      5 GLN  HN          3.50    (#    476:10  Single Ambig)
 &rst
  ixpk= 476, nxpk= 10, iat=  -1,  64, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
 igr1=  68,  69,  85,
 &end
#
#   40 PHE  HN           10 VAL  HN          3.50    (#    480:10  Preassigned    2.62, 3.04 A)
 &rst
  ixpk= 480, nxpk= 10, iat= 564, 146, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#    9 ASN  HA           10 VAL  HN          2.70    (#    481:10  Unique         2.14, 2.28 A)
 &rst
  ixpk= 481, nxpk= 10, iat= 134, 146, r1= 1.30, r2= 1.80, r3= 2.70, r4= 3.20,  &end
#
#   10 VAL  HB           10 VAL  HN          3.50    (#    482:10  Unique         2.35, 2.48 A)
 &rst
  ixpk= 482, nxpk= 10, iat= 150, 146, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   10 VAL  HA           10 VAL  HN          5.00    (#    483:10  Unique         2.88, 2.95 A)
 &rst
  ixpk= 483, nxpk= 10, iat= 148, 146, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50,  &end
#
#   40 PHE  QB           10 VAL  HN          3.50    (#    484:10  Unique         2.49, 3.57 A)
 &rst
  ixpk= 484, nxpk= 10, iat=  -1, 146, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1= 568, 569,
 &end
#
#    9 ASN  QB           10 VAL  HN          5.00    (#    486:10  Unique         2.64, 4.15 A)
 &rst
  ixpk= 486, nxpk= 10, iat=  -1, 146, r1= 1.30, r2= 1.80, r3= 5.61, r4= 6.11,
 igr1= 136, 137,
 &end
#
#   10 VAL  MG1          10 VAL  HN          5.00    (#    487:10  Unique         4.35, 4.58 A)
 &rst
  ixpk= 487, nxpk= 10, iat=  -1, 146, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,
 igr1= 152, 153, 154,
 &end
#
#   10 VAL  MG2          10 VAL  HN          3.50    (#    488:10  Unique         2.12, 3.34 A)
 &rst
  ixpk= 488, nxpk= 10, iat=  -1, 146, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
 igr1= 156, 157, 158,
 &end
#
#    5 GLN  HA            5 GLN  HN          5.00    (#    489:10  Unique         2.83, 2.91 A)
 &rst
  ixpk= 489, nxpk= 10, iat=  66,  64, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50,  &end
#
#    5 GLN  HB+           5 GLN  HN          5.00    (#    490:10  Unique         2.44, 3.09 A)
 &rst
  ixpk= 490, nxpk= 10, iat=  -1,  64, r1= 1.30, r2= 1.80, r3= 5.61, r4= 6.11,
 igr1=  68,  69,
 &end
#
#   98 ALA  MB           15 ARG  HN          5.00    (#    497:10  Unique         4.23, 5.17 A)
 &rst
  ixpk= 497, nxpk= 10, iat=  -1, 217, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,
 igr1=1465,1466,1467,
 &end
#
#  106 ALA  HN          107 LYS  HN          3.50    (#    499:10  Unique         3.49, 3.53 A)
 &rst
  ixpk= 499, nxpk= 10, iat=1598,1608, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#  106 ALA  HA          107 LYS  HN          2.70    (#    502:10  Unique         2.56, 2.65 A)
 &rst
  ixpk= 502, nxpk= 10, iat=1600,1608, r1= 1.30, r2= 1.80, r3= 2.70, r4= 3.20,  &end
#
#    0 AMB  10-2:503    107 LYS  HN          3.50    (#    503:10  Single Ambig)
 &rst
  ixpk= 503, nxpk= 10, iat=  -1,1608, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,
 igr1=1612,1613,1612,1613,
 &end
#
#    0 AMB  10-2:504    107 LYS  HN          2.70    (#    504:10  Single Ambig)
 &rst
  ixpk= 504, nxpk= 10, iat=  -1,1608, r1= 1.30, r2= 1.80, r3= 3.53, r4= 4.03,
 igr1=1615,1616, 376, 377, 378,
 &end
#
#   24 THR  MG2         107 LYS  HN          3.50    (#    505:10  Unique         2.96, 4.03 A)
 &rst
  ixpk= 505, nxpk= 10, iat=  -1,1608, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
 igr1= 364, 365, 366,
 &end
#
#   16 ALA  HN           15 ARG  HN          5.00    (#    513:10  Unique         4.27, 4.39 A)
 &rst
  ixpk= 513, nxpk= 10, iat= 241, 217, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50,  &end
#
#   14 VAL  HN           15 ARG  HN          5.00    (#    514:10  Unique         3.95, 4.37 A)
 &rst
  ixpk= 514, nxpk= 10, iat= 201, 217, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50,  &end
#
#   36 ASP  HN           15 ARG  HN          3.50    (#    515:10  Preassigned    2.55, 3.31 A)
 &rst
  ixpk= 515, nxpk= 10, iat= 523, 217, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   37 ALA  HA           15 ARG  HN          3.50    (#    516:10  Preassigned    3.61, 3.98 A)
 &rst
  ixpk= 516, nxpk= 10, iat= 537, 217, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   14 VAL  HA           15 ARG  HN          2.70    (#    518:10  Unique         2.12, 2.19 A)
 &rst
  ixpk= 518, nxpk= 10, iat= 203, 217, r1= 1.30, r2= 1.80, r3= 2.70, r4= 3.20,  &end
#
#   36 ASP  HA           15 ARG  HN          5.00    (#    519:10  Preassigned    4.77, 4.90 A)
 &rst
  ixpk= 519, nxpk= 10, iat= 525, 217, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50,  &end
#
#   15 ARG  HA           15 ARG  HN          3.50    (#    520:10  Unique         2.90, 2.96 A)
 &rst
  ixpk= 520, nxpk= 10, iat= 219, 217, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   15 ARG  HB+          15 ARG  HN          3.50    (#    522:10  Unique         2.40, 3.20 A)
 &rst
  ixpk= 522, nxpk= 10, iat=  -1, 217, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1= 221, 222,
 &end
#
#    0 AMB  10-2:523     15 ARG  HN          3.50    (#    523:10  Single Ambig)
 &rst
  ixpk= 523, nxpk= 10, iat=  -1, 217, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,
 igr1= 224, 225, 221, 222,
 &end
#
#   15 ARG  HG-          15 ARG  HN          3.50    (#    524:10  Unique         2.10, 3.79 A)
 &rst
  ixpk= 524, nxpk= 10, iat=  -1, 217, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1= 224, 225,
 &end
#
#   37 ALA  MB           15 ARG  HN          6.00    (#    525:10  Preassigned    4.62, 5.96 A)
 &rst
  ixpk= 525, nxpk= 10, iat=  -1, 217, r1= 1.30, r2= 1.80, r3= 7.21, r4= 7.71,
 igr1= 539, 540, 541,
 &end
#
#   14 VAL  MGX          15 ARG  HN          3.50    (#    526:10  Unique         2.70, 4.61 A)
 &rst
  ixpk= 526, nxpk= 10, iat=  -1, 217, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,
 igr1= 207, 208, 209, 211, 212, 213,
 &end
#
#   14 VAL  MGY          15 ARG  HN          3.50    (#    527:10  Unique         2.70, 4.61 A)
 &rst
  ixpk= 527, nxpk= 10, iat=  -1, 217, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,
 igr1= 207, 208, 209, 211, 212, 213,
 &end
#
#    0 AMB  10-2:529    107 LYS  HN          5.00    (#    529:10  Single Ambig)
 &rst
  ixpk= 529, nxpk= 10, iat=  -1,1608, r1= 1.30, r2= 1.80, r3= 5.61, r4= 6.11,
 igr1=1580,1564,
 &end
#
#  107 LYS  HA          107 LYS  HN          3.50    (#    530:10  Unique         2.24, 2.32 A)
 &rst
  ixpk= 530, nxpk= 10, iat=1610,1608, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#  105 PHE  HB2         107 LYS  HN          3.50    (#    531:10  Preassigned    3.51, 3.79 A)
 &rst
  ixpk= 531, nxpk= 10, iat=1582,1608, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#  105 PHE  HB3         107 LYS  HN          5.00    (#    532:10  Preassigned    4.99, 5.07 A)
 &rst
  ixpk= 532, nxpk= 10, iat=1583,1608, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50,  &end
#
#   46 THR  HN           88 ILE  HN          3.50    (#    538:10  Unique         2.98, 3.08 A)
 &rst
  ixpk= 538, nxpk= 10, iat= 658,1320, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   87 CYS  HA           88 ILE  HN          3.50    (#    539:10  Unique         2.01, 2.10 A)
 &rst
  ixpk= 539, nxpk= 10, iat=1312,1320, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   45 MET  ME           88 ILE  HN          5.00    (#    541:10  Unique         3.11, 4.53 A)
 &rst
  ixpk= 541, nxpk= 10, iat=  -1,1320, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,
 igr1= 652, 653, 654,
 &end
#
#    0 AMB  10-2:542     88 ILE  HN          3.50    (#    542:10  Single Ambig)
 &rst
  ixpk= 542, nxpk= 10, iat=  -1,1320, r1= 1.30, r2= 1.80, r3= 5.30, r4= 5.80,
 igr1=1333,1334,1335, 207, 208, 209, 211, 212, 213,1326,
      1327,1328,
 &end
#
#   87 CYS  HB3          88 ILE  HN          5.00    (#    543:10  Unique         3.87, 4.10 A)
 &rst
  ixpk= 543, nxpk= 10, iat=1315,1320, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50,  &end
#
#   80 SER  HN           82 GLU  HN          6.00    (#    547:10  Preassigned    4.21, 4.29 A)
 &rst
  ixpk= 547, nxpk= 10, iat=1207,1230, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,  &end
#
#   81 ASP  HN           82 GLU  HN          3.50    (#    548:10  Unique         2.44, 2.56 A)
 &rst
  ixpk= 548, nxpk= 10, iat=1218,1230, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   81 ASP  HA           82 GLU  HN          5.00    (#    549:10  Unique         3.39, 3.44 A)
 &rst
  ixpk= 549, nxpk= 10, iat=1220,1230, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50,  &end
#
#   82 GLU  HA           82 GLU  HN          5.00    (#    550:10  Preassigned    2.80, 2.83 A)
 &rst
  ixpk= 550, nxpk= 10, iat=1232,1230, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50,  &end
#
#    0 AMB  10-2:551     82 GLU  HN          6.00    (#    551:10  Single Ambig)
 &rst
  ixpk= 551, nxpk= 10, iat=  -1,1230, r1= 1.30, r2= 1.80, r3= 7.56, r4= 8.06,
 igr1=1237,1238,1177,1178,
 &end
#
#   82 GLU  HB+          82 GLU  HN          3.50    (#    552:10  Unique         2.29, 2.49 A)
 &rst
  ixpk= 552, nxpk= 10, iat=  -1,1230, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1=1234,1235,
 &end
#
#   82 GLU  HG-          82 GLU  HN          5.00    (#    553:10  Unique         4.31, 4.45 A)
 &rst
  ixpk= 553, nxpk= 10, iat=  -1,1230, r1= 1.30, r2= 1.80, r3= 5.61, r4= 6.11,
 igr1=1237,1238,
 &end
#
#   82 GLU  HB-          82 GLU  HN          3.50    (#    554:10  Unique         2.29, 2.49 A)
 &rst
  ixpk= 554, nxpk= 10, iat=  -1,1230, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1=1234,1235,
 &end
#
#    0 AMB  10-2:558     82 GLU  HN          5.00    (#    558:10  Single Ambig)
 &rst
  ixpk= 558, nxpk= 10, iat=  -1,1230, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,
 igr1=1566,1195,1196,
 &end
#
#  104 VAL  MGY          82 GLU  HN          3.50    (#    559:10  Unique         2.55, 4.62 A)
 &rst
  ixpk= 559, nxpk= 10, iat=  -1,1230, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,
 igr1=1568,1569,1570,1572,1573,1574,
 &end
#
#   47 TRP  HA           88 ILE  HN          5.00    (#    562:10  Unique         2.95, 3.11 A)
 &rst
  ixpk= 562, nxpk= 10, iat= 674,1320, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50,  &end
#
#   88 ILE  HA           88 ILE  HN          3.50    (#    564:10  Unique         2.95, 2.98 A)
 &rst
  ixpk= 564, nxpk= 10, iat=1322,1320, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#    0 AMB  10-2:565     88 ILE  HN          3.50    (#    565:10  Single Ambig)
 &rst
  ixpk= 565, nxpk= 10, iat=  -1,1320, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
 igr1=1314,1453,1454,
 &end
#
#    0 AMB  10-2:566     88 ILE  HN          3.50    (#    566:10  Single Ambig)
 &rst
  ixpk= 566, nxpk= 10, iat=  -1,1320, r1= 1.30, r2= 1.80, r3= 4.58, r4= 5.08,
 igr1=1330,1331, 664, 665, 666,
 &end
#
#    0 AMB  10-2:567     88 ILE  HN          3.50    (#    567:10  Single Ambig)
 &rst
  ixpk= 567, nxpk= 10, iat=  -1,1320, r1= 1.30, r2= 1.80, r3= 4.95, r4= 5.45,
 igr1=1330,1331, 207, 208, 209, 211, 212, 213,
 &end
#
#   22 ASN  HN           21 MET  HN          5.00    (#    569:10  Unique         4.28, 4.36 A)
 &rst
  ixpk= 569, nxpk= 10, iat= 334, 317, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50,  &end
#
#   20 THR  HN           21 MET  HN          5.00    (#    570:10  Unique         3.66, 4.13 A)
 &rst
  ixpk= 570, nxpk= 10, iat= 303, 317, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50,  &end
#
#   20 THR  HA           21 MET  HN          2.70    (#    572:10  Unique         2.09, 2.19 A)
 &rst
  ixpk= 572, nxpk= 10, iat= 305, 317, r1= 1.30, r2= 1.80, r3= 2.70, r4= 3.20,  &end
#
#  102 LEU  HA           21 MET  HN          3.50    (#    573:10  Unique         2.76, 2.94 A)
 &rst
  ixpk= 573, nxpk= 10, iat=1523, 317, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   21 MET  HA           21 MET  HN          3.50    (#    574:10  Unique         2.91, 2.95 A)
 &rst
  ixpk= 574, nxpk= 10, iat= 319, 317, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#    0 AMB  10-2:575     21 MET  HN          5.00    (#    575:10  Single Ambig)
 &rst
  ixpk= 575, nxpk= 10, iat=  -1, 317, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,
 igr1= 307, 296, 297,
 &end
#
#   21 MET  QG           21 MET  HN          3.50    (#    576:10  Unique         3.14, 4.01 A)
 &rst
  ixpk= 576, nxpk= 10, iat=  -1, 317, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1= 324, 325,
 &end
#
#   21 MET  HB3          21 MET  HN          5.00    (#    577:10  Unique         3.58, 3.72 A)
 &rst
  ixpk= 577, nxpk= 10, iat= 322, 317, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50,  &end
#
#   21 MET  HB2          21 MET  HN          3.50    (#    578:10  Unique         2.31, 2.61 A)
 &rst
  ixpk= 578, nxpk= 10, iat= 321, 317, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   20 THR  MG2          21 MET  HN          3.50    (#    579:10  Preassigned    2.63, 3.67 A)
 &rst
  ixpk= 579, nxpk= 10, iat=  -1, 317, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
 igr1= 309, 310, 311,
 &end
#
#  100 ILE  MG2          21 MET  HN          5.00    (#    580:10  Unique         2.94, 4.42 A)
 &rst
  ixpk= 580, nxpk= 10, iat=  -1, 317, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,
 igr1=1491,1492,1493,
 &end
#
#    0 AMB  10-2:581     21 MET  HN          5.00    (#    581:10  Single Ambig)
 &rst
  ixpk= 581, nxpk= 10, iat=  -1, 317, r1= 1.30, r2= 1.80, r3= 7.57, r4= 8.07,
 igr1=1530,1531,1532,1534,1535,1536,1530,1531,1532,1534,
      1535,1536,
 &end
#
#   55 GLU  HN           54 ILE  HN          6.00    (#    582:10  Unique         3.11, 3.33 A)
 &rst
  ixpk= 582, nxpk= 10, iat= 799, 780, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,  &end
#
#   48 THR  HA           54 ILE  HN          3.50    (#    584:10  Unique         2.08, 2.40 A)
 &rst
  ixpk= 584, nxpk= 10, iat= 698, 780, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   53 PRO  HA           54 ILE  HN          3.50    (#    586:10  Unique         2.07, 2.14 A)
 &rst
  ixpk= 586, nxpk= 10, iat= 776, 780, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#    0 AMB  10-2:587     54 ILE  HN          3.50    (#    587:10  Single Ambig)
 &rst
  ixpk= 587, nxpk= 10, iat=  -1, 780, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,
 igr1= 773, 774, 758, 759,
 &end
#
#   54 ILE  HB           54 ILE  HN          3.50    (#    588:10  Preassigned    2.46, 2.60 A)
 &rst
  ixpk= 588, nxpk= 10, iat= 784, 780, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   54 ILE  HG1+         54 ILE  HN          3.50    (#    589:10  Unique         2.02, 2.85 A)
 &rst
  ixpk= 589, nxpk= 10, iat=  -1, 780, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1= 790, 791,
 &end
#
#    0 AMB  10-2:590     54 ILE  HN          3.50    (#    590:10  Single Ambig)
 &rst
  ixpk= 590, nxpk= 10, iat=  -1, 780, r1= 1.30, r2= 1.80, r3= 4.58, r4= 5.08,
 igr1= 790, 791, 702, 703, 704,
 &end
#
#   54 ILE  MG2          54 ILE  HN          5.00    (#    591:10  Unique         4.38, 4.56 A)
 &rst
  ixpk= 591, nxpk= 10, iat=  -1, 780, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,
 igr1= 786, 787, 788,
 &end
#
#   79 LYS  HA           82 GLU  HN          5.00    (#    594:10  Unique         3.09, 3.53 A)
 &rst
  ixpk= 594, nxpk= 10, iat=1187,1230, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50,  &end
#
#   43 PRO  HD+          42 GLU  HN          5.00    (#    600:10  Unique         4.01, 4.72 A)
 &rst
  ixpk= 600, nxpk= 10, iat=  -1, 598, r1= 1.30, r2= 1.80, r3= 5.61, r4= 6.11,
 igr1= 614, 615,
 &end
#
#   54 ILE  HA           54 ILE  HN          3.50    (#    608:10  Unique         2.90, 2.94 A)
 &rst
  ixpk= 608, nxpk= 10, iat= 782, 780, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   53 PRO  HB-          54 ILE  HN          3.50    (#    609:10  Preassigned    3.68, 4.03 A)
 &rst
  ixpk= 609, nxpk= 10, iat=  -1, 780, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1= 773, 774,
 &end
#
#   54 ILE  MD1          54 ILE  HN          3.50    (#    611:10  Unique         3.22, 4.12 A)
 &rst
  ixpk= 611, nxpk= 10, iat=  -1, 780, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
 igr1= 793, 794, 795,
 &end
#
#   43 PRO  HD+          42 GLU  HN          5.00    (#    621:10  Preassigned    4.01, 4.72 A)
 &rst
  ixpk= 621, nxpk= 10, iat=  -1, 598, r1= 1.30, r2= 1.80, r3= 5.61, r4= 6.11,
 igr1= 614, 615,
 &end
#
#   40 PHE  HA           42 GLU  HN          3.50    (#    622:10  Unique         3.20, 3.39 A)
 &rst
  ixpk= 622, nxpk= 10, iat= 566, 598, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   42 GLU  HA           42 GLU  HN          3.50    (#    623:10  Unique         2.55, 2.65 A)
 &rst
  ixpk= 623, nxpk= 10, iat= 600, 598, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   41 PRO  HA           42 GLU  HN          2.70    (#    624:10  Preassigned    2.25, 2.33 A)
 &rst
  ixpk= 624, nxpk= 10, iat= 594, 598, r1= 1.30, r2= 1.80, r3= 2.70, r4= 3.20,  &end
#
#   40 PHE  QB           42 GLU  HN          5.00    (#    625:10  Preassigned    5.11, 5.74 A)
 &rst
  ixpk= 625, nxpk= 10, iat=  -1, 598, r1= 1.30, r2= 1.80, r3= 5.61, r4= 6.11,
 igr1= 568, 569,
 &end
#
#   42 GLU  QB           42 GLU  HN          2.70    (#    626:10  Unique         2.37, 3.07 A)
 &rst
  ixpk= 626, nxpk= 10, iat=  -1, 598, r1= 1.30, r2= 1.80, r3= 3.03, r4= 3.53,
 igr1= 602, 603,
 &end
#
#   41 PRO  HB-          42 GLU  HN          3.50    (#    627:10  Unique         2.59, 3.05 A)
 &rst
  ixpk= 627, nxpk= 10, iat=  -1, 598, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1= 591, 592,
 &end
#
#   41 PRO  HB+          42 GLU  HN          3.50    (#    628:10  Unique         2.59, 3.05 A)
 &rst
  ixpk= 628, nxpk= 10, iat=  -1, 598, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1= 591, 592,
 &end
#
#   89 ALA  HN           96 GLN  HN          3.50    (#    629:10  Unique         2.94, 3.01 A)
 &rst
  ixpk= 629, nxpk= 10, iat=1339,1432, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#    0 AMB  10-2:630     96 GLN  HN          5.00    (#    630:10  Single Ambig)
 &rst
  ixpk= 630, nxpk= 10, iat=  -1,1432, r1= 1.30, r2= 1.80, r3= 5.61, r4= 6.11,
 igr1=1449, 190,
 &end
#
#   97 ASP  HA           96 GLN  HN          5.00    (#    631:10  Unique         4.60, 4.79 A)
 &rst
  ixpk= 631, nxpk= 10, iat=1451,1432, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50,  &end
#
#   95 GLU  HA           96 GLN  HN          2.70    (#    632:10  Unique         2.15, 2.21 A)
 &rst
  ixpk= 632, nxpk= 10, iat=1419,1432, r1= 1.30, r2= 1.80, r3= 2.70, r4= 3.20,  &end
#
#    0 AMB  10-2:634     96 GLN  HN          3.50    (#    634:10  Single Ambig)
 &rst
  ixpk= 634, nxpk= 10, iat=  -1,1432, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1=1351,1341,
 &end
#
#   96 GLN  HA           96 GLN  HN          3.50    (#    635:10  Unique         2.91, 2.97 A)
 &rst
  ixpk= 635, nxpk= 10, iat=1434,1432, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#    0 AMB  10-2:636     96 GLN  HN          3.50    (#    636:10  Single Ambig)
 &rst
  ixpk= 636, nxpk= 10, iat=  -1,1432, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,
 igr1=1424,1425,1356,1357,
 &end
#
#    0 AMB  10-2:637     96 GLN  HN          3.50    (#    637:10  Single Ambig)
 &rst
  ixpk= 637, nxpk= 10, iat=  -1,1432, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,
 igr1= 180, 181, 183, 184,
 &end
#
#   96 GLN  HB-          96 GLN  HN          3.50    (#    638:10  Unique         2.48, 3.23 A)
 &rst
  ixpk= 638, nxpk= 10, iat=  -1,1432, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1=1436,1437,
 &end
#
#    0 AMB  10-2:639     96 GLN  HN          5.00    (#    639:10  Single Ambig)
 &rst
  ixpk= 639, nxpk= 10, iat=  -1,1432, r1= 1.30, r2= 1.80, r3= 6.30, r4= 6.80,
 igr1= 180, 181, 183, 184,
 &end
#
#   89 ALA  MB           96 GLN  HN          3.50    (#    640:10  Unique         3.34, 4.48 A)
 &rst
  ixpk= 640, nxpk= 10, iat=  -1,1432, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
 igr1=1343,1344,1345,
 &end
#
#    0 AMB  10-2:641     96 GLN  HN          3.50    (#    641:10  Single Ambig)
 &rst
  ixpk= 641, nxpk= 10, iat=  -1,1432, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 207, 208, 209, 211, 212, 213,1326,1327,1328,
 &end
#
#   65 PHE  QD           65 PHE  HN          5.00    (#    650:10  Preassigned    2.36, 3.75 A)
 &rst
  ixpk= 650, nxpk= 10, iat=  -1, 956, r1= 1.30, r2= 1.80, r3= 5.61, r4= 6.11,
 igr1= 964, 972,
 &end
#
#   65 PHE  HA           65 PHE  HN          3.50    (#    651:10  Unique         2.87, 2.90 A)
 &rst
  ixpk= 651, nxpk= 10, iat= 958, 956, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   64 SER  HA           65 PHE  HN          2.70    (#    652:10  Unique         2.47, 2.57 A)
 &rst
  ixpk= 652, nxpk= 10, iat= 947, 956, r1= 1.30, r2= 1.80, r3= 2.70, r4= 3.20,  &end
#
#   64 SER  HB+          65 PHE  HN          5.00    (#    654:10  Preassigned    2.43, 3.06 A)
 &rst
  ixpk= 654, nxpk= 10, iat=  -1, 956, r1= 1.30, r2= 1.80, r3= 5.61, r4= 6.11,
 igr1= 949, 950,
 &end
#
#   64 SER  HB-          65 PHE  HN          5.00    (#    655:10  Preassigned    2.43, 3.06 A)
 &rst
  ixpk= 655, nxpk= 10, iat=  -1, 956, r1= 1.30, r2= 1.80, r3= 5.61, r4= 6.11,
 igr1= 949, 950,
 &end
#
#   65 PHE  HB2          65 PHE  HN          3.50    (#    656:10  Preassigned    3.89, 3.96 A)
 &rst
  ixpk= 656, nxpk= 10, iat= 960, 956, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   65 PHE  HB3          65 PHE  HN          2.70    (#    657:10  Preassigned    3.25, 3.37 A)
 &rst
  ixpk= 657, nxpk= 10, iat= 961, 956, r1= 1.30, r2= 1.80, r3= 2.70, r4= 3.20,  &end
#
#   44 THR  HN           45 MET  HN          5.00    (#    658:10  Unique         4.04, 4.13 A)
 &rst
  ixpk= 658, nxpk= 10, iat= 627, 641, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50,  &end
#
#   45 MET  HA           45 MET  HN          5.00    (#    659:10  Unique         2.97, 2.99 A)
 &rst
  ixpk= 659, nxpk= 10, iat= 643, 641, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50,  &end
#
#   44 THR  HA           45 MET  HN          2.70    (#    661:10  Preassigned    2.17, 2.25 A)
 &rst
  ixpk= 661, nxpk= 10, iat= 629, 641, r1= 1.30, r2= 1.80, r3= 2.70, r4= 3.20,  &end
#
#   44 THR  HB           45 MET  HN          5.00    (#    662:10  Preassigned    4.27, 4.42 A)
 &rst
  ixpk= 662, nxpk= 10, iat= 631, 641, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50,  &end
#
#   45 MET  HG+          45 MET  HN          5.00    (#    663:10  Unique         2.28, 3.02 A)
 &rst
  ixpk= 663, nxpk= 10, iat=  -1, 641, r1= 1.30, r2= 1.80, r3= 5.61, r4= 6.11,
 igr1= 648, 649,
 &end
#
#   45 MET  HB3          45 MET  HN          3.50    (#    664:10  Preassigned    2.59, 2.88 A)
 &rst
  ixpk= 664, nxpk= 10, iat= 646, 641, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   44 THR  MG2          45 MET  HN          3.50    (#    665:10  Preassigned    3.44, 4.19 A)
 &rst
  ixpk= 665, nxpk= 10, iat=  -1, 641, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
 igr1= 633, 634, 635,
 &end
#
#   45 MET  HG-          45 MET  HN          5.00    (#    675:10  Unique         2.28, 3.02 A)
 &rst
  ixpk= 675, nxpk= 10, iat=  -1, 641, r1= 1.30, r2= 1.80, r3= 5.61, r4= 6.11,
 igr1= 648, 649,
 &end
#
#    0 AMB  10-2:676     45 MET  HN          5.00    (#    676:10  Single Ambig)
 &rst
  ixpk= 676, nxpk= 10, iat=  -1, 641, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,
 igr1= 645, 617, 618,
 &end
#
#   87 CYS  HA           87 CYS  HN          5.00    (#    680:10  Unique         2.96, 2.97 A)
 &rst
  ixpk= 680, nxpk= 10, iat=1312,1310, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50,  &end
#
#    0 AMB  10-2:681     87 CYS  HN          5.00    (#    681:10  Single Ambig)
 &rst
  ixpk= 681, nxpk= 10, iat=  -1,1310, r1= 1.30, r2= 1.80, r3= 6.54, r4= 7.04,
 igr1=1465,1466,1467,1301,1302,
 &end
#
#   86 ILE  HG1-         87 CYS  HN          5.00    (#    682:10  Unique         4.54, 4.88 A)
 &rst
  ixpk= 682, nxpk= 10, iat=  -1,1310, r1= 1.30, r2= 1.80, r3= 5.61, r4= 6.11,
 igr1=1301,1302,
 &end
#
#   98 ALA  HN           87 CYS  HN          3.50    (#    683:10  Unique         2.80, 2.99 A)
 &rst
  ixpk= 683, nxpk= 10, iat=1461,1310, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   97 ASP  HA           87 CYS  HN          5.00    (#    684:10  Unique         4.60, 4.80 A)
 &rst
  ixpk= 684, nxpk= 10, iat=1451,1310, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50,  &end
#
#   86 ILE  HA           87 CYS  HN          2.70    (#    685:10  Unique         2.16, 2.22 A)
 &rst
  ixpk= 685, nxpk= 10, iat=1293,1310, r1= 1.30, r2= 1.80, r3= 2.70, r4= 3.20,  &end
#
#   99 THR  HA           87 CYS  HN          3.50    (#    686:10  Unique         2.50, 2.71 A)
 &rst
  ixpk= 686, nxpk= 10, iat=1473,1310, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#    0 AMB  10-2:687     87 CYS  HN          5.00    (#    687:10  Single Ambig)
 &rst
  ixpk= 687, nxpk= 10, iat=  -1,1310, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,
 igr1=1314,1453,1454,
 &end
#
#    0 AMB  10-2:688     87 CYS  HN          5.00    (#    688:10  Single Ambig)
 &rst
  ixpk= 688, nxpk= 10, iat=  -1,1310, r1= 1.30, r2= 1.80, r3= 7.07, r4= 7.57,
 igr1=1330,1331, 207, 208, 209, 211, 212, 213,
 &end
#
#    0 AMB  10-2:689     87 CYS  HN          2.70    (#    689:10  Single Ambig)
 &rst
  ixpk= 689, nxpk= 10, iat=  -1,1310, r1= 1.30, r2= 1.80, r3= 3.64, r4= 4.14,
 igr1=1297,1298,1299,1333,1334,1335,
 &end
#
#   87 CYS  HB3          87 CYS  HN          3.50    (#    690:10  Unique         2.90, 3.26 A)
 &rst
  ixpk= 690, nxpk= 10, iat=1315,1310, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#  103 LYS  HA          104 VAL  HN          2.70    (#    697:10  Unique         2.07, 2.19 A)
 &rst
  ixpk= 697, nxpk= 10, iat=1542,1562, r1= 1.30, r2= 1.80, r3= 2.70, r4= 3.20,  &end
#
#   82 GLU  HG+         104 VAL  HN          3.50    (#    699:10  Unique         2.11, 3.31 A)
 &rst
  ixpk= 699, nxpk= 10, iat=  -1,1562, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1=1237,1238,
 &end
#
#   82 GLU  HB+         104 VAL  HN          5.00    (#    700:10  Unique         2.63, 3.74 A)
 &rst
  ixpk= 700, nxpk= 10, iat=  -1,1562, r1= 1.30, r2= 1.80, r3= 5.61, r4= 6.11,
 igr1=1234,1235,
 &end
#
#   82 GLU  HB-         104 VAL  HN          3.50    (#    701:10  Unique         2.63, 3.74 A)
 &rst
  ixpk= 701, nxpk= 10, iat=  -1,1562, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1=1234,1235,
 &end
#
#    0 AMB  10-2:702    104 VAL  HN          5.00    (#    702:10  Single Ambig)
 &rst
  ixpk= 702, nxpk= 10, iat=  -1,1562, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,
 igr1=1528,1547,1548,
 &end
#
#  104 VAL  MGY         104 VAL  HN          3.50    (#    703:10  Unique         2.16, 3.92 A)
 &rst
  ixpk= 703, nxpk= 10, iat=  -1,1562, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,
 igr1=1568,1569,1570,1572,1573,1574,
 &end
#
#  104 VAL  MGX         104 VAL  HN          5.00    (#    704:10  Unique         2.16, 3.92 A)
 &rst
  ixpk= 704, nxpk= 10, iat=  -1,1562, r1= 1.30, r2= 1.80, r3= 6.74, r4= 7.24,
 igr1=1568,1569,1570,1572,1573,1574,
 &end
#
#   82 GLU  HG-         104 VAL  HN          3.50    (#    705:10  Unique         2.11, 3.31 A)
 &rst
  ixpk= 705, nxpk= 10, iat=  -1,1562, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1=1237,1238,
 &end
#
#  104 VAL  HB          104 VAL  HN          2.70    (#    706:10  Unique         2.44, 2.56 A)
 &rst
  ixpk= 706, nxpk= 10, iat=1566,1562, r1= 1.30, r2= 1.80, r3= 2.70, r4= 3.20,  &end
#
#  103 LYS  HB-         104 VAL  HN          5.00    (#    707:10  Unique         2.86, 4.05 A)
 &rst
  ixpk= 707, nxpk= 10, iat=  -1,1562, r1= 1.30, r2= 1.80, r3= 5.61, r4= 6.11,
 igr1=1544,1545,
 &end
#
#   48 THR  HN           86 ILE  HN          3.50    (#    708:10  Unique         2.94, 3.12 A)
 &rst
  ixpk= 708, nxpk= 10, iat= 696,1291, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   85 TYR  HA           86 ILE  HN          2.70    (#    709:10  Unique         2.29, 2.32 A)
 &rst
  ixpk= 709, nxpk= 10, iat=1272,1291, r1= 1.30, r2= 1.80, r3= 2.70, r4= 3.20,  &end
#
#   86 ILE  HA           86 ILE  HN          5.00    (#    710:10  Unique         2.92, 2.95 A)
 &rst
  ixpk= 710, nxpk= 10, iat=1293,1291, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50,  &end
#
#    0 AMB  10-2:711     86 ILE  HN          5.00    (#    711:10  Single Ambig)
 &rst
  ixpk= 711, nxpk= 10, iat=  -1,1291, r1= 1.30, r2= 1.80, r3= 6.30, r4= 6.80,
 igr1=1274,1275, 736, 737,
 &end
#
#    0 AMB  10-2:712     86 ILE  HN          5.00    (#    712:10  Single Ambig)
 &rst
  ixpk= 712, nxpk= 10, iat=  -1,1291, r1= 1.30, r2= 1.80, r3= 6.74, r4= 7.24,
 igr1=1304,1305,1306, 793, 794, 795,
 &end
#
#    0 AMB  10-2:714     87 CYS  HN          5.00    (#    714:10  Single Ambig)
 &rst
  ixpk= 714, nxpk= 10, iat=  -1,1310, r1= 1.30, r2= 1.80, r3= 5.61, r4= 6.11,
 igr1=1291, 658,
 &end
#
#    5 GLN  HA            6 VAL  HN          2.70    (#    717:10  Unique         2.12, 2.75 A)
 &rst
  ixpk= 717, nxpk= 10, iat=  66,  81, r1= 1.30, r2= 1.80, r3= 2.70, r4= 3.20,  &end
#
#    0 AMB  10-2:718      6 VAL  HN          3.50    (#    718:10  Single Ambig)
 &rst
  ixpk= 718, nxpk= 10, iat=  -1,  81, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1=  83,  99,
 &end
#
#    5 GLN  HB+           6 VAL  HN          5.00    (#    719:10  Unique         2.56, 4.22 A)
 &rst
  ixpk= 719, nxpk= 10, iat=  -1,  81, r1= 1.30, r2= 1.80, r3= 5.61, r4= 6.11,
 igr1=  68,  69,
 &end
#
#    0 AMB  10-2:720      6 VAL  HN          3.50    (#    720:10  Single Ambig)
 &rst
  ixpk= 720, nxpk= 10, iat=  -1,  81, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
 igr1=  68,  69,  85,
 &end
#
#    0 AMB  10-2:721      6 VAL  HN          3.50    (#    721:10  Single Ambig)
 &rst
  ixpk= 721, nxpk= 10, iat=  -1,  81, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1=  91,  92,  93,  51,  52,  53, 126, 127, 128,
 &end
#
#   82 GLU  HA          104 VAL  HN          5.00    (#    728:10  Unique         2.41, 2.89 A)
 &rst
  ixpk= 728, nxpk= 10, iat=1232,1562, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50,  &end
#
#  104 VAL  HA          104 VAL  HN          3.50    (#    730:10  Unique         2.89, 2.92 A)
 &rst
  ixpk= 730, nxpk= 10, iat=1564,1562, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#    0 AMB  10-2:731    104 VAL  HN          5.00    (#    731:10  Single Ambig)
 &rst
  ixpk= 731, nxpk= 10, iat=  -1,1562, r1= 1.30, r2= 1.80, r3= 6.74, r4= 7.24,
 igr1=1550,1551,1550,1551,1192,1193,
 &end
#
#    5 GLN  HN            6 VAL  HN          5.00    (#    734:10  Unique         1.98, 3.12 A)
 &rst
  ixpk= 734, nxpk= 10, iat=  64,  81, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50,  &end
#
#  105 PHE  HN           23 ALA  HN          3.50    (#    752:10  Unique         2.54, 2.77 A)
 &rst
  ixpk= 752, nxpk= 10, iat=1578, 348, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   22 ASN  HA           23 ALA  HN          2.70    (#    762:10  Unique         2.28, 2.49 A)
 &rst
  ixpk= 762, nxpk= 10, iat= 336, 348, r1= 1.30, r2= 1.80, r3= 2.70, r4= 3.20,  &end
#
#   23 ALA  MB           23 ALA  HN          3.50    (#    763:10  Preassigned    2.84, 3.56 A)
 &rst
  ixpk= 763, nxpk= 10, iat=  -1, 348, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
 igr1= 352, 353, 354,
 &end
#
#    0 AMB  10-2:764     23 ALA  HN          3.50    (#    764:10  Single Ambig)
 &rst
  ixpk= 764, nxpk= 10, iat=  -1, 348, r1= 1.30, r2= 1.80, r3= 5.81, r4= 6.31,
 igr1=1568,1569,1570,1572,1573,1574,1530,1531,1532,1534,
      1535,1536,1530,1531,1532,1534,1535,1536,1163,1164,
      1165,
 &end
#
#   23 ALA  HA           23 ALA  HN          3.50    (#    765:10  Preassigned    2.78, 2.83 A)
 &rst
  ixpk= 765, nxpk= 10, iat= 350, 348, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   22 ASN  QB           23 ALA  HN          3.50    (#    766:10  Unique         2.23, 3.23 A)
 &rst
  ixpk= 766, nxpk= 10, iat=  -1, 348, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1= 338, 339,
 &end
#
#   55 GLU  HA           56 GLN  HN          2.70    (#    767:10  Unique         2.22, 2.36 A)
 &rst
  ixpk= 767, nxpk= 10, iat= 801, 814, r1= 1.30, r2= 1.80, r3= 2.70, r4= 3.20,  &end
#
#   56 GLN  HG+          56 GLN  HN          5.00    (#    768:10  Unique         1.99, 2.71 A)
 &rst
  ixpk= 768, nxpk= 10, iat=  -1, 814, r1= 1.30, r2= 1.80, r3= 5.61, r4= 6.11,
 igr1= 821, 822,
 &end
#
#   56 GLN  HB+          56 GLN  HN          3.50    (#    769:10  Unique         2.32, 3.09 A)
 &rst
  ixpk= 769, nxpk= 10, iat=  -1, 814, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1= 818, 819,
 &end
#
#   56 GLN  HB-          56 GLN  HN          2.70    (#    770:10  Unique         2.32, 3.09 A)
 &rst
  ixpk= 770, nxpk= 10, iat=  -1, 814, r1= 1.30, r2= 1.80, r3= 3.03, r4= 3.53,
 igr1= 818, 819,
 &end
#
#   10 VAL  HN            9 ASN  HN          5.00    (#    775:10  Unique         3.63, 4.05 A)
 &rst
  ixpk= 775, nxpk= 10, iat= 146, 132, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50,  &end
#
#    8 VAL  HN            9 ASN  HN          5.00    (#    776:10  Unique         1.82, 2.13 A)
 &rst
  ixpk= 776, nxpk= 10, iat= 116, 132, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50,  &end
#
#    9 ASN  HD21          9 ASN  HN          3.50    (#    777:10  Unique         3.21, 3.49 A)
 &rst
  ixpk= 777, nxpk= 10, iat= 141, 132, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#    9 ASN  HD22          9 ASN  HN          5.00    (#    778:10  Unique         2.11, 3.11 A)
 &rst
  ixpk= 778, nxpk= 10, iat= 142, 132, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50,  &end
#
#    9 ASN  HA            9 ASN  HN          3.50    (#    779:10  Unique         2.37, 2.86 A)
 &rst
  ixpk= 779, nxpk= 10, iat= 134, 132, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#    8 VAL  HA            9 ASN  HN          3.50    (#    781:10  Preassigned    3.50, 3.53 A)
 &rst
  ixpk= 781, nxpk= 10, iat= 118, 132, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#    9 ASN  QB            9 ASN  HN          3.50    (#    783:10  Preassigned    2.29, 3.13 A)
 &rst
  ixpk= 783, nxpk= 10, iat=  -1, 132, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1= 136, 137,
 &end
#
#    8 VAL  HB            9 ASN  HN          5.00    (#    784:10  Unique         1.99, 2.31 A)
 &rst
  ixpk= 784, nxpk= 10, iat= 120, 132, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50,  &end
#
#   10 VAL  MG2           9 ASN  HN          5.00    (#    785:10  Unique         4.20, 5.45 A)
 &rst
  ixpk= 785, nxpk= 10, iat=  -1, 132, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,
 igr1= 156, 157, 158,
 &end
#
#    0 AMB  10-2:786      9 ASN  HN          3.50    (#    786:10  Single Ambig)
 &rst
  ixpk= 786, nxpk= 10, iat=  -1, 132, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,
 igr1= 122, 123, 124, 126, 127, 128,
 &end
#
#   51 GLY  HA+          52 GLU  HN          3.50    (#    790:10  Preassigned    2.71, 3.24 A)
 &rst
  ixpk= 790, nxpk= 10, iat=  -1, 751, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1= 746, 747,
 &end
#
#   52 GLU  HA           52 GLU  HN          3.50    (#    791:10  Preassigned    2.76, 2.86 A)
 &rst
  ixpk= 791, nxpk= 10, iat= 753, 751, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   51 GLY  HA-          52 GLU  HN          3.50    (#    792:10  Preassigned    2.71, 3.24 A)
 &rst
  ixpk= 792, nxpk= 10, iat=  -1, 751, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1= 746, 747,
 &end
#
#   46 THR  HA           56 GLN  HN          5.00    (#    801:10  Unique         3.04, 3.73 A)
 &rst
  ixpk= 801, nxpk= 10, iat= 660, 814, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50,  &end
#
#    0 AMB  10-2:804      3 ASP  HN          5.00    (#    804:10  Single Ambig)
 &rst
  ixpk= 804, nxpk= 10, iat=  -1,  33, r1= 1.30, r2= 1.80, r3= 6.30, r4= 6.80,
 igr1=  37,  38, 136, 137,
 &end
#
#   49 LYS  HN           52 GLU  HN          3.50    (#    807:10  Preassigned    2.75, 2.87 A)
 &rst
  ixpk= 807, nxpk= 10, iat= 710, 751, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   51 GLY  HN           52 GLU  HN          3.50    (#    808:10  Preassigned    2.13, 2.41 A)
 &rst
  ixpk= 808, nxpk= 10, iat= 744, 751, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   48 THR  HA           52 GLU  HN          5.00    (#    810:10  Preassigned    3.19, 3.57 A)
 &rst
  ixpk= 810, nxpk= 10, iat= 698, 751, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50,  &end
#
#   53 PRO  HD-          52 GLU  HN          5.00    (#    811:10  Unique         4.19, 4.65 A)
 &rst
  ixpk= 811, nxpk= 10, iat=  -1, 751, r1= 1.30, r2= 1.80, r3= 5.61, r4= 6.11,
 igr1= 767, 768,
 &end
#
#   48 THR  HB           52 GLU  HN          3.50    (#    812:10  Preassigned    2.32, 2.87 A)
 &rst
  ixpk= 812, nxpk= 10, iat= 700, 751, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   52 GLU  HG+          52 GLU  HN          5.00    (#    813:10  Preassigned    2.49, 3.55 A)
 &rst
  ixpk= 813, nxpk= 10, iat=  -1, 751, r1= 1.30, r2= 1.80, r3= 5.61, r4= 6.11,
 igr1= 758, 759,
 &end
#
#   52 GLU  HG-          52 GLU  HN          3.50    (#    814:10  Unique         2.49, 3.55 A)
 &rst
  ixpk= 814, nxpk= 10, iat=  -1, 751, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1= 758, 759,
 &end
#
#   52 GLU  HB2          52 GLU  HN          5.00    (#    815:10  Preassigned    3.85, 4.03 A)
 &rst
  ixpk= 815, nxpk= 10, iat= 755, 751, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50,  &end
#
#   52 GLU  HB3          52 GLU  HN          3.50    (#    816:10  Preassigned    2.88, 3.30 A)
 &rst
  ixpk= 816, nxpk= 10, iat= 756, 751, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   48 THR  MG2          52 GLU  HN          5.00    (#    818:10  Preassigned    3.92, 4.96 A)
 &rst
  ixpk= 818, nxpk= 10, iat=  -1, 751, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,
 igr1= 702, 703, 704,
 &end
#
#   30 SER  HN           29 GLN  HN          5.00    (#    828:10  Preassigned    4.39, 4.53 A)
 &rst
  ixpk= 828, nxpk= 10, iat= 443, 426, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50,  &end
#
#   29 GLN  QG           29 GLN  HN          5.00    (#    829:10  Preassigned    2.70, 3.82 A)
 &rst
  ixpk= 829, nxpk= 10, iat=  -1, 426, r1= 1.30, r2= 1.80, r3= 5.61, r4= 6.11,
 igr1= 433, 434,
 &end
#
#   29 GLN  HB-          29 GLN  HN          3.50    (#    830:10  Preassigned    2.06, 3.14 A)
 &rst
  ixpk= 830, nxpk= 10, iat=  -1, 426, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1= 430, 431,
 &end
#
#   59 ASN  HN           57 GLU  HN          5.00    (#    831:10  Unique         3.99, 4.08 A)
 &rst
  ixpk= 831, nxpk= 10, iat= 858, 831, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50,  &end
#
#   57 GLU  HA           57 GLU  HN          3.50    (#    832:10  Unique         2.75, 2.83 A)
 &rst
  ixpk= 832, nxpk= 10, iat= 833, 831, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   56 GLN  HA           57 GLU  HN          3.50    (#    833:10  Unique         3.45, 3.52 A)
 &rst
  ixpk= 833, nxpk= 10, iat= 816, 831, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#    0 AMB  10-2:835     57 GLU  HN          2.70    (#    835:10  Single Ambig)
 &rst
  ixpk= 835, nxpk= 10, iat=  -1, 831, r1= 1.30, r2= 1.80, r3= 3.40, r4= 3.90,
 igr1= 838, 839, 821, 822,
 &end
#
#   56 GLN  HB-          57 GLU  HN          3.50    (#    836:10  Unique         2.36, 3.31 A)
 &rst
  ixpk= 836, nxpk= 10, iat=  -1, 831, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1= 818, 819,
 &end
#
#    0 AMB  10-2:837     57 GLU  HN          2.70    (#    837:10  Single Ambig)
 &rst
  ixpk= 837, nxpk= 10, iat=  -1, 831, r1= 1.30, r2= 1.80, r3= 3.53, r4= 4.03,
 igr1= 803, 835, 836, 821, 822,
 &end
#
#    0 AMB  10-2:847     49 LYS  HN          5.00    (#    847:10  Single Ambig)
 &rst
  ixpk= 847, nxpk= 10, iat=  -1, 710, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,
 igr1= 720, 721, 784,
 &end
#
#   52 GLU  HN           49 LYS  HN          3.50    (#    848:10  Unique         2.75, 2.87 A)
 &rst
  ixpk= 848, nxpk= 10, iat= 751, 710, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   48 THR  HA           49 LYS  HN          3.50    (#    849:10  Unique         2.08, 2.16 A)
 &rst
  ixpk= 849, nxpk= 10, iat= 698, 710, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   49 LYS  HA           49 LYS  HN          3.50    (#    851:10  Unique         2.92, 2.96 A)
 &rst
  ixpk= 851, nxpk= 10, iat= 712, 710, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   48 THR  HB           49 LYS  HN          5.00    (#    852:10  Unique         3.18, 3.34 A)
 &rst
  ixpk= 852, nxpk= 10, iat= 700, 710, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50,  &end
#
#   49 LYS  HB+          49 LYS  HN          3.50    (#    853:10  Unique         2.07, 2.58 A)
 &rst
  ixpk= 853, nxpk= 10, iat=  -1, 710, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1= 714, 715,
 &end
#
#   49 LYS  HB-          49 LYS  HN          3.50    (#    854:10  Unique         2.07, 2.58 A)
 &rst
  ixpk= 854, nxpk= 10, iat=  -1, 710, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1= 714, 715,
 &end
#
#   48 THR  MG2          49 LYS  HN          5.00    (#    855:10  Preassigned    4.27, 5.03 A)
 &rst
  ixpk= 855, nxpk= 10, iat=  -1, 710, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,
 igr1= 702, 703, 704,
 &end
#
#   54 ILE  MD1          49 LYS  HN          3.50    (#    856:10  Unique         2.56, 3.59 A)
 &rst
  ixpk= 856, nxpk= 10, iat=  -1, 710, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
 igr1= 793, 794, 795,
 &end
#
#   28 SER  HN           29 GLN  HN          3.50    (#    859:10  Unique         2.11, 2.97 A)
 &rst
  ixpk= 859, nxpk= 10, iat= 415, 426, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   29 GLN  HA           29 GLN  HN          5.00    (#    861:10  Preassigned    2.29, 2.84 A)
 &rst
  ixpk= 861, nxpk= 10, iat= 428, 426, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50,  &end
#
#   28 SER  HA           29 GLN  HN          3.50    (#    862:10  Unique         2.19, 2.67 A)
 &rst
  ixpk= 862, nxpk= 10, iat= 417, 426, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   13 SER  HN           14 VAL  HN          5.00    (#    873:10  Unique         3.44, 3.63 A)
 &rst
  ixpk= 873, nxpk= 10, iat= 190, 201, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50,  &end
#
#  100 ILE  MD1          34 ALA  HN          5.00    (#    877:10  Preassigned    2.72, 3.86 A)
 &rst
  ixpk= 877, nxpk= 10, iat=  -1, 503, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,
 igr1=1498,1499,1500,
 &end
#
#   33 LEU  HA           34 ALA  HN          2.70    (#    879:10  Unique         2.24, 2.56 A)
 &rst
  ixpk= 879, nxpk= 10, iat= 486, 503, r1= 1.30, r2= 1.80, r3= 2.70, r4= 3.20,  &end
#
#    0 AMB  10-2:880     34 ALA  HN          3.50    (#    880:10  Single Ambig)
 &rst
  ixpk= 880, nxpk= 10, iat=  -1, 503, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1= 488, 491,
 &end
#
#    5 GLN  HN            4 ILE  HN          5.00    (#    883:10  Unique         2.24, 3.48 A)
 &rst
  ixpk= 883, nxpk= 10, iat=  64,  45, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50,  &end
#
#   13 SER  HN           14 VAL  HN          5.00    (#    896:10  Preassigned    3.44, 3.63 A)
 &rst
  ixpk= 896, nxpk= 10, iat= 190, 201, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50,  &end
#
#   14 VAL  HA           14 VAL  HN          3.50    (#    897:10  Unique         2.78, 2.85 A)
 &rst
  ixpk= 897, nxpk= 10, iat= 203, 201, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   13 SER  HA           14 VAL  HN          2.70    (#    898:10  Unique         2.22, 2.49 A)
 &rst
  ixpk= 898, nxpk= 10, iat= 192, 201, r1= 1.30, r2= 1.80, r3= 2.70, r4= 3.20,  &end
#
#   13 SER  QB           14 VAL  HN          5.00    (#    899:10  Unique         4.04, 4.43 A)
 &rst
  ixpk= 899, nxpk= 10, iat=  -1, 201, r1= 1.30, r2= 1.80, r3= 5.61, r4= 6.11,
 igr1= 194, 195,
 &end
#
#   96 GLN  HB-          14 VAL  HN          3.50    (#    900:10  Preassigned    2.85, 3.29 A)
 &rst
  ixpk= 900, nxpk= 10, iat=  -1, 201, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1=1436,1437,
 &end
#
#   14 VAL  HB           14 VAL  HN          3.50    (#    901:10  Unique         2.42, 2.58 A)
 &rst
  ixpk= 901, nxpk= 10, iat= 205, 201, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   37 ALA  MB           14 VAL  HN          5.00    (#    902:10  Unique         4.42, 5.28 A)
 &rst
  ixpk= 902, nxpk= 10, iat=  -1, 201, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,
 igr1= 539, 540, 541,
 &end
#
#   14 VAL  MGX          14 VAL  HN          3.50    (#    903:10  Unique         2.00, 3.78 A)
 &rst
  ixpk= 903, nxpk= 10, iat=  -1, 201, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,
 igr1= 207, 208, 209, 211, 212, 213,
 &end
#
#   14 VAL  MGY          14 VAL  HN          2.70    (#    904:10  Unique         2.00, 3.78 A)
 &rst
  ixpk= 904, nxpk= 10, iat=  -1, 201, r1= 1.30, r2= 1.80, r3= 3.64, r4= 4.14,
 igr1= 207, 208, 209, 211, 212, 213,
 &end
#
#   33 LEU  HN           34 ALA  HN          5.00    (#    906:10  Unique         4.31, 4.40 A)
 &rst
  ixpk= 906, nxpk= 10, iat= 484, 503, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50,  &end
#
#   33 LEU  MDX          34 ALA  HN          5.00    (#    907:10  Unique         3.84, 5.26 A)
 &rst
  ixpk= 907, nxpk= 10, iat=  -1, 503, r1= 1.30, r2= 1.80, r3= 6.74, r4= 7.24,
 igr1= 493, 494, 495, 497, 498, 499,
 &end
#
#   34 ALA  HA           34 ALA  HN          3.50    (#    908:10  Unique         2.91, 2.95 A)
 &rst
  ixpk= 908, nxpk= 10, iat= 505, 503, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#    3 ASP  HA            4 ILE  HN          3.50    (#    911:10  Unique         2.19, 2.61 A)
 &rst
  ixpk= 911, nxpk= 10, iat=  35,  45, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#    0 AMB  10-2:912      4 ILE  HN          5.00    (#    912:10  Single Ambig)
 &rst
  ixpk= 912, nxpk= 10, iat=  -1,  45, r1= 1.30, r2= 1.80, r3= 5.61, r4= 6.11,
 igr1=  47, 118,
 &end
#
#    0 AMB  10-2:913      4 ILE  HN          3.50    (#    913:10  Single Ambig)
 &rst
  ixpk= 913, nxpk= 10, iat=  -1,  45, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
 igr1=  49,  15,  16,
 &end
#
#    4 ILE  HG1-          4 ILE  HN          5.00    (#    914:10  Unique         2.94, 3.62 A)
 &rst
  ixpk= 914, nxpk= 10, iat=  -1,  45, r1= 1.30, r2= 1.80, r3= 5.61, r4= 6.11,
 igr1=  55,  56,
 &end
#
#    0 AMB  10-2:915      4 ILE  HN          5.00    (#    915:10  Single Ambig)
 &rst
  ixpk= 915, nxpk= 10, iat=  -1,  45, r1= 1.30, r2= 1.80, r3= 7.57, r4= 8.07,
 igr1=  58,  59,  60, 126, 127, 128,  91,  92,  93, 122,
       123, 124,
 &end
#
#   90 GLU  HN           91 ASN  HN          5.00    (#    920:10  Unique         4.26, 4.35 A)
 &rst
  ixpk= 920, nxpk= 10, iat=1349,1364, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50,  &end
#
#   94 GLY  HN           91 ASN  HN          3.50    (#    922:10  Unique         2.85, 2.91 A)
 &rst
  ixpk= 922, nxpk= 10, iat=1410,1364, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   95 GLU  HA           91 ASN  HN          3.50    (#    923:10  Unique         3.48, 3.53 A)
 &rst
  ixpk= 923, nxpk= 10, iat=1419,1364, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   90 GLU  HA           91 ASN  HN          2.70    (#    924:10  Unique         2.15, 2.22 A)
 &rst
  ixpk= 924, nxpk= 10, iat=1351,1364, r1= 1.30, r2= 1.80, r3= 2.70, r4= 3.20,  &end
#
#   91 ASN  HA           91 ASN  HN          3.50    (#    925:10  Unique         2.83, 2.85 A)
 &rst
  ixpk= 925, nxpk= 10, iat=1366,1364, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#    0 AMB  10-2:926     91 ASN  HN          3.50    (#    926:10  Single Ambig)
 &rst
  ixpk= 926, nxpk= 10, iat=  -1,1364, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,
 igr1=1356,1357,1424,1425,
 &end
#
#    0 AMB  10-2:927     91 ASN  HN          5.00    (#    927:10  Single Ambig)
 &rst
  ixpk= 927, nxpk= 10, iat=  -1,1364, r1= 1.30, r2= 1.80, r3= 6.30, r4= 6.80,
 igr1=1421,1422,1421,1422,
 &end
#
#    0 AMB  10-2:934     91 ASN  HN          3.50    (#    934:10  Single Ambig)
 &rst
  ixpk= 934, nxpk= 10, iat=  -1,1364, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,
 igr1= 180, 181, 183, 184,
 &end
#
#   89 ALA  HN           90 GLU  HN          5.00    (#    935:10  Preassigned    4.30, 4.36 A)
 &rst
  ixpk= 935, nxpk= 10, iat=1339,1349, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50,  &end
#
#   45 MET  HA           90 GLU  HN          3.50    (#    936:10  Unique         2.84, 3.17 A)
 &rst
  ixpk= 936, nxpk= 10, iat= 643,1349, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#    0 AMB  10-2:937     90 GLU  HN          2.70    (#    937:10  Single Ambig)
 &rst
  ixpk= 937, nxpk= 10, iat=  -1,1349, r1= 1.30, r2= 1.80, r3= 3.03, r4= 3.53,
 igr1=1341,1351,
 &end
#
#    0 AMB  10-2:938     90 GLU  HN          2.70    (#    938:10  Single Ambig)
 &rst
  ixpk= 938, nxpk= 10, iat=  -1,1349, r1= 1.30, r2= 1.80, r3= 3.64, r4= 4.14,
 igr1=1353,1354, 180, 181, 183, 184,
 &end
#
#   43 PRO  QB           90 GLU  HN          5.00    (#    939:10  Preassigned    2.96, 4.20 A)
 &rst
  ixpk= 939, nxpk= 10, iat=  -1,1349, r1= 1.30, r2= 1.80, r3= 5.61, r4= 6.11,
 igr1= 620, 621,
 &end
#
#   89 ALA  MB           90 GLU  HN          3.50    (#    940:10  Unique         2.86, 3.76 A)
 &rst
  ixpk= 940, nxpk= 10, iat=  -1,1349, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
 igr1=1343,1344,1345,
 &end
#
#   33 LEU  HN           32 THR  HN          5.00    (#    943:10  Unique         4.40, 4.49 A)
 &rst
  ixpk= 943, nxpk= 10, iat= 484, 470, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50,  &end
#
#   31 VAL  HN           32 THR  HN          5.00    (#    944:10  Preassigned    4.25, 4.33 A)
 &rst
  ixpk= 944, nxpk= 10, iat= 454, 470, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50,  &end
#
#   31 VAL  HA           32 THR  HN          2.70    (#    947:10  Preassigned    2.11, 2.17 A)
 &rst
  ixpk= 947, nxpk= 10, iat= 456, 470, r1= 1.30, r2= 1.80, r3= 2.70, r4= 3.20,  &end
#
#   32 THR  HB           32 THR  HN          2.70    (#    949:10  Unique         2.44, 2.52 A)
 &rst
  ixpk= 949, nxpk= 10, iat= 474, 470, r1= 1.30, r2= 1.80, r3= 2.70, r4= 3.20,  &end
#
#   21 MET  ME           32 THR  HN          5.00    (#    950:10  Unique         4.50, 5.56 A)
 &rst
  ixpk= 950, nxpk= 10, iat=  -1, 470, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,
 igr1= 328, 329, 330,
 &end
#
#   32 THR  MG2          32 THR  HN          5.00    (#    951:10  Unique         4.38, 4.59 A)
 &rst
  ixpk= 951, nxpk= 10, iat=  -1, 470, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,
 igr1= 476, 477, 478,
 &end
#
#   31 VAL  HB           32 THR  HN          5.00    (#    953:10  Unique         3.82, 4.16 A)
 &rst
  ixpk= 953, nxpk= 10, iat= 458, 470, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50,  &end
#
#   31 VAL  MG1          32 THR  HN          3.50    (#    954:10  Unique         2.49, 3.54 A)
 &rst
  ixpk= 954, nxpk= 10, iat=  -1, 470, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
 igr1= 460, 461, 462,
 &end
#
#   96 GLN  HN           97 ASP  HN          5.00    (#    955:10  Preassigned    4.35, 4.42 A)
 &rst
  ixpk= 955, nxpk= 10, iat=1432,1449, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50,  &end
#
#   96 GLN  HE21         97 ASP  HN          6.00    (#    956:10  Preassigned    5.40, 6.55 A)
 &rst
  ixpk= 956, nxpk= 10, iat=1444,1449, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,  &end
#
#   97 ASP  HA           97 ASP  HN          3.50    (#    957:10  Preassigned    2.87, 2.88 A)
 &rst
  ixpk= 957, nxpk= 10, iat=1451,1449, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   96 GLN  HA           97 ASP  HN          2.70    (#    959:10  Unique         2.44, 2.50 A)
 &rst
  ixpk= 959, nxpk= 10, iat=1434,1449, r1= 1.30, r2= 1.80, r3= 2.70, r4= 3.20,  &end
#
#   96 GLN  HG+          97 ASP  HN          3.50    (#    961:10  Preassigned    3.73, 4.09 A)
 &rst
  ixpk= 961, nxpk= 10, iat=  -1,1449, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1=1439,1440,
 &end
#
#   97 ASP  HB+          97 ASP  HN          3.50    (#    962:10  Preassigned    3.36, 3.71 A)
 &rst
  ixpk= 962, nxpk= 10, iat=  -1,1449, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1=1453,1454,
 &end
#
#   97 ASP  HB-          97 ASP  HN          5.00    (#    963:10  Unique         3.36, 3.71 A)
 &rst
  ixpk= 963, nxpk= 10, iat=  -1,1449, r1= 1.30, r2= 1.80, r3= 5.61, r4= 6.11,
 igr1=1453,1454,
 &end
#
#   96 GLN  HB+          97 ASP  HN          3.50    (#    964:10  Unique         2.09, 2.91 A)
 &rst
  ixpk= 964, nxpk= 10, iat=  -1,1449, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1=1436,1437,
 &end
#
#   96 GLN  HB-          97 ASP  HN          3.50    (#    965:10  Unique         2.09, 2.91 A)
 &rst
  ixpk= 965, nxpk= 10, iat=  -1,1449, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1=1436,1437,
 &end
#
#    0 AMB  10-2:966     97 ASP  HN          3.50    (#    966:10  Single Ambig)
 &rst
  ixpk= 966, nxpk= 10, iat=  -1,1449, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 207, 208, 209, 211, 212, 213,1326,1327,1328,
 &end
#
#   98 ALA  HN           97 ASP  HN          5.00    (#    967:10  Unique         4.30, 4.36 A)
 &rst
  ixpk= 967, nxpk= 10, iat=1461,1449, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50,  &end
#
#    0 AMB  10-2:970     47 TRP  HN          5.00    (#    970:10  Single Ambig)
 &rst
  ixpk= 970, nxpk= 10, iat=  -1, 672, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,
 igr1= 814, 658, 831,
 &end
#
#   47 TRP  HD1          47 TRP  HN          3.50    (#    971:10  Preassigned    2.60, 2.79 A)
 &rst
  ixpk= 971, nxpk= 10, iat= 680, 672, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   47 TRP  HA           47 TRP  HN          3.50    (#    973:10  Unique         2.78, 2.84 A)
 &rst
  ixpk= 973, nxpk= 10, iat= 674, 672, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   46 THR  HA           47 TRP  HN          2.70    (#    974:10  Preassigned    2.38, 2.48 A)
 &rst
  ixpk= 974, nxpk= 10, iat= 660, 672, r1= 1.30, r2= 1.80, r3= 2.70, r4= 3.20,  &end
#
#    0 AMB  10-2:975     47 TRP  HN          5.00    (#    975:10  Single Ambig)
 &rst
  ixpk= 975, nxpk= 10, iat=  -1, 672, r1= 1.30, r2= 1.80, r3= 5.61, r4= 6.11,
 igr1=1312, 816,
 &end
#
#   46 THR  HB           47 TRP  HN          3.50    (#    976:10  Preassigned    2.26, 2.90 A)
 &rst
  ixpk= 976, nxpk= 10, iat= 662, 672, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   47 TRP  HB2          47 TRP  HN          5.00    (#    977:10  Unique         3.91, 3.95 A)
 &rst
  ixpk= 977, nxpk= 10, iat= 676, 672, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50,  &end
#
#   47 TRP  HB3          47 TRP  HN          5.00    (#    978:10  Unique         3.60, 3.71 A)
 &rst
  ixpk= 978, nxpk= 10, iat= 677, 672, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50,  &end
#
#   46 THR  MG2          47 TRP  HN          3.50    (#    979:10  Preassigned    3.52, 4.30 A)
 &rst
  ixpk= 979, nxpk= 10, iat=  -1, 672, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
 igr1= 664, 665, 666,
 &end
#
#    0 AMB  10-2:980     47 TRP  HN          5.00    (#    980:10  Single Ambig)
 &rst
  ixpk= 980, nxpk= 10, iat=  -1, 672, r1= 1.30, r2= 1.80, r3= 6.74, r4= 7.24,
 igr1= 793, 794, 795,1333,1334,1335,
 &end
#
#   59 ASN  HA           60 GLU  HN          3.50    (#    983:10  Unique         2.12, 2.19 A)
 &rst
  ixpk= 983, nxpk= 10, iat= 860, 872, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#    0 AMB  10-2:984     60 GLU  HN          3.50    (#    984:10  Single Ambig)
 &rst
  ixpk= 984, nxpk= 10, iat=  -1, 872, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,
 igr1= 879, 880, 879, 880,
 &end
#
#   60 GLU  HB-          60 GLU  HN          2.70    (#    985:10  Unique         2.61, 3.24 A)
 &rst
  ixpk= 985, nxpk= 10, iat=  -1, 872, r1= 1.30, r2= 1.80, r3= 3.03, r4= 3.53,
 igr1= 876, 877,
 &end
#
#    0 AMB  10-2:986      0 AMB  10-1:986    2.70    (#    986:10  Double Ambig)
 &rst
  ixpk= 986, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 3.40, r4= 3.90,
 igr1= 858, 887,
 igr2= 846, 872,
 &end
#
#   58 ASP  HA           58 ASP  HN          3.50    (#    988:10  Unique         2.92, 2.98 A)
 &rst
  ixpk= 988, nxpk= 10, iat= 848, 846, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   56 GLN  HA           58 ASP  HN          5.00    (#    989:10  Unique         3.56, 4.07 A)
 &rst
  ixpk= 989, nxpk= 10, iat= 816, 846, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50,  &end
#
#    0 AMB  10-2:990     58 ASP  HN          5.00    (#    990:10  Single Ambig)
 &rst
  ixpk= 990, nxpk= 10, iat=  -1, 846, r1= 1.30, r2= 1.80, r3= 6.30, r4= 6.80,
 igr1= 838, 839, 806, 807,
 &end
#
#   58 ASP  HB+          58 ASP  HN          3.50    (#    991:10  Unique         2.37, 3.01 A)
 &rst
  ixpk= 991, nxpk= 10, iat=  -1, 846, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1= 850, 851,
 &end
#
#    0 AMB  10-2:992     58 ASP  HN          3.50    (#    992:10  Single Ambig)
 &rst
  ixpk= 992, nxpk= 10, iat=  -1, 846, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
 igr1= 835, 836, 803,
 &end
#
#   57 GLU  HA           58 ASP  HN          3.50    (#    993:10  Unique         3.24, 3.45 A)
 &rst
  ixpk= 993, nxpk= 10, iat= 833, 846, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   58 ASP  HB-          58 ASP  HN          3.50    (#    994:10  Unique         2.37, 3.01 A)
 &rst
  ixpk= 994, nxpk= 10, iat=  -1, 846, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1= 850, 851,
 &end
#
#    0 AMB  10-2:999      0 AMB  10-1:999    5.00    (#    999:10  Double Ambig)
 &rst
  ixpk= 999, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.30, r4= 6.80,
 igr1= 535, 513,
 igr2= 523, 545,
 &end
#
#   15 ARG  HN           36 ASP  HN          5.00    (#   1000:10  Preassigned    2.55, 3.31 A)
 &rst
  ixpk= 1000, nxpk= 10, iat= 217, 523, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50,  &end
#
#   35 CYS  HA           36 ASP  HN          2.70    (#   1001:10  Preassigned    2.19, 2.28 A)
 &rst
  ixpk= 1001, nxpk= 10, iat= 515, 523, r1= 1.30, r2= 1.80, r3= 2.70, r4= 3.20,  &end
#
#   35 CYS  HB+          36 ASP  HN          5.00    (#   1002:10  Preassigned    2.39, 4.32 A)
 &rst
  ixpk= 1002, nxpk= 10, iat=  -1, 523, r1= 1.30, r2= 1.80, r3= 5.61, r4= 6.11,
 igr1= 517, 518,
 &end
#
#   36 ASP  HB3          36 ASP  HN          3.50    (#   1003:10  Preassigned    2.65, 2.82 A)
 &rst
  ixpk= 1003, nxpk= 10, iat= 528, 523, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   43 PRO  HG+          38 ASP  HN          6.00    (#   1004:10  Preassigned    4.25, 5.43 A)
 &rst
  ixpk= 1004, nxpk= 10, iat=  -1, 545, r1= 1.30, r2= 1.80, r3= 6.73, r4= 7.23,
 igr1= 617, 618,
 &end
#
#   87 CYS  HN           98 ALA  HN          3.50    (#   1005:10  Unique         2.80, 2.99 A)
 &rst
  ixpk= 1005, nxpk= 10, iat=1310,1461, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   97 ASP  HN           98 ALA  HN          5.00    (#   1006:10  Unique         4.30, 4.36 A)
 &rst
  ixpk= 1006, nxpk= 10, iat=1449,1461, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50,  &end
#
#   97 ASP  HA           98 ALA  HN          2.70    (#   1007:10  Unique         2.29, 2.34 A)
 &rst
  ixpk= 1007, nxpk= 10, iat=1451,1461, r1= 1.30, r2= 1.80, r3= 2.70, r4= 3.20,  &end
#
#   88 ILE  HA           98 ALA  HN          5.00    (#   1009:10  Unique         3.72, 3.83 A)
 &rst
  ixpk= 1009, nxpk= 10, iat=1322,1461, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50,  &end
#
#   97 ASP  HB+          98 ALA  HN          3.50    (#   1010:10  Unique         2.40, 3.23 A)
 &rst
  ixpk= 1010, nxpk= 10, iat=  -1,1461, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1=1453,1454,
 &end
#
#   97 ASP  HB-          98 ALA  HN          3.50    (#   1011:10  Unique         2.40, 3.23 A)
 &rst
  ixpk= 1011, nxpk= 10, iat=  -1,1461, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1=1453,1454,
 &end
#
#   98 ALA  MB           98 ALA  HN          3.50    (#   1012:10  Unique         2.85, 3.46 A)
 &rst
  ixpk= 1012, nxpk= 10, iat=  -1,1461, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
 igr1=1465,1466,1467,
 &end
#
#    0 AMB  10-2:1013    98 ALA  HN          5.00    (#   1013:10  Single Ambig)
 &rst
  ixpk= 1013, nxpk= 10, iat=  -1,1461, r1= 1.30, r2= 1.80, r3= 7.07, r4= 7.57,
 igr1= 207, 208, 209, 211, 212, 213,1330,1331,
 &end
#
#    0 AMB  10-2:1014    98 ALA  HN          2.70    (#   1014:10  Single Ambig)
 &rst
  ixpk= 1014, nxpk= 10, iat=  -1,1461, r1= 1.30, r2= 1.80, r3= 4.09, r4= 4.59,
 igr1= 207, 208, 209, 211, 212, 213,1333,1334,1335,1297,
      1298,1299,
 &end
#
#   87 CYS  HB3          98 ALA  HN          5.00    (#   1015:10  Unique         4.77, 4.93 A)
 &rst
  ixpk= 1015, nxpk= 10, iat=1315,1461, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50,  &end
#
#    0 AMB  10-2:1017    98 ALA  HN          5.00    (#   1017:10  Single Ambig)
 &rst
  ixpk= 1017, nxpk= 10, iat=  -1,1461, r1= 1.30, r2= 1.80, r3= 5.61, r4= 6.11,
 igr1=1293, 203,
 &end
#
#   13 SER  HN           38 ASP  HN          3.50    (#   1024:10  Preassigned    3.34, 3.50 A)
 &rst
  ixpk= 1024, nxpk= 10, iat= 190, 545, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   37 ALA  HA           38 ASP  HN          2.70    (#   1026:10  Unique         2.16, 2.29 A)
 &rst
  ixpk= 1026, nxpk= 10, iat= 537, 545, r1= 1.30, r2= 1.80, r3= 2.70, r4= 3.20,  &end
#
#   14 VAL  HA           38 ASP  HN          3.50    (#   1027:10  Preassigned    3.29, 3.42 A)
 &rst
  ixpk= 1027, nxpk= 10, iat= 203, 545, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   38 ASP  QB           38 ASP  HN          2.70    (#   1029:10  Preassigned    2.36, 3.05 A)
 &rst
  ixpk= 1029, nxpk= 10, iat=  -1, 545, r1= 1.30, r2= 1.80, r3= 3.03, r4= 3.53,
 igr1= 549, 550,
 &end
#
#   15 ARG  HB-          36 ASP  HN          5.00    (#   1030:10  Preassigned    3.89, 4.79 A)
 &rst
  ixpk= 1030, nxpk= 10, iat=  -1, 523, r1= 1.30, r2= 1.80, r3= 5.61, r4= 6.11,
 igr1= 221, 222,
 &end
#
#   43 PRO  HG-          38 ASP  HN          6.00    (#   1031:10  Preassigned    4.25, 5.43 A)
 &rst
  ixpk= 1031, nxpk= 10, iat=  -1, 545, r1= 1.30, r2= 1.80, r3= 6.73, r4= 7.23,
 igr1= 617, 618,
 &end
#
#   37 ALA  MB           38 ASP  HN          3.50    (#   1032:10  Preassigned    3.94, 4.33 A)
 &rst
  ixpk= 1032, nxpk= 10, iat=  -1, 545, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
 igr1= 539, 540, 541,
 &end
#
#   14 VAL  MGX          38 ASP  HN          5.00    (#   1033:10  Preassigned    4.73, 6.37 A)
 &rst
  ixpk= 1033, nxpk= 10, iat=  -1, 545, r1= 1.30, r2= 1.80, r3= 6.74, r4= 7.24,
 igr1= 207, 208, 209, 211, 212, 213,
 &end
#
#   39 GLY  HN           38 ASP  HN          5.00    (#   1034:10  Preassigned    4.27, 4.36 A)
 &rst
  ixpk= 1034, nxpk= 10, iat= 557, 545, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50,  &end
#
#    0 AMB  10-2:1035    98 ALA  HN          5.00    (#   1035:10  Single Ambig)
 &rst
  ixpk= 1035, nxpk= 10, iat=  -1,1461, r1= 1.30, r2= 1.80, r3= 6.54, r4= 7.04,
 igr1=1330,1331, 245, 246, 247,
 &end
#
#   22 ASN  HA           22 ASN  HN          5.00    (#   1041:10  Unique         2.82, 2.88 A)
 &rst
  ixpk= 1041, nxpk= 10, iat= 336, 334, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50,  &end
#
#   21 MET  HA           22 ASN  HN          2.70    (#   1042:10  Unique         2.24, 2.49 A)
 &rst
  ixpk= 1042, nxpk= 10, iat= 319, 334, r1= 1.30, r2= 1.80, r3= 2.70, r4= 3.20,  &end
#
#   21 MET  QG           22 ASN  HN          5.00    (#   1044:10  Unique         4.28, 4.52 A)
 &rst
  ixpk= 1044, nxpk= 10, iat=  -1, 334, r1= 1.30, r2= 1.80, r3= 5.61, r4= 6.11,
 igr1= 324, 325,
 &end
#
#   21 MET  ME           22 ASN  HN          5.00    (#   1045:10  Preassigned    2.29, 3.64 A)
 &rst
  ixpk= 1045, nxpk= 10, iat=  -1, 334, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,
 igr1= 328, 329, 330,
 &end
#
#   21 MET  HB3          22 ASN  HN          3.50    (#   1046:10  Unique         2.04, 2.27 A)
 &rst
  ixpk= 1046, nxpk= 10, iat= 322, 334, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#    0 AMB  10-2:1047    22 ASN  HN          5.00    (#   1047:10  Single Ambig)
 &rst
  ixpk= 1047, nxpk= 10, iat=  -1, 334, r1= 1.30, r2= 1.80, r3= 7.21, r4= 7.71,
 igr1= 352, 353, 354,1547,1548, 309, 310, 311,1528,
 &end
#
#   26 ASN  HN           27 LEU  HN          3.50    (#   1052:10  Unique         2.80, 3.12 A)
 &rst
  ixpk= 1052, nxpk= 10, iat= 382, 396, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#    0 AMB  10-2:1054    27 LEU  HN          3.50    (#   1054:10  Single Ambig)
 &rst
  ixpk= 1054, nxpk= 10, iat=  -1, 396, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1= 374, 417,
 &end
#
#    0 AMB  10-2:1055    27 LEU  HN          5.00    (#   1055:10  Single Ambig)
 &rst
  ixpk= 1055, nxpk= 10, iat=  -1, 396, r1= 1.30, r2= 1.80, r3= 7.57, r4= 8.07,
 igr1= 405, 406, 407, 409, 410, 411, 405, 406, 407, 409,
       410, 411,
 &end
#
#   28 SER  HN           27 LEU  HN          3.50    (#   1056:10  Unique         2.50, 2.95 A)
 &rst
  ixpk= 1056, nxpk= 10, iat= 415, 396, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   27 LEU  HB+          27 LEU  HN          3.50    (#   1058:10  Preassigned    2.37, 3.21 A)
 &rst
  ixpk= 1058, nxpk= 10, iat=  -1, 396, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1= 400, 401,
 &end
#
#   27 LEU  HG           27 LEU  HN          3.50    (#   1059:10  Preassigned    2.21, 3.16 A)
 &rst
  ixpk= 1059, nxpk= 10, iat= 403, 396, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   27 LEU  HB-          27 LEU  HN          3.50    (#   1060:10  Unique         2.37, 3.21 A)
 &rst
  ixpk= 1060, nxpk= 10, iat=  -1, 396, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1= 400, 401,
 &end
#
#   91 ASN  HN           93 ALA  HN          5.00    (#   1061:10  Unique         4.01, 4.13 A)
 &rst
  ixpk= 1061, nxpk= 10, iat=1364,1400, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50,  &end
#
#   35 CYS  HB-          35 CYS  HN          3.50    (#   1069:10  Unique         2.63, 3.18 A)
 &rst
  ixpk= 1069, nxpk= 10, iat=  -1, 513, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1= 517, 518,
 &end
#
#   72 LEU  HN           35 CYS  HN          5.00    (#   1071:10  Preassigned    4.62, 4.78 A)
 &rst
  ixpk= 1071, nxpk= 10, iat=1056, 513, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50,  &end
#
#   47 TRP  HZ2          35 CYS  HN          3.50    (#   1072:10  Preassigned    2.81, 3.23 A)
 &rst
  ixpk= 1072, nxpk= 10, iat= 685, 513, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   47 TRP  HH2          35 CYS  HN          5.00    (#   1073:10  Preassigned    2.88, 3.64 A)
 &rst
  ixpk= 1073, nxpk= 10, iat= 687, 513, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50,  &end
#
#   34 ALA  HA           35 CYS  HN          2.70    (#   1074:10  Unique         2.14, 2.18 A)
 &rst
  ixpk= 1074, nxpk= 10, iat= 505, 513, r1= 1.30, r2= 1.80, r3= 2.70, r4= 3.20,  &end
#
#   71 GLU  HA           35 CYS  HN          5.00    (#   1075:10  Preassigned    3.54, 3.88 A)
 &rst
  ixpk= 1075, nxpk= 10, iat=1043, 513, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50,  &end
#
#   35 CYS  HA           35 CYS  HN          3.50    (#   1076:10  Preassigned    2.93, 2.95 A)
 &rst
  ixpk= 1076, nxpk= 10, iat= 515, 513, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   35 CYS  HB+          35 CYS  HN          3.50    (#   1078:10  Unique         2.63, 3.18 A)
 &rst
  ixpk= 1078, nxpk= 10, iat=  -1, 513, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1= 517, 518,
 &end
#
#   34 ALA  MB           35 CYS  HN          2.70    (#   1079:10  Preassigned    2.40, 3.47 A)
 &rst
  ixpk= 1079, nxpk= 10, iat=  -1, 513, r1= 1.30, r2= 1.80, r3= 3.24, r4= 3.74,
 igr1= 507, 508, 509,
 &end
#
#   80 SER  HN           79 LYS  HN          5.00    (#   1081:10  Unique         2.74, 2.92 A)
 &rst
  ixpk= 1081, nxpk= 10, iat=1207,1185, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50,  &end
#
#   78 ASP  HN           79 LYS  HN          5.00    (#   1082:10  Unique         4.23, 4.28 A)
 &rst
  ixpk= 1082, nxpk= 10, iat=1173,1185, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50,  &end
#
#   78 ASP  HA           79 LYS  HN          3.50    (#   1083:10  Unique         2.52, 2.69 A)
 &rst
  ixpk= 1083, nxpk= 10, iat=1175,1185, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   79 LYS  HA           79 LYS  HN          3.50    (#   1084:10  Unique         2.70, 2.78 A)
 &rst
  ixpk= 1084, nxpk= 10, iat=1187,1185, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   78 ASP  HB+          79 LYS  HN          2.70    (#   1085:10  Unique         2.11, 3.17 A)
 &rst
  ixpk= 1085, nxpk= 10, iat=  -1,1185, r1= 1.30, r2= 1.80, r3= 3.03, r4= 3.53,
 igr1=1177,1178,
 &end
#
#   79 LYS  HB+          79 LYS  HN          3.50    (#   1087:10  Unique         2.23, 2.90 A)
 &rst
  ixpk= 1087, nxpk= 10, iat=  -1,1185, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1=1189,1190,
 &end
#
#    0 AMB  10-2:1088    79 LYS  HN          3.50    (#   1088:10  Single Ambig)
 &rst
  ixpk= 1088, nxpk= 10, iat=  -1,1185, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,
 igr1=1189,1190,1195,1196,
 &end
#
#    0 AMB  10-2:1089    79 LYS  HN          3.50    (#   1089:10  Single Ambig)
 &rst
  ixpk= 1089, nxpk= 10, iat=  -1,1185, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,
 igr1=1192,1193,1192,1193,
 &end
#
#   25 ALA  MB           79 LYS  HN          3.50    (#   1090:10  Unique         2.51, 3.79 A)
 &rst
  ixpk= 1090, nxpk= 10, iat=  -1,1185, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
 igr1= 376, 377, 378,
 &end
#
#  104 VAL  MGY          79 LYS  HN          6.00    (#   1091:10  Preassigned    3.50, 5.33 A)
 &rst
  ixpk= 1091, nxpk= 10, iat=  -1,1185, r1= 1.30, r2= 1.80, r3= 8.09, r4= 8.59,
 igr1=1568,1569,1570,1572,1573,1574,
 &end
#
#   76 LYS  HN           31 VAL  HN          5.00    (#   1092:10  Unique         4.13, 5.00 A)
 &rst
  ixpk= 1092, nxpk= 10, iat=1135, 454, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50,  &end
#
#   30 SER  HN           31 VAL  HN          5.00    (#   1093:10  Preassigned    3.84, 4.37 A)
 &rst
  ixpk= 1093, nxpk= 10, iat= 443, 454, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50,  &end
#
#   30 SER  HA           31 VAL  HN          2.70    (#   1094:10  Unique         2.19, 2.25 A)
 &rst
  ixpk= 1094, nxpk= 10, iat= 445, 454, r1= 1.30, r2= 1.80, r3= 2.70, r4= 3.20,  &end
#
#   31 VAL  HA           31 VAL  HN          3.50    (#   1096:10  Preassigned    2.93, 2.99 A)
 &rst
  ixpk= 1096, nxpk= 10, iat= 456, 454, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   75 LYS  HA           31 VAL  HN          3.50    (#   1097:10  Preassigned    4.06, 4.26 A)
 &rst
  ixpk= 1097, nxpk= 10, iat=1115, 454, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   30 SER  QB           31 VAL  HN          3.50    (#   1098:10  Unique         3.16, 3.78 A)
 &rst
  ixpk= 1098, nxpk= 10, iat=  -1, 454, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1= 447, 448,
 &end
#
#   31 VAL  HB           31 VAL  HN          3.50    (#   1099:10  Unique         2.62, 2.79 A)
 &rst
  ixpk= 1099, nxpk= 10, iat= 458, 454, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   74 ILE  HB           31 VAL  HN          3.50    (#   1100:10  Unique         2.31, 2.66 A)
 &rst
  ixpk= 1100, nxpk= 10, iat=1098, 454, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   31 VAL  MG2          31 VAL  HN          3.50    (#   1102:10  Preassigned    2.86, 3.68 A)
 &rst
  ixpk= 1102, nxpk= 10, iat=  -1, 454, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
 igr1= 464, 465, 466,
 &end
#
#   73 ILE  MG2          31 VAL  HN          3.50    (#   1104:10  Unique         3.56, 4.28 A)
 &rst
  ixpk= 1104, nxpk= 10, iat=  -1, 454, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
 igr1=1081,1082,1083,
 &end
#
#   80 SER  HA           81 ASP  HN          3.50    (#   1107:10  Preassigned    3.44, 3.49 A)
 &rst
  ixpk= 1107, nxpk= 10, iat=1209,1218, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   81 ASP  HB-          81 ASP  HN          3.50    (#   1108:10  Unique         2.45, 2.91 A)
 &rst
  ixpk= 1108, nxpk= 10, iat=  -1,1218, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1=1222,1223,
 &end
#
#   61 GLU  HN           62 LYS  HN          5.00    (#   1110:10  Unique         3.82, 3.93 A)
 &rst
  ixpk= 1110, nxpk= 10, iat= 887, 902, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50,  &end
#
#   63 TYR  HN           62 LYS  HN          2.70    (#   1111:10  Unique         2.17, 2.59 A)
 &rst
  ixpk= 1111, nxpk= 10, iat= 924, 902, r1= 1.30, r2= 1.80, r3= 2.70, r4= 3.20,  &end
#
#   60 GLU  HA           62 LYS  HN          5.00    (#   1113:10  Unique         4.30, 4.61 A)
 &rst
  ixpk= 1113, nxpk= 10, iat= 874, 902, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50,  &end
#
#   62 LYS  HA           62 LYS  HN          3.50    (#   1114:10  Unique         2.82, 2.89 A)
 &rst
  ixpk= 1114, nxpk= 10, iat= 904, 902, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   62 LYS  HD-          62 LYS  HN          5.00    (#   1115:10  Unique         2.93, 4.60 A)
 &rst
  ixpk= 1115, nxpk= 10, iat=  -1, 902, r1= 1.30, r2= 1.80, r3= 5.61, r4= 6.11,
 igr1= 912, 913,
 &end
#
#   62 LYS  HG+          62 LYS  HN          5.00    (#   1116:10  Unique         2.50, 3.34 A)
 &rst
  ixpk= 1116, nxpk= 10, iat=  -1, 902, r1= 1.30, r2= 1.80, r3= 5.61, r4= 6.11,
 igr1= 909, 910,
 &end
#
#   61 GLU  HA           62 LYS  HN          3.50    (#   1118:10  Unique         3.52, 3.53 A)
 &rst
  ixpk= 1118, nxpk= 10, iat= 889, 902, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   61 GLU  QB           62 LYS  HN          5.00    (#   1119:10  Unique         2.19, 2.52 A)
 &rst
  ixpk= 1119, nxpk= 10, iat=  -1, 902, r1= 1.30, r2= 1.80, r3= 5.61, r4= 6.11,
 igr1= 891, 892,
 &end
#
#   92 LYS  HN           93 ALA  HN          3.50    (#   1121:10  Unique         2.91, 3.00 A)
 &rst
  ixpk= 1121, nxpk= 10, iat=1378,1400, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#    0 AMB  10-2:1123    93 ALA  HN          5.00    (#   1123:10  Single Ambig)
 &rst
  ixpk= 1123, nxpk= 10, iat=  -1,1400, r1= 1.30, r2= 1.80, r3= 6.30, r4= 6.80,
 igr1=1412,1413, 559, 560,
 &end
#
#   41 PRO  HD-          93 ALA  HN          5.00    (#   1124:10  Unique         4.12, 5.09 A)
 &rst
  ixpk= 1124, nxpk= 10, iat=  -1,1400, r1= 1.30, r2= 1.80, r3= 5.61, r4= 6.11,
 igr1= 585, 586,
 &end
#
#   92 LYS  HB-          93 ALA  HN          3.50    (#   1125:10  Preassigned    3.65, 4.29 A)
 &rst
  ixpk= 1125, nxpk= 10, iat=  -1,1400, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1=1382,1383,
 &end
#
#   92 LYS  HB+          93 ALA  HN          5.00    (#   1126:10  Preassigned    3.65, 4.29 A)
 &rst
  ixpk= 1126, nxpk= 10, iat=  -1,1400, r1= 1.30, r2= 1.80, r3= 5.61, r4= 6.11,
 igr1=1382,1383,
 &end
#
#   92 LYS  QG           93 ALA  HN          3.50    (#   1127:10  Unique         2.55, 3.80 A)
 &rst
  ixpk= 1127, nxpk= 10, iat=  -1,1400, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1=1385,1386,
 &end
#
#   93 ALA  MB           93 ALA  HN          2.70    (#   1128:10  Preassigned    2.44, 2.97 A)
 &rst
  ixpk= 1128, nxpk= 10, iat=  -1,1400, r1= 1.30, r2= 1.80, r3= 3.24, r4= 3.74,
 igr1=1404,1405,1406,
 &end
#
#    9 ASN  QB           93 ALA  HN          5.00    (#   1131:10  Unique         3.83, 5.10 A)
 &rst
  ixpk= 1131, nxpk= 10, iat=  -1,1400, r1= 1.30, r2= 1.80, r3= 5.61, r4= 6.11,
 igr1= 136, 137,
 &end
#
#   10 VAL  HN           40 PHE  HN          3.50    (#   1139:10  Preassigned    2.62, 3.04 A)
 &rst
  ixpk= 1139, nxpk= 10, iat= 146, 564, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   91 ASN  HD21         40 PHE  HN          3.50    (#   1140:10  Preassigned    2.11, 2.28 A)
 &rst
  ixpk= 1140, nxpk= 10, iat=1373, 564, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   39 GLY  HN           40 PHE  HN          5.00    (#   1141:10  Unique         4.30, 4.34 A)
 &rst
  ixpk= 1141, nxpk= 10, iat= 557, 564, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50,  &end
#
#   91 ASN  HD22         40 PHE  HN          3.50    (#   1142:10  Preassigned    2.83, 3.03 A)
 &rst
  ixpk= 1142, nxpk= 10, iat=1374, 564, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   40 PHE  HA           40 PHE  HN          3.50    (#   1143:10  Unique         2.91, 2.95 A)
 &rst
  ixpk= 1143, nxpk= 10, iat= 566, 564, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   39 GLY  HA+          40 PHE  HN          3.50    (#   1144:10  Preassigned    2.29, 2.61 A)
 &rst
  ixpk= 1144, nxpk= 10, iat=  -1, 564, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1= 559, 560,
 &end
#
#   39 GLY  HA-          40 PHE  HN          3.50    (#   1146:10  Preassigned    2.29, 2.61 A)
 &rst
  ixpk= 1146, nxpk= 10, iat=  -1, 564, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1= 559, 560,
 &end
#
#   40 PHE  QB           40 PHE  HN          3.50    (#   1147:10  Preassigned    2.78, 3.24 A)
 &rst
  ixpk= 1147, nxpk= 10, iat=  -1, 564, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1= 568, 569,
 &end
#
#    9 ASN  HA           40 PHE  HN          5.00    (#   1148:10  Preassigned    4.64, 4.80 A)
 &rst
  ixpk= 1148, nxpk= 10, iat= 134, 564, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50,  &end
#
#   78 ASP  HN           81 ASP  HN          3.50    (#   1150:10  Unique         2.88, 3.12 A)
 &rst
  ixpk= 1150, nxpk= 10, iat=1173,1218, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   80 SER  HN           81 ASP  HN          3.50    (#   1151:10  Preassigned    2.69, 2.73 A)
 &rst
  ixpk= 1151, nxpk= 10, iat=1207,1218, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   82 GLU  HN           81 ASP  HN          3.50    (#   1153:10  Unique         2.44, 2.56 A)
 &rst
  ixpk= 1153, nxpk= 10, iat=1230,1218, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#    0 AMB  10-2:1154    81 ASP  HN          5.00    (#   1154:10  Single Ambig)
 &rst
  ixpk= 1154, nxpk= 10, iat=  -1,1218, r1= 1.30, r2= 1.80, r3= 5.61, r4= 6.11,
 igr1=1220,1175,
 &end
#
#   79 LYS  HA           81 ASP  HN          5.00    (#   1155:10  Unique         3.51, 3.78 A)
 &rst
  ixpk= 1155, nxpk= 10, iat=1187,1218, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50,  &end
#
#    0 AMB  10-2:1156    81 ASP  HN          5.00    (#   1156:10  Single Ambig)
 &rst
  ixpk= 1156, nxpk= 10, iat=  -1,1218, r1= 1.30, r2= 1.80, r3= 6.30, r4= 6.80,
 igr1= 723, 724,1198,1199,
 &end
#
#   81 ASP  HB+          81 ASP  HN          3.50    (#   1157:10  Unique         2.45, 2.91 A)
 &rst
  ixpk= 1157, nxpk= 10, iat=  -1,1218, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1=1222,1223,
 &end
#
#    0 AMB  10-2:1158    81 ASP  HN          3.50    (#   1158:10  Single Ambig)
 &rst
  ixpk= 1158, nxpk= 10, iat=  -1,1218, r1= 1.30, r2= 1.80, r3= 5.81, r4= 6.31,
 igr1=1568,1569,1570,1572,1573,1574,1163,1164,1165,1530,
      1531,1532,1534,1535,1536,1530,1531,1532,1534,1535,
      1536,
 &end
#
#   78 ASP  HB-          81 ASP  HN          6.00    (#   1161:10  Unique         3.59, 4.95 A)
 &rst
  ixpk= 1161, nxpk= 10, iat=  -1,1218, r1= 1.30, r2= 1.80, r3= 6.73, r4= 7.23,
 igr1=1177,1178,
 &end
#
#   10 VAL  HB           40 PHE  HN          2.70    (#   1170:10  Preassigned    2.04, 2.21 A)
 &rst
  ixpk= 1170, nxpk= 10, iat= 150, 564, r1= 1.30, r2= 1.80, r3= 2.70, r4= 3.20,  &end
#
#   83 ALA  HA           84 GLU  HN          3.50    (#   1181:10  Preassigned    2.07, 2.22 A)
 &rst
  ixpk= 1181, nxpk= 10, iat=1247,1255, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   84 GLU  HB+          84 GLU  HN          3.50    (#   1182:10  Unique         2.26, 3.01 A)
 &rst
  ixpk= 1182, nxpk= 10, iat=  -1,1255, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1=1259,1260,
 &end
#
#   83 ALA  MB           84 GLU  HN          2.70    (#   1184:10  Unique         2.21, 3.35 A)
 &rst
  ixpk= 1184, nxpk= 10, iat=  -1,1255, r1= 1.30, r2= 1.80, r3= 3.24, r4= 3.74,
 igr1=1249,1250,1251,
 &end
#
#   50 ASP  HN           84 GLU  HN          3.50    (#   1186:10  Preassigned    2.59, 3.17 A)
 &rst
  ixpk= 1186, nxpk= 10, iat= 732,1255, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   84 GLU  QG           84 GLU  HN          5.00    (#   1187:10  Preassigned    2.90, 4.04 A)
 &rst
  ixpk= 1187, nxpk= 10, iat=  -1,1255, r1= 1.30, r2= 1.80, r3= 5.61, r4= 6.11,
 igr1=1262,1263,
 &end
#
#   76 LYS  HN           77 VAL  HN          5.00    (#   1188:10  Unique         2.01, 3.14 A)
 &rst
  ixpk= 1188, nxpk= 10, iat=1135,1157, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50,  &end
#
#   76 LYS  HA           77 VAL  HN          3.50    (#   1189:10  Unique         2.20, 2.58 A)
 &rst
  ixpk= 1189, nxpk= 10, iat=1137,1157, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#    0 AMB  10-2:1190    77 VAL  HN          3.50    (#   1190:10  Single Ambig)
 &rst
  ixpk= 1190, nxpk= 10, iat=  -1,1157, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
 igr1=1139,1140,1161,
 &end
#
#   74 ILE  MG2          77 VAL  HN          5.00    (#   1192:10  Unique         2.14, 3.71 A)
 &rst
  ixpk= 1192, nxpk= 10, iat=  -1,1157, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,
 igr1=1100,1101,1102,
 &end
#
#   28 SER  HA           77 VAL  HN          5.00    (#   1193:10  Unique         2.53, 3.56 A)
 &rst
  ixpk= 1193, nxpk= 10, iat= 417,1157, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50,  &end
#
#    0 AMB  10-2:1204    77 VAL  HN          5.00    (#   1204:10  Single Ambig)
 &rst
  ixpk= 1204, nxpk= 10, iat=  -1,1157, r1= 1.30, r2= 1.80, r3= 6.30, r4= 6.80,
 igr1=1139,1140,1145,1146,
 &end
#
#   19 SER  HB+          19 SER  HN          5.00    (#   1218:10  Unique         2.48, 3.21 A)
 &rst
  ixpk= 1218, nxpk= 10, iat=  -1, 292, r1= 1.30, r2= 1.80, r3= 5.61, r4= 6.11,
 igr1= 296, 297,
 &end
#
#   18 GLN  HA           19 SER  HN          3.50    (#   1221:10  Unique         2.18, 2.53 A)
 &rst
  ixpk= 1221, nxpk= 10, iat= 277, 292, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   20 THR  HN           19 SER  HN          3.50    (#   1233:10  Unique         2.77, 3.12 A)
 &rst
  ixpk= 1233, nxpk= 10, iat= 303, 292, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   88 ILE  HN           46 THR  HN          3.50    (#   1254:10  Preassigned    2.98, 3.08 A)
 &rst
  ixpk= 1254, nxpk= 10, iat=1320, 658, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   45 MET  HA           46 THR  HN          2.70    (#   1256:10  Unique         2.23, 2.30 A)
 &rst
  ixpk= 1256, nxpk= 10, iat= 643, 658, r1= 1.30, r2= 1.80, r3= 2.70, r4= 3.20,  &end
#
#   89 ALA  HA           46 THR  HN          5.00    (#   1257:10  Unique         3.37, 3.50 A)
 &rst
  ixpk= 1257, nxpk= 10, iat=1341, 658, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50,  &end
#
#   46 THR  HA           46 THR  HN          5.00    (#   1258:10  Unique         2.79, 2.86 A)
 &rst
  ixpk= 1258, nxpk= 10, iat= 660, 658, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50,  &end
#
#   87 CYS  HA           46 THR  HN          5.00    (#   1259:10  Unique         4.51, 4.64 A)
 &rst
  ixpk= 1259, nxpk= 10, iat=1312, 658, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50,  &end
#
#    0 AMB  10-2:1260    46 THR  HN          3.50    (#   1260:10  Single Ambig)
 &rst
  ixpk= 1260, nxpk= 10, iat=  -1, 658, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,
 igr1= 645, 652, 653, 654,
 &end
#
#   88 ILE  HB           46 THR  HN          3.50    (#   1261:10  Unique         3.48, 3.53 A)
 &rst
  ixpk= 1261, nxpk= 10, iat=1324, 658, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#    0 AMB  10-2:1262    46 THR  HN          5.00    (#   1262:10  Single Ambig)
 &rst
  ixpk= 1262, nxpk= 10, iat=  -1, 658, r1= 1.30, r2= 1.80, r3= 7.57, r4= 8.07,
 igr1=1326,1327,1328, 207, 208, 209, 211, 212, 213,1333,
      1334,1335,
 &end
#
#   46 THR  HB           46 THR  HN          5.00    (#   1263:10  Unique         3.65, 3.83 A)
 &rst
  ixpk= 1263, nxpk= 10, iat= 662, 658, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50,  &end
#
#    0 AMB  10-2:1264    46 THR  HN          5.00    (#   1264:10  Single Ambig)
 &rst
  ixpk= 1264, nxpk= 10, iat=  -1, 658, r1= 1.30, r2= 1.80, r3= 6.30, r4= 6.80,
 igr1= 648, 649, 821, 822,
 &end
#
#    0 AMB  10-2:1265    46 THR  HN          3.50    (#   1265:10  Single Ambig)
 &rst
  ixpk= 1265, nxpk= 10, iat=  -1, 658, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,
 igr1= 664, 665, 666, 539, 540, 541,
 &end
#
#   72 LEU  HN           71 GLU  HN          5.00    (#   1272:10  Preassigned    4.47, 4.58 A)
 &rst
  ixpk= 1272, nxpk= 10, iat=1056,1041, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50,  &end
#
#   66 ASN  HD21         71 GLU  HN          3.50    (#   1273:10  Unique         1.79, 2.17 A)
 &rst
  ixpk= 1273, nxpk= 10, iat= 985,1041, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#    0 AMB  10-2:1274    71 GLU  HN          5.00    (#   1274:10  Single Ambig)
 &rst
  ixpk= 1274, nxpk= 10, iat=  -1,1041, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,
 igr1= 960, 261, 262,
 &end
#
#   71 GLU  QG           71 GLU  HN          5.00    (#   1276:10  Unique         2.18, 2.95 A)
 &rst
  ixpk= 1276, nxpk= 10, iat=  -1,1041, r1= 1.30, r2= 1.80, r3= 5.61, r4= 6.11,
 igr1=1048,1049,
 &end
#
#   71 GLU  QB           71 GLU  HN          3.50    (#   1277:10  Unique         2.34, 3.10 A)
 &rst
  ixpk= 1277, nxpk= 10, iat=  -1,1041, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1=1045,1046,
 &end
#
#   72 LEU  HN           71 GLU  HN          5.00    (#   1278:10  Preassigned    4.47, 4.58 A)
 &rst
  ixpk= 1278, nxpk= 10, iat=1056,1041, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50,  &end
#
#   66 ASN  HD22         71 GLU  HN          3.50    (#   1280:10  Unique         2.31, 3.07 A)
 &rst
  ixpk= 1280, nxpk= 10, iat= 986,1041, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   71 GLU  HA           71 GLU  HN          3.50    (#   1281:10  Unique         2.89, 2.92 A)
 &rst
  ixpk= 1281, nxpk= 10, iat=1043,1041, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   30 SER  HA           76 LYS  HN          5.00    (#   1289:10  Unique         2.43, 4.02 A)
 &rst
  ixpk= 1289, nxpk= 10, iat= 445,1135, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50,  &end
#
#    0 AMB  10-2:1290    76 LYS  HN          3.50    (#   1290:10  Single Ambig)
 &rst
  ixpk= 1290, nxpk= 10, iat=  -1,1135, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1=1115,1096,
 &end
#
#   76 LYS  HA           76 LYS  HN          3.50    (#   1291:10  Unique         2.34, 2.88 A)
 &rst
  ixpk= 1291, nxpk= 10, iat=1137,1135, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#    0 AMB  10-2:1292    76 LYS  HN          3.50    (#   1292:10  Single Ambig)
 &rst
  ixpk= 1292, nxpk= 10, iat=  -1,1135, r1= 1.30, r2= 1.80, r3= 4.95, r4= 5.45,
 igr1=1139,1140,1117,1118,1145,1146, 912, 913,
 &end
#
#   62 LYS  HB+          76 LYS  HN          5.00    (#   1293:10  Preassigned    3.03, 4.30 A)
 &rst
  ixpk= 1293, nxpk= 10, iat=  -1,1135, r1= 1.30, r2= 1.80, r3= 5.61, r4= 6.11,
 igr1= 906, 907,
 &end
#
#    0 AMB  10-2:1294    76 LYS  HN          5.00    (#   1294:10  Single Ambig)
 &rst
  ixpk= 1294, nxpk= 10, iat=  -1,1135, r1= 1.30, r2= 1.80, r3= 6.74, r4= 7.24,
 igr1=1142,1143,1142,1143, 906, 907,
 &end
#
#   75 LYS  HG+          76 LYS  HN          6.00    (#   1295:10  Unique         3.99, 4.62 A)
 &rst
  ixpk= 1295, nxpk= 10, iat=  -1,1135, r1= 1.30, r2= 1.80, r3= 6.73, r4= 7.23,
 igr1=1120,1121,
 &end
#
#   77 VAL  HN           76 LYS  HN          5.00    (#   1296:10  Unique         2.01, 3.14 A)
 &rst
  ixpk= 1296, nxpk= 10, iat=1157,1135, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50,  &end
#
#   28 SER  HA           76 LYS  HN          5.00    (#   1297:10  Unique         4.62, 5.09 A)
 &rst
  ixpk= 1297, nxpk= 10, iat= 417,1135, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50,  &end
#
#   60 GLU  HN           61 GLU  HN          3.50    (#   1298:10  Unique         1.89, 2.00 A)
 &rst
  ixpk= 1298, nxpk= 10, iat= 872, 887, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   62 LYS  HN           61 GLU  HN          5.00    (#   1301:10  Unique         3.82, 3.93 A)
 &rst
  ixpk= 1301, nxpk= 10, iat= 902, 887, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50,  &end
#
#   63 TYR  HN           61 GLU  HN          5.00    (#   1302:10  Unique         4.58, 4.69 A)
 &rst
  ixpk= 1302, nxpk= 10, iat= 924, 887, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50,  &end
#
#   59 ASN  HA           61 GLU  HN          5.00    (#   1303:10  Preassigned    3.58, 3.74 A)
 &rst
  ixpk= 1303, nxpk= 10, iat= 860, 887, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50,  &end
#
#   61 GLU  HA           61 GLU  HN          3.50    (#   1305:10  Unique         2.16, 2.37 A)
 &rst
  ixpk= 1305, nxpk= 10, iat= 889, 887, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   60 GLU  HG-          61 GLU  HN          5.00    (#   1306:10  Unique         4.17, 4.98 A)
 &rst
  ixpk= 1306, nxpk= 10, iat=  -1, 887, r1= 1.30, r2= 1.80, r3= 5.61, r4= 6.11,
 igr1= 879, 880,
 &end
#
#   60 GLU  HB-          61 GLU  HN          3.50    (#   1307:10  Unique         2.57, 3.84 A)
 &rst
  ixpk= 1307, nxpk= 10, iat=  -1, 887, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1= 876, 877,
 &end
#
#   61 GLU  QB           61 GLU  HN          2.70    (#   1308:10  Unique         2.73, 3.32 A)
 &rst
  ixpk= 1308, nxpk= 10, iat=  -1, 887, r1= 1.30, r2= 1.80, r3= 3.03, r4= 3.53,
 igr1= 891, 892,
 &end
#
#    0 AMB  10-2:1310    61 GLU  HN          5.00    (#   1310:10  Single Ambig)
 &rst
  ixpk= 1310, nxpk= 10, iat=  -1, 887, r1= 1.30, r2= 1.80, r3= 6.30, r4= 6.80,
 igr1= 879, 880, 879, 880,
 &end
#
#   61 GLU  QG           61 GLU  HN          3.50    (#   1311:10  Unique         2.10, 3.15 A)
 &rst
  ixpk= 1311, nxpk= 10, iat=  -1, 887, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1= 894, 895,
 &end
#
#   96 GLN  HN           95 GLU  HN          5.00    (#   1319:10  Unique         3.84, 4.03 A)
 &rst
  ixpk= 1319, nxpk= 10, iat=1432,1417, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50,  &end
#
#   94 GLY  HN           95 GLU  HN          5.00    (#   1320:10  Unique         4.26, 4.32 A)
 &rst
  ixpk= 1320, nxpk= 10, iat=1410,1417, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50,  &end
#
#   96 GLN  HE21         95 GLU  HN          5.00    (#   1321:10  Unique         2.49, 3.35 A)
 &rst
  ixpk= 1321, nxpk= 10, iat=1444,1417, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50,  &end
#
#   95 GLU  HA           95 GLU  HN          5.00    (#   1322:10  Unique         2.86, 2.91 A)
 &rst
  ixpk= 1322, nxpk= 10, iat=1419,1417, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50,  &end
#
#   11 PRO  HA           95 GLU  HN          5.00    (#   1323:10  Preassigned    5.03, 5.08 A)
 &rst
  ixpk= 1323, nxpk= 10, iat= 172,1417, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50,  &end
#
#   94 GLY  HA+          95 GLU  HN          2.70    (#   1324:10  Unique         2.26, 2.55 A)
 &rst
  ixpk= 1324, nxpk= 10, iat=  -1,1417, r1= 1.30, r2= 1.80, r3= 3.03, r4= 3.53,
 igr1=1412,1413,
 &end
#
#   94 GLY  HA-          95 GLU  HN          2.70    (#   1325:10  Unique         2.26, 2.55 A)
 &rst
  ixpk= 1325, nxpk= 10, iat=  -1,1417, r1= 1.30, r2= 1.80, r3= 3.03, r4= 3.53,
 igr1=1412,1413,
 &end
#
#    0 AMB  10-2:1327    95 GLU  HN          3.50    (#   1327:10  Single Ambig)
 &rst
  ixpk= 1327, nxpk= 10, iat=  -1,1417, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,
 igr1= 169, 170,1424,1425,1356,1357,
 &end
#
#    0 AMB  10-2:1328    95 GLU  HN          3.50    (#   1328:10  Single Ambig)
 &rst
  ixpk= 1328, nxpk= 10, iat=  -1,1417, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,
 igr1= 169, 170, 166, 167,
 &end
#
#    0 AMB  10-2:1329    95 GLU  HN          2.70    (#   1329:10  Single Ambig)
 &rst
  ixpk= 1329, nxpk= 10, iat=  -1,1417, r1= 1.30, r2= 1.80, r3= 3.40, r4= 3.90,
 igr1=1421,1422,1421,1422,
 &end
#
#    0 AMB  10-2:1332    59 ASN  HN          3.50    (#   1332:10  Single Ambig)
 &rst
  ixpk= 1332, nxpk= 10, iat=  -1, 858, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
 igr1= 831, 799, 814,
 &end
#
#   59 ASN  HB+          59 ASN  HN          5.00    (#   1334:10  Unique         2.38, 2.65 A)
 &rst
  ixpk= 1334, nxpk= 10, iat=  -1, 858, r1= 1.30, r2= 1.80, r3= 5.61, r4= 6.11,
 igr1= 862, 863,
 &end
#
#    0 AMB  10-2:1335    59 ASN  HN          2.70    (#   1335:10  Single Ambig)
 &rst
  ixpk= 1335, nxpk= 10, iat=  -1, 858, r1= 1.30, r2= 1.80, r3= 3.40, r4= 3.90,
 igr1= 862, 863, 850, 851,
 &end
#
#   58 ASP  HB-          59 ASN  HN          3.50    (#   1337:10  Unique         2.48, 3.31 A)
 &rst
  ixpk= 1337, nxpk= 10, iat=  -1, 858, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1= 850, 851,
 &end
#
#   12 PRO  HD-          95 GLU  HN          5.00    (#   1339:10  Unique         3.17, 4.68 A)
 &rst
  ixpk= 1339, nxpk= 10, iat=  -1,1417, r1= 1.30, r2= 1.80, r3= 5.61, r4= 6.11,
 igr1= 177, 178,
 &end
#
#   23 ALA  HN           24 THR  HN          5.00    (#   1353:10  Preassigned    4.19, 4.28 A)
 &rst
  ixpk= 1353, nxpk= 10, iat= 348, 358, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50,  &end
#
#   24 THR  HA           24 THR  HN          3.50    (#   1354:10  Unique         2.83, 2.91 A)
 &rst
  ixpk= 1354, nxpk= 10, iat= 360, 358, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   23 ALA  HA           24 THR  HN          2.70    (#   1356:10  Unique         2.39, 2.53 A)
 &rst
  ixpk= 1356, nxpk= 10, iat= 350, 358, r1= 1.30, r2= 1.80, r3= 2.70, r4= 3.20,  &end
#
#   24 THR  HB           24 THR  HN          3.50    (#   1359:10  Unique         2.50, 2.61 A)
 &rst
  ixpk= 1359, nxpk= 10, iat= 362, 358, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#    0 AMB  10-2:1360    24 THR  HN          5.00    (#   1360:10  Single Ambig)
 &rst
  ixpk= 1360, nxpk= 10, iat=  -1, 358, r1= 1.30, r2= 1.80, r3= 6.92, r4= 7.42,
 igr1= 400, 401,1615,1616, 376, 377, 378,
 &end
#
#   23 ALA  MB           24 THR  HN          2.70    (#   1361:10  Preassigned    2.34, 3.33 A)
 &rst
  ixpk= 1361, nxpk= 10, iat=  -1, 358, r1= 1.30, r2= 1.80, r3= 3.24, r4= 3.74,
 igr1= 352, 353, 354,
 &end
#
#    0 AMB  10-2:1363    24 THR  HN          5.00    (#   1363:10  Single Ambig)
 &rst
  ixpk= 1363, nxpk= 10, iat=  -1, 358, r1= 1.30, r2= 1.80, r3= 7.57, r4= 8.07,
 igr1= 405, 406, 407, 409, 410, 411, 405, 406, 407, 409,
       410, 411,
 &end
#
#    0 AMB  10-2:1364    24 THR  HN          5.00    (#   1364:10  Single Ambig)
 &rst
  ixpk= 1364, nxpk= 10, iat=  -1, 358, r1= 1.30, r2= 1.80, r3= 7.21, r4= 7.71,
 igr1=1163,1164,1165,1568,1569,1570,1572,1573,1574,
 &end
#
#   59 ASN  HA           59 ASN  HN          3.50    (#   1366:10  Unique         2.92, 2.94 A)
 &rst
  ixpk= 1366, nxpk= 10, iat= 860, 858, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   58 ASP  HA           59 ASN  HN          5.00    (#   1368:10  Preassigned    3.51, 3.53 A)
 &rst
  ixpk= 1368, nxpk= 10, iat= 848, 858, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50,  &end
#
#   57 GLU  HA           59 ASN  HN          5.00    (#   1369:10  Unique         5.09, 5.15 A)
 &rst
  ixpk= 1369, nxpk= 10, iat= 833, 858, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50,  &end
#
#   58 ASP  HN           59 ASN  HN          2.70    (#   1370:10  Unique         1.79, 1.93 A)
 &rst
  ixpk= 1370, nxpk= 10, iat= 846, 858, r1= 1.30, r2= 1.80, r3= 2.70, r4= 3.20,  &end
#
#   59 ASN  HD21         59 ASN  HN          6.00    (#   1371:10  Unique         4.70, 5.64 A)
 &rst
  ixpk= 1371, nxpk= 10, iat= 867, 858, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,  &end
#
#    0 AMB  10-2:1372    59 ASN  HN          3.50    (#   1372:10  Single Ambig)
 &rst
  ixpk= 1372, nxpk= 10, iat=  -1, 858, r1= 1.30, r2= 1.80, r3= 4.58, r4= 5.08,
 igr1= 803, 835, 836, 876, 877,
 &end
#
#    0 AMB  10-2:1374    20 THR  HN          3.50    (#   1374:10  Single Ambig)
 &rst
  ixpk= 1374, nxpk= 10, iat=  -1, 303, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,
 igr1= 279, 280, 279, 280,
 &end
#
#   19 SER  HN           20 THR  HN          3.50    (#   1384:10  Preassigned    2.77, 3.12 A)
 &rst
  ixpk= 1384, nxpk= 10, iat= 292, 303, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   20 THR  HA           20 THR  HN          3.50    (#   1385:10  Unique         2.86, 2.96 A)
 &rst
  ixpk= 1385, nxpk= 10, iat= 305, 303, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#    0 AMB  10-2:1387    20 THR  HN          3.50    (#   1387:10  Single Ambig)
 &rst
  ixpk= 1387, nxpk= 10, iat=  -1, 303, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
 igr1= 307, 296, 297,
 &end
#
#   20 THR  MG2          20 THR  HN          5.00    (#   1388:10  Preassigned    4.42, 4.77 A)
 &rst
  ixpk= 1388, nxpk= 10, iat=  -1, 303, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,
 igr1= 309, 310, 311,
 &end
#
#   18 GLN  HA           20 THR  HN          5.00    (#   1389:10  Preassigned    3.53, 3.86 A)
 &rst
  ixpk= 1389, nxpk= 10, iat= 277, 303, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50,  &end
#
#   19 SER  HA           20 THR  HN          3.50    (#   1390:10  Unique         3.29, 3.51 A)
 &rst
  ixpk= 1390, nxpk= 10, iat= 294, 303, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   19 SER  HB-          20 THR  HN          5.00    (#   1391:10  Unique         2.72, 3.64 A)
 &rst
  ixpk= 1391, nxpk= 10, iat=  -1, 303, r1= 1.30, r2= 1.80, r3= 5.61, r4= 6.11,
 igr1= 296, 297,
 &end
#
#    0 AMB  10-2:1392    20 THR  HN          5.00    (#   1392:10  Single Ambig)
 &rst
  ixpk= 1392, nxpk= 10, iat=  -1, 303, r1= 1.30, r2= 1.80, r3= 6.30, r4= 6.80,
 igr1= 282, 283, 282, 283,
 &end
#
#   21 MET  QG           20 THR  HN          5.00    (#   1393:10  Unique         3.31, 4.65 A)
 &rst
  ixpk= 1393, nxpk= 10, iat=  -1, 303, r1= 1.30, r2= 1.80, r3= 5.61, r4= 6.11,
 igr1= 324, 325,
 &end
#
#   69 GLY  HN           70 SER  HN          5.00    (#   1444:10  Preassigned    2.31, 2.99 A)
 &rst
  ixpk= 1444, nxpk= 10, iat=1023,1030, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50,  &end
#
#   70 SER  QB           70 SER  HN          5.00    (#   1445:10  Preassigned    2.48, 3.09 A)
 &rst
  ixpk= 1445, nxpk= 10, iat=  -1,1030, r1= 1.30, r2= 1.80, r3= 5.61, r4= 6.11,
 igr1=1034,1035,
 &end
#
#   71 GLU  HN           70 SER  HN          3.50    (#   1446:10  Unique         2.78, 3.27 A)
 &rst
  ixpk= 1446, nxpk= 10, iat=1041,1030, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   66 ASN  HD22         70 SER  HN          5.00    (#   1447:10  Preassigned    2.72, 4.11 A)
 &rst
  ixpk= 1447, nxpk= 10, iat= 986,1030, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50,  &end
#
#   70 SER  HA           70 SER  HN          3.50    (#   1448:10  Preassigned    2.60, 2.78 A)
 &rst
  ixpk= 1448, nxpk= 10, iat=1032,1030, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#    0 AMB  10-2:1461    13 SER  HN          5.00    (#   1461:10  Single Ambig)
 &rst
  ixpk= 1461, nxpk= 10, iat=  -1, 190, r1= 1.30, r2= 1.80, r3= 6.54, r4= 7.04,
 igr1= 617, 618, 205, 224, 225,
 &end
#
#    0 AMB  10-2:1469    28 SER  HN          5.00    (#   1469:10  Single Ambig)
 &rst
  ixpk= 1469, nxpk= 10, iat=  -1, 415, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,
 igr1= 400, 401,1161,
 &end
#
#   14 VAL  HN           13 SER  HN          6.00    (#   1470:10  Preassigned    3.44, 3.63 A)
 &rst
  ixpk= 1470, nxpk= 10, iat= 201, 190, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,  &end
#
#   14 VAL  HA           13 SER  HN          5.00    (#   1471:10  Unique         4.50, 4.76 A)
 &rst
  ixpk= 1471, nxpk= 10, iat= 203, 190, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50,  &end
#
#   38 ASP  QB           13 SER  HN          5.00    (#   1473:10  Unique         3.44, 4.54 A)
 &rst
  ixpk= 1473, nxpk= 10, iat=  -1, 190, r1= 1.30, r2= 1.80, r3= 5.61, r4= 6.11,
 igr1= 549, 550,
 &end
#
#   38 ASP  HN           13 SER  HN          3.50    (#   1474:10  Preassigned    3.34, 3.50 A)
 &rst
  ixpk= 1474, nxpk= 10, iat= 545, 190, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   37 ALA  HA           13 SER  HN          5.00    (#   1477:10  Unique         3.86, 4.13 A)
 &rst
  ixpk= 1477, nxpk= 10, iat= 537, 190, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50,  &end
#
#   12 PRO  HA           13 SER  HN          2.70    (#   1478:10  Unique         2.12, 2.18 A)
 &rst
  ixpk= 1478, nxpk= 10, iat= 186, 190, r1= 1.30, r2= 1.80, r3= 2.70, r4= 3.20,  &end
#
#   13 SER  HA           13 SER  HN          3.50    (#   1480:10  Unique         2.89, 2.94 A)
 &rst
  ixpk= 1480, nxpk= 10, iat= 192, 190, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   39 GLY  HA+          13 SER  HN          5.00    (#   1481:10  Unique         3.30, 3.75 A)
 &rst
  ixpk= 1481, nxpk= 10, iat=  -1, 190, r1= 1.30, r2= 1.80, r3= 5.61, r4= 6.11,
 igr1= 559, 560,
 &end
#
#   13 SER  QB           13 SER  HN          3.50    (#   1482:10  Unique         2.40, 3.03 A)
 &rst
  ixpk= 1482, nxpk= 10, iat=  -1, 190, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1= 194, 195,
 &end
#
#   39 GLY  HA-          13 SER  HN          5.00    (#   1483:10  Unique         3.30, 3.75 A)
 &rst
  ixpk= 1483, nxpk= 10, iat=  -1, 190, r1= 1.30, r2= 1.80, r3= 5.61, r4= 6.11,
 igr1= 559, 560,
 &end
#
#   12 PRO  HB-          13 SER  HN          5.00    (#   1484:10  Preassigned    3.70, 4.08 A)
 &rst
  ixpk= 1484, nxpk= 10, iat=  -1, 190, r1= 1.30, r2= 1.80, r3= 5.61, r4= 6.11,
 igr1= 183, 184,
 &end
#
#   12 PRO  HB+          13 SER  HN          5.00    (#   1485:10  Preassigned    3.70, 4.08 A)
 &rst
  ixpk= 1485, nxpk= 10, iat=  -1, 190, r1= 1.30, r2= 1.80, r3= 5.61, r4= 6.11,
 igr1= 183, 184,
 &end
#
#   37 ALA  MB           13 SER  HN          5.00    (#   1486:10  Unique         4.91, 5.95 A)
 &rst
  ixpk= 1486, nxpk= 10, iat=  -1, 190, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,
 igr1= 539, 540, 541,
 &end
#
#   29 GLN  HN           28 SER  HN          3.50    (#   1492:10  Unique         2.11, 2.97 A)
 &rst
  ixpk= 1492, nxpk= 10, iat= 426, 415, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   27 LEU  HN           28 SER  HN          3.50    (#   1493:10  Unique         2.50, 2.95 A)
 &rst
  ixpk= 1493, nxpk= 10, iat= 396, 415, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#    0 AMB  10-2:1495    28 SER  HN          3.50    (#   1495:10  Single Ambig)
 &rst
  ixpk= 1495, nxpk= 10, iat=  -1, 415, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1= 398, 384,
 &end
#
#   28 SER  HA           28 SER  HN          2.70    (#   1496:10  Preassigned    2.23, 2.53 A)
 &rst
  ixpk= 1496, nxpk= 10, iat= 417, 415, r1= 1.30, r2= 1.80, r3= 2.70, r4= 3.20,  &end
#
#   79 LYS  HN           80 SER  HN          3.50    (#   1497:10  Preassigned    2.74, 2.92 A)
 &rst
  ixpk= 1497, nxpk= 10, iat=1185,1207, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   81 ASP  HN           80 SER  HN          2.70    (#   1498:10  Unique         2.69, 2.73 A)
 &rst
  ixpk= 1498, nxpk= 10, iat=1218,1207, r1= 1.30, r2= 1.80, r3= 2.70, r4= 3.20,  &end
#
#   80 SER  HB2          80 SER  HN          3.50    (#   1499:10  Preassigned    3.41, 3.53 A)
 &rst
  ixpk= 1499, nxpk= 10, iat=1211,1207, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   80 SER  HB3          80 SER  HN          3.50    (#   1500:10  Preassigned    2.58, 2.63 A)
 &rst
  ixpk= 1500, nxpk= 10, iat=1212,1207, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   79 LYS  HA           80 SER  HN          5.00    (#   1501:10  Unique         3.48, 3.55 A)
 &rst
  ixpk= 1501, nxpk= 10, iat=1187,1207, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50,  &end
#
#   79 LYS  HB+          80 SER  HN          5.00    (#   1502:10  Preassigned    2.54, 3.37 A)
 &rst
  ixpk= 1502, nxpk= 10, iat=  -1,1207, r1= 1.30, r2= 1.80, r3= 5.61, r4= 6.11,
 igr1=1189,1190,
 &end
#
#   79 LYS  HB-          80 SER  HN          3.50    (#   1503:10  Preassigned    2.54, 3.37 A)
 &rst
  ixpk= 1503, nxpk= 10, iat=  -1,1207, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1=1189,1190,
 &end
#
#   82 GLU  HN           80 SER  HN          5.00    (#   1505:10  Preassigned    4.21, 4.29 A)
 &rst
  ixpk= 1505, nxpk= 10, iat=1230,1207, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50,  &end
#
#   78 ASP  HA           80 SER  HN          5.00    (#   1507:10  Unique         4.41, 4.56 A)
 &rst
  ixpk= 1507, nxpk= 10, iat=1175,1207, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50,  &end
#
#   80 SER  HA           80 SER  HN          3.50    (#   1508:10  Preassigned    2.77, 2.82 A)
 &rst
  ixpk= 1508, nxpk= 10, iat=1209,1207, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   78 ASP  HB-          80 SER  HN          5.00    (#   1509:10  Unique         2.53, 3.87 A)
 &rst
  ixpk= 1509, nxpk= 10, iat=  -1,1207, r1= 1.30, r2= 1.80, r3= 5.61, r4= 6.11,
 igr1=1177,1178,
 &end
#
#   63 TYR  QD           64 SER  HN          5.00    (#   1511:10  Preassigned    2.73, 4.12 A)
 &rst
  ixpk= 1511, nxpk= 10, iat=  -1, 945, r1= 1.30, r2= 1.80, r3= 5.61, r4= 6.11,
 igr1= 932, 941,
 &end
#
#   63 TYR  HA           64 SER  HN          2.70    (#   1512:10  Unique         2.45, 2.54 A)
 &rst
  ixpk= 1512, nxpk= 10, iat= 926, 945, r1= 1.30, r2= 1.80, r3= 2.70, r4= 3.20,  &end
#
#   64 SER  HB+          64 SER  HN          3.50    (#   1513:10  Unique         2.94, 3.49 A)
 &rst
  ixpk= 1513, nxpk= 10, iat=  -1, 945, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1= 949, 950,
 &end
#
#   64 SER  HB-          64 SER  HN          3.50    (#   1514:10  Unique         2.94, 3.49 A)
 &rst
  ixpk= 1514, nxpk= 10, iat=  -1, 945, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1= 949, 950,
 &end
#
#   63 TYR  QB           64 SER  HN          3.50    (#   1515:10  Unique         2.06, 2.89 A)
 &rst
  ixpk= 1515, nxpk= 10, iat=  -1, 945, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1= 928, 929,
 &end
#
#    0 AMB  10-2:1516     0 AMB  10-1:1516   3.50    (#   1516:10  Double Ambig)
 &rst
  ixpk= 1516, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.43, r4= 5.93,
 igr1=1079,1123,1124,1192,1193,1192,1193,
 igr2= 945,1207,
 &end
#
#   73 ILE  MD1          64 SER  HN          5.00    (#   1517:10  Preassigned    4.26, 5.11 A)
 &rst
  ixpk= 1517, nxpk= 10, iat=  -1, 945, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,
 igr1=1088,1089,1090,
 &end
#
#   72 LEU  MDY          64 SER  HN          5.00    (#   1518:10  Preassigned    3.53, 5.25 A)
 &rst
  ixpk= 1518, nxpk= 10, iat=  -1, 945, r1= 1.30, r2= 1.80, r3= 6.74, r4= 7.24,
 igr1=1065,1066,1067,1069,1070,1071,
 &end
#
#   73 ILE  MG2          64 SER  HN          5.00    (#   1530:10  Unique         4.43, 5.32 A)
 &rst
  ixpk= 1530, nxpk= 10, iat=  -1, 945, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,
 igr1=1081,1082,1083,
 &end
#
#    0 AMB  10-2:1531    30 SER  HN          6.00    (#   1531:10  Single Ambig)
 &rst
  ixpk= 1531, nxpk= 10, iat=  -1, 443, r1= 1.30, r2= 1.80, r3= 8.09, r4= 8.59,
 igr1= 464, 465, 466,1167,1168,1169,
 &end
#
#    0 AMB  10-2:1538    30 SER  HN          5.00    (#   1538:10  Single Ambig)
 &rst
  ixpk= 1538, nxpk= 10, iat=  -1, 443, r1= 1.30, r2= 1.80, r3= 5.61, r4= 6.11,
 igr1= 454, 426,
 &end
#
#   30 SER  HA           30 SER  HN          3.50    (#   1539:10  Unique         2.85, 2.94 A)
 &rst
  ixpk= 1539, nxpk= 10, iat= 445, 443, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   31 VAL  HA           30 SER  HN          5.00    (#   1540:10  Unique         4.20, 4.87 A)
 &rst
  ixpk= 1540, nxpk= 10, iat= 456, 443, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50,  &end
#
#   29 GLN  HA           30 SER  HN          2.70    (#   1541:10  Unique         2.16, 2.40 A)
 &rst
  ixpk= 1541, nxpk= 10, iat= 428, 443, r1= 1.30, r2= 1.80, r3= 2.70, r4= 3.20,  &end
#
#   30 SER  QB           30 SER  HN          3.50    (#   1543:10  Unique         2.63, 3.30 A)
 &rst
  ixpk= 1543, nxpk= 10, iat=  -1, 443, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1= 447, 448,
 &end
#
#   29 GLN  QG           30 SER  HN          3.50    (#   1544:10  Unique         2.04, 4.00 A)
 &rst
  ixpk= 1544, nxpk= 10, iat=  -1, 443, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1= 433, 434,
 &end
#
#    0 AMB  10-2:1545    30 SER  HN          2.70    (#   1545:10  Single Ambig)
 &rst
  ixpk= 1545, nxpk= 10, iat=  -1, 443, r1= 1.30, r2= 1.80, r3= 3.40, r4= 3.90,
 igr1= 430, 431, 430, 431,
 &end
#
#   17 ARG  HN           18 GLN  HN          5.00    (#   1546:10  Preassigned    2.57, 3.11 A)
 &rst
  ixpk= 1546, nxpk= 10, iat= 251, 275, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50,  &end
#
#   18 GLN  HA           18 GLN  HN          5.00    (#   1548:10  Unique         2.34, 2.84 A)
 &rst
  ixpk= 1548, nxpk= 10, iat= 277, 275, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50,  &end
#
#   17 ARG  HA           18 GLN  HN          5.00    (#   1549:10  Unique         2.23, 3.30 A)
 &rst
  ixpk= 1549, nxpk= 10, iat= 253, 275, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50,  &end
#
#   18 GLN  HB-          18 GLN  HN          3.50    (#   1550:10  Unique         2.24, 3.23 A)
 &rst
  ixpk= 1550, nxpk= 10, iat=  -1, 275, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1= 279, 280,
 &end
#
#   17 ARG  HB+          18 GLN  HN          5.00    (#   1551:10  Unique         2.03, 3.26 A)
 &rst
  ixpk= 1551, nxpk= 10, iat=  -1, 275, r1= 1.30, r2= 1.80, r3= 5.61, r4= 6.11,
 igr1= 255, 256,
 &end
#
#   17 ARG  HB-          18 GLN  HN          5.00    (#   1552:10  Unique         2.03, 3.26 A)
 &rst
  ixpk= 1552, nxpk= 10, iat=  -1, 275, r1= 1.30, r2= 1.80, r3= 5.61, r4= 6.11,
 igr1= 255, 256,
 &end
#
#   16 ALA  MB           18 GLN  HN          5.00    (#   1553:10  Preassigned    3.07, 4.70 A)
 &rst
  ixpk= 1553, nxpk= 10, iat=  -1, 275, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,
 igr1= 245, 246, 247,
 &end
#
#   93 ALA  HN           92 LYS  HN          3.50    (#   1558:10  Unique         2.91, 3.00 A)
 &rst
  ixpk= 1558, nxpk= 10, iat=1400,1378, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   91 ASN  HA           92 LYS  HN          3.50    (#   1560:10  Unique         2.45, 2.52 A)
 &rst
  ixpk= 1560, nxpk= 10, iat=1366,1378, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#    0 AMB  10-2:1561    92 LYS  HN          5.00    (#   1561:10  Single Ambig)
 &rst
  ixpk= 1561, nxpk= 10, iat=  -1,1378, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,
 igr1= 623,1402, 172,
 &end
#
#   92 LYS  HA           92 LYS  HN          5.00    (#   1562:10  Unique         2.71, 2.76 A)
 &rst
  ixpk= 1562, nxpk= 10, iat=1380,1378, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50,  &end
#
#    0 AMB  10-2:1563    92 LYS  HN          3.50    (#   1563:10  Single Ambig)
 &rst
  ixpk= 1563, nxpk= 10, iat=  -1,1378, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,
 igr1=1391,1392,1368,1369,
 &end
#
#   91 ASN  HB-          92 LYS  HN          3.50    (#   1564:10  Unique         2.32, 3.24 A)
 &rst
  ixpk= 1564, nxpk= 10, iat=  -1,1378, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1=1368,1369,
 &end
#
#    0 AMB  10-2:1565    92 LYS  HN          3.50    (#   1565:10  Single Ambig)
 &rst
  ixpk= 1565, nxpk= 10, iat=  -1,1378, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,
 igr1=1382,1383,1382,1383,
 &end
#
#   92 LYS  QG           92 LYS  HN          3.50    (#   1566:10  Unique         2.14, 3.32 A)
 &rst
  ixpk= 1566, nxpk= 10, iat=  -1,1378, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1=1385,1386,
 &end
#
#    0 AMB  10-2:1567    63 TYR  HN          5.00    (#   1567:10  Single Ambig)
 &rst
  ixpk= 1567, nxpk= 10, iat=  -1, 924, r1= 1.30, r2= 1.80, r3= 5.61, r4= 6.11,
 igr1= 945,1113,
 &end
#
#   61 GLU  HN           63 TYR  HN          5.00    (#   1568:10  Preassigned    4.58, 4.69 A)
 &rst
  ixpk= 1568, nxpk= 10, iat= 887, 924, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50,  &end
#
#   62 LYS  HN           63 TYR  HN          2.70    (#   1570:10  Unique         2.17, 2.59 A)
 &rst
  ixpk= 1570, nxpk= 10, iat= 902, 924, r1= 1.30, r2= 1.80, r3= 2.70, r4= 3.20,  &end
#
#   63 TYR  HA           63 TYR  HN          3.50    (#   1573:10  Unique         2.87, 2.91 A)
 &rst
  ixpk= 1573, nxpk= 10, iat= 926, 924, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   60 GLU  HA           63 TYR  HN          3.50    (#   1574:10  Unique         3.55, 3.62 A)
 &rst
  ixpk= 1574, nxpk= 10, iat= 874, 924, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   62 LYS  HA           63 TYR  HN          3.50    (#   1575:10  Unique         2.57, 2.65 A)
 &rst
  ixpk= 1575, nxpk= 10, iat= 904, 924, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#    0 AMB  10-2:1576    63 TYR  HN          3.50    (#   1576:10  Single Ambig)
 &rst
  ixpk= 1576, nxpk= 10, iat=  -1, 924, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,
 igr1= 928, 929, 879, 880,
 &end
#
#   62 LYS  HB+          63 TYR  HN          5.00    (#   1577:10  Preassigned    4.38, 4.58 A)
 &rst
  ixpk= 1577, nxpk= 10, iat=  -1, 924, r1= 1.30, r2= 1.80, r3= 5.61, r4= 6.11,
 igr1= 906, 907,
 &end
#
#   62 LYS  HB-          63 TYR  HN          5.00    (#   1578:10  Unique         4.38, 4.58 A)
 &rst
  ixpk= 1578, nxpk= 10, iat=  -1, 924, r1= 1.30, r2= 1.80, r3= 5.61, r4= 6.11,
 igr1= 906, 907,
 &end
#
#   90 GLU  HN           44 THR  HN          3.50    (#   1617:10  Preassigned    3.04, 3.18 A)
 &rst
  ixpk= 1617, nxpk= 10, iat=1349, 627, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   91 ASN  HA           44 THR  HN          3.50    (#   1618:10  Unique         3.56, 3.59 A)
 &rst
  ixpk= 1618, nxpk= 10, iat=1366, 627, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#    0 AMB  10-2:1619    44 THR  HN          2.70    (#   1619:10  Single Ambig)
 &rst
  ixpk= 1619, nxpk= 10, iat=  -1, 627, r1= 1.30, r2= 1.80, r3= 3.03, r4= 3.53,
 igr1= 623, 629,
 &end
#
#   44 THR  HB           44 THR  HN          3.50    (#   1621:10  Unique         2.42, 2.58 A)
 &rst
  ixpk= 1621, nxpk= 10, iat= 631, 627, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   91 ASN  HB-          44 THR  HN          5.00    (#   1622:10  Unique         2.92, 3.66 A)
 &rst
  ixpk= 1622, nxpk= 10, iat=  -1, 627, r1= 1.30, r2= 1.80, r3= 5.61, r4= 6.11,
 igr1=1368,1369,
 &end
#
#   43 PRO  QB           44 THR  HN          2.70    (#   1623:10  Unique         2.40, 2.99 A)
 &rst
  ixpk= 1623, nxpk= 10, iat=  -1, 627, r1= 1.30, r2= 1.80, r3= 3.03, r4= 3.53,
 igr1= 620, 621,
 &end
#
#    0 AMB  10-2:1624    44 THR  HN          3.50    (#   1624:10  Single Ambig)
 &rst
  ixpk= 1624, nxpk= 10, iat=  -1, 627, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,
 igr1= 180, 181, 617, 618, 183, 184,
 &end
#
#    0 AMB  10-2:1641    44 THR  HN          5.00    (#   1641:10  Single Ambig)
 &rst
  ixpk= 1641, nxpk= 10, iat=  -1, 627, r1= 1.30, r2= 1.80, r3= 5.61, r4= 6.11,
 igr1=1341,1351,
 &end
#
#   13 SER  HA           15 ARG  HE          5.00    (#   1658:10  Unique         3.88, 4.69 A)
 &rst
  ixpk= 1658, nxpk= 10, iat= 192, 230, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50,  &end
#
#   93 ALA  HN           94 GLY  HN          2.70    (#   1661:10  Preassigned    2.26, 2.43 A)
 &rst
  ixpk= 1661, nxpk= 10, iat=1400,1410, r1= 1.30, r2= 1.80, r3= 2.70, r4= 3.20,  &end
#
#   17 ARG  HD-          17 ARG  HE          3.50    (#   1664:10  Unique         2.20, 2.68 A)
 &rst
  ixpk= 1664, nxpk= 10, iat=  -1, 264, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1= 261, 262,
 &end
#
#   17 ARG  HB+          17 ARG  HE          5.00    (#   1665:10  Unique         2.10, 3.38 A)
 &rst
  ixpk= 1665, nxpk= 10, iat=  -1, 264, r1= 1.30, r2= 1.80, r3= 5.61, r4= 6.11,
 igr1= 255, 256,
 &end
#
#   17 ARG  QG           17 ARG  HE          3.50    (#   1666:10  Unique         2.18, 3.42 A)
 &rst
  ixpk= 1666, nxpk= 10, iat=  -1, 264, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1= 258, 259,
 &end
#
#   71 GLU  HN           17 ARG  HE          5.00    (#   1667:10  Unique         4.59, 5.03 A)
 &rst
  ixpk= 1667, nxpk= 10, iat=1041, 264, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50,  &end
#
#   17 ARG  HD+          17 ARG  HE          3.50    (#   1668:10  Unique         2.20, 2.68 A)
 &rst
  ixpk= 1668, nxpk= 10, iat=  -1, 264, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1= 261, 262,
 &end
#
#   17 ARG  HB-          17 ARG  HE          3.50    (#   1669:10  Unique         2.10, 3.38 A)
 &rst
  ixpk= 1669, nxpk= 10, iat=  -1, 264, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1= 255, 256,
 &end
#
#   34 ALA  MB           17 ARG  HE          5.00    (#   1670:10  Unique         2.06, 2.61 A)
 &rst
  ixpk= 1670, nxpk= 10, iat=  -1, 264, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,
 igr1= 507, 508, 509,
 &end
#
#   59 ASN  HB+          59 ASN  HD21        5.00    (#   1675:10  Unique         2.29, 3.56 A)
 &rst
  ixpk= 1675, nxpk= 10, iat=  -1, 867, r1= 1.30, r2= 1.80, r3= 5.61, r4= 6.11,
 igr1= 862, 863,
 &end
#
#   59 ASN  HB-          59 ASN  HD21        5.00    (#   1676:10  Unique         2.29, 3.56 A)
 &rst
  ixpk= 1676, nxpk= 10, iat=  -1, 867, r1= 1.30, r2= 1.80, r3= 5.61, r4= 6.11,
 igr1= 862, 863,
 &end
#
#   15 ARG  QD           15 ARG  HE          5.00    (#   1678:10  Preassigned    2.22, 2.71 A)
 &rst
  ixpk= 1678, nxpk= 10, iat=  -1, 230, r1= 1.30, r2= 1.80, r3= 5.61, r4= 6.11,
 igr1= 227, 228,
 &end
#
#   59 ASN  HB+          59 ASN  HD22        5.00    (#   1682:10  Unique         2.29, 3.01 A)
 &rst
  ixpk= 1682, nxpk= 10, iat=  -1, 868, r1= 1.30, r2= 1.80, r3= 5.61, r4= 6.11,
 igr1= 862, 863,
 &end
#
#   59 ASN  HB-          59 ASN  HD22        5.00    (#   1683:10  Unique         2.29, 3.01 A)
 &rst
  ixpk= 1683, nxpk= 10, iat=  -1, 868, r1= 1.30, r2= 1.80, r3= 5.61, r4= 6.11,
 igr1= 862, 863,
 &end
#
#    0 AMB  10-2:1690    26 ASN  HD21        6.00    (#   1690:10  Single Ambig)
 &rst
  ixpk= 1690, nxpk= 10, iat=  -1, 391, r1= 1.30, r2= 1.80, r3= 7.56, r4= 8.06,
 igr1= 386, 387,1621,1622,
 &end
#
#    0 AMB  10-2:1695    26 ASN  HD21        5.00    (#   1695:10  Single Ambig)
 &rst
  ixpk= 1695, nxpk= 10, iat=  -1, 391, r1= 1.30, r2= 1.80, r3= 6.30, r4= 6.80,
 igr1= 386, 387,1621,1622,
 &end
#
#    0 AMB  10-2:1702    26 ASN  HD22        5.00    (#   1702:10  Single Ambig)
 &rst
  ixpk= 1702, nxpk= 10, iat=  -1, 392, r1= 1.30, r2= 1.80, r3= 6.30, r4= 6.80,
 igr1= 386, 387,1621,1622,
 &end
#
#   25 ALA  MB           26 ASN  HD22        5.00    (#   1703:10  Unique         4.27, 5.80 A)
 &rst
  ixpk= 1703, nxpk= 10, iat=  -1, 392, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,
 igr1= 376, 377, 378,
 &end
#
#    0 AMB  10-2:1741    26 ASN  HN          5.00    (#   1741:10  Single Ambig)
 &rst
  ixpk= 1741, nxpk= 10, iat=  -1, 382, r1= 1.30, r2= 1.80, r3= 7.21, r4= 7.71,
 igr1=1568,1569,1570,1572,1573,1574,1163,1164,1165,
 &end
#
#   27 LEU  HN           26 ASN  HN          3.50    (#   1742:10  Unique         2.80, 3.12 A)
 &rst
  ixpk= 1742, nxpk= 10, iat= 396, 382, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   26 ASN  HA           26 ASN  HN          2.70    (#   1743:10  Unique         2.18, 2.31 A)
 &rst
  ixpk= 1743, nxpk= 10, iat= 384, 382, r1= 1.30, r2= 1.80, r3= 2.70, r4= 3.20,  &end
#
#   25 ALA  HA           26 ASN  HN          3.50    (#   1744:10  Unique         2.07, 2.35 A)
 &rst
  ixpk= 1744, nxpk= 10, iat= 374, 382, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   26 ASN  HB-          26 ASN  HN          5.00    (#   1745:10  Unique         2.40, 3.40 A)
 &rst
  ixpk= 1745, nxpk= 10, iat=  -1, 382, r1= 1.30, r2= 1.80, r3= 5.61, r4= 6.11,
 igr1= 386, 387,
 &end
#
#   25 ALA  MB           26 ASN  HN          3.50    (#   1746:10  Unique         2.00, 3.22 A)
 &rst
  ixpk= 1746, nxpk= 10, iat=  -1, 382, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
 igr1= 376, 377, 378,
 &end
#
#  100 ILE  HN           99 THR  HN          5.00    (#   1748:10  Unique         4.27, 4.32 A)
 &rst
  ixpk= 1748, nxpk= 10, iat=1485,1471, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50,  &end
#
#   98 ALA  HN           99 THR  HN          5.00    (#   1749:10  Unique         4.34, 4.36 A)
 &rst
  ixpk= 1749, nxpk= 10, iat=1461,1471, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50,  &end
#
#   22 ASN  QB           22 ASN  HD21        5.00    (#   1755:10  Unique         3.90, 4.00 A)
 &rst
  ixpk= 1755, nxpk= 10, iat=  -1, 343, r1= 1.30, r2= 1.80, r3= 5.61, r4= 6.11,
 igr1= 338, 339,
 &end
#
#    0 AMB  10-2:1759    22 ASN  HD22        5.00    (#   1759:10  Single Ambig)
 &rst
  ixpk= 1759, nxpk= 10, iat=  -1, 344, r1= 1.30, r2= 1.80, r3= 7.07, r4= 7.57,
 igr1=1547,1548, 309, 310, 311, 352, 353, 354,
 &end
#
#   99 THR  HA           99 THR  HN          3.50    (#   1769:10  Unique         2.92, 2.93 A)
 &rst
  ixpk= 1769, nxpk= 10, iat=1473,1471, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   98 ALA  HA           99 THR  HN          2.70    (#   1771:10  Unique         2.73, 2.77 A)
 &rst
  ixpk= 1771, nxpk= 10, iat=1463,1471, r1= 1.30, r2= 1.80, r3= 2.70, r4= 3.20,  &end
#
#   99 THR  HB           99 THR  HN          2.70    (#   1772:10  Unique         2.75, 2.78 A)
 &rst
  ixpk= 1772, nxpk= 10, iat=1475,1471, r1= 1.30, r2= 1.80, r3= 2.70, r4= 3.20,  &end
#
#   98 ALA  MB           99 THR  HN          3.50    (#   1773:10  Unique         2.10, 3.03 A)
 &rst
  ixpk= 1773, nxpk= 10, iat=  -1,1471, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
 igr1=1465,1466,1467,
 &end
#
#   16 ALA  MB           99 THR  HN          5.00    (#   1774:10  Unique         2.58, 3.77 A)
 &rst
  ixpk= 1774, nxpk= 10, iat=  -1,1471, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,
 igr1= 245, 246, 247,
 &end
#
#   99 THR  MG2          99 THR  HN          5.00    (#   1775:10  Preassigned    4.47, 4.81 A)
 &rst
  ixpk= 1775, nxpk= 10, iat=  -1,1471, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,
 igr1=1477,1478,1479,
 &end
#
#   96 GLN  HG-          96 GLN  HE22        5.00    (#   1780:10  Unique         2.29, 3.34 A)
 &rst
  ixpk= 1780, nxpk= 10, iat=  -1,1445, r1= 1.30, r2= 1.80, r3= 5.61, r4= 6.11,
 igr1=1439,1440,
 &end
#
#   96 GLN  HG+          96 GLN  HE21        3.50    (#   1792:10  Unique         2.78, 3.78 A)
 &rst
  ixpk= 1792, nxpk= 10, iat=  -1,1444, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1=1439,1440,
 &end
#
#   96 GLN  HG-          96 GLN  HE21        5.00    (#   1793:10  Unique         2.78, 3.78 A)
 &rst
  ixpk= 1793, nxpk= 10, iat=  -1,1444, r1= 1.30, r2= 1.80, r3= 5.61, r4= 6.11,
 igr1=1439,1440,
 &end
#
#   96 GLN  HB+          96 GLN  HE21        6.00    (#   1794:10  Unique         2.02, 4.01 A)
 &rst
  ixpk= 1794, nxpk= 10, iat=  -1,1444, r1= 1.30, r2= 1.80, r3= 6.73, r4= 7.23,
 igr1=1436,1437,
 &end
#
#    0 AMB  10-2:1812    56 GLN  HE21        5.00    (#   1812:10  Single Ambig)
 &rst
  ixpk= 1812, nxpk= 10, iat=  -1, 826, r1= 1.30, r2= 1.80, r3= 6.30, r4= 6.80,
 igr1= 648, 649, 821, 822,
 &end
#
#    0 AMB  10-2:1813    56 GLN  HE21        3.50    (#   1813:10  Single Ambig)
 &rst
  ixpk= 1813, nxpk= 10, iat=  -1, 826, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,
 igr1= 648, 649, 821, 822,
 &end
#
#   56 GLN  HG+          56 GLN  HE22        5.00    (#   1816:10  Unique         2.34, 3.01 A)
 &rst
  ixpk= 1816, nxpk= 10, iat=  -1, 827, r1= 1.30, r2= 1.80, r3= 5.61, r4= 6.11,
 igr1= 821, 822,
 &end
#
#    0 AMB  10-2:1825    18 GLN  HE21        6.00    (#   1825:10  Single Ambig)
 &rst
  ixpk= 1825, nxpk= 10, iat=  -1, 287, r1= 1.30, r2= 1.80, r3= 7.56, r4= 8.06,
 igr1= 282, 283, 282, 283,
 &end
#
#   18 GLN  HA           18 GLN  HE22        5.00    (#   1828:10  Unique         2.10, 4.23 A)
 &rst
  ixpk= 1828, nxpk= 10, iat= 277, 288, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50,  &end
#
#   29 GLN  HB+          29 GLN  HE22        5.00    (#   1829:10  Unique         2.04, 3.62 A)
 &rst
  ixpk= 1829, nxpk= 10, iat=  -1, 439, r1= 1.30, r2= 1.80, r3= 5.61, r4= 6.11,
 igr1= 430, 431,
 &end
#
#    0 AMB  10-2:1830     0 AMB  10-1:1830   5.00    (#   1830:10  Double Ambig)
 &rst
  ixpk= 1830, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.30, r4= 6.80,
 igr1= 319, 360,
 igr2= 288, 439,
 &end
#
#   29 GLN  QG           29 GLN  HE21        3.50    (#   1837:10  Unique         3.48, 3.82 A)
 &rst
  ixpk= 1837, nxpk= 10, iat=  -1, 438, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1= 433, 434,
 &end
#
#   29 GLN  QG           29 GLN  HE22        5.00    (#   1841:10  Unique         2.21, 2.94 A)
 &rst
  ixpk= 1841, nxpk= 10, iat=  -1, 439, r1= 1.30, r2= 1.80, r3= 5.61, r4= 6.11,
 igr1= 433, 434,
 &end
#
#    0 AMB  10-2:1844    29 GLN  HE22        5.00    (#   1844:10  Single Ambig)
 &rst
  ixpk= 1844, nxpk= 10, iat=  -1, 439, r1= 1.30, r2= 1.80, r3= 7.57, r4= 8.07,
 igr1= 405, 406, 407, 409, 410, 411, 405, 406, 407, 409,
       410, 411,
 &end
#
#   71 GLU  QB           66 ASN  HD21        5.00    (#   1849:10  Unique         2.59, 4.05 A)
 &rst
  ixpk= 1849, nxpk= 10, iat=  -1, 985, r1= 1.30, r2= 1.80, r3= 5.61, r4= 6.11,
 igr1=1045,1046,
 &end
#
#   71 GLU  HN           66 ASN  HD22        5.00    (#   1856:10  Unique         2.31, 3.07 A)
 &rst
  ixpk= 1856, nxpk= 10, iat=1041, 986, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50,  &end
#
#   48 THR  MG2          48 THR  HN          3.50    (#   1883:10  Preassigned    2.70, 3.75 A)
 &rst
  ixpk= 1883, nxpk= 10, iat=  -1, 696, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
 igr1= 702, 703, 704,
 &end
#
#   85 TYR  HA           48 THR  HN          5.00    (#   1884:10  Unique         3.49, 3.70 A)
 &rst
  ixpk= 1884, nxpk= 10, iat=1272, 696, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50,  &end
#
#   48 THR  HA           48 THR  HN          5.00    (#   1885:10  Unique         2.95, 2.97 A)
 &rst
  ixpk= 1885, nxpk= 10, iat= 698, 696, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50,  &end
#
#    0 AMB  10-2:1886    48 THR  HN          3.50    (#   1886:10  Single Ambig)
 &rst
  ixpk= 1886, nxpk= 10, iat=  -1, 696, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
 igr1= 676,1274,1275,
 &end
#
#   47 TRP  HB3          48 THR  HN          5.00    (#   1893:10  Unique         3.39, 3.53 A)
 &rst
  ixpk= 1893, nxpk= 10, iat= 677, 696, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50,  &end
#
#   49 LYS  HN           48 THR  HN          5.00    (#   1894:10  Unique         4.16, 4.28 A)
 &rst
  ixpk= 1894, nxpk= 10, iat= 710, 696, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50,  &end
#
#    0 AMB  10-2:1895    48 THR  HN          5.00    (#   1895:10  Single Ambig)
 &rst
  ixpk= 1895, nxpk= 10, iat=  -1, 696, r1= 1.30, r2= 1.80, r3= 5.61, r4= 6.11,
 igr1= 672,1320,
 &end
#
#    0 AMB  10-2:1896    48 THR  HN          3.50    (#   1896:10  Single Ambig)
 &rst
  ixpk= 1896, nxpk= 10, iat=  -1, 696, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1=1291, 744,
 &end
#
#   47 TRP  HA           48 THR  HN          3.50    (#   1897:10  Unique         2.17, 2.29 A)
 &rst
  ixpk= 1897, nxpk= 10, iat= 674, 696, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#    0 AMB  10-2:1899    48 THR  HN          5.00    (#   1899:10  Single Ambig)
 &rst
  ixpk= 1899, nxpk= 10, iat=  -1, 696, r1= 1.30, r2= 1.80, r3= 5.61, r4= 6.11,
 igr1=1312, 712,
 &end
#
#    0 AMB  10-2:1900    48 THR  HN          5.00    (#   1900:10  Single Ambig)
 &rst
  ixpk= 1900, nxpk= 10, iat=  -1, 696, r1= 1.30, r2= 1.80, r3= 5.61, r4= 6.11,
 igr1=1295, 784,
 &end
#
#    0 AMB  10-2:1901    48 THR  HN          3.50    (#   1901:10  Single Ambig)
 &rst
  ixpk= 1901, nxpk= 10, iat=  -1, 696, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 793, 794, 795,1333,1334,1335,1297,1298,1299,
 &end
#
#    0 AMB  10-2:1926     9 ASN  HD21        3.50    (#   1926:10  Single Ambig)
 &rst
  ixpk= 1926, nxpk= 10, iat=  -1, 141, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,
 igr1= 136, 137,  37,  38,
 &end
#
#   93 ALA  MB            9 ASN  HD22        5.00    (#   1934:10  Unique         3.32, 5.17 A)
 &rst
  ixpk= 1934, nxpk= 10, iat=  -1, 142, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,
 igr1=1404,1405,1406,
 &end
#
#   68 ASP  HA           69 GLY  HN          5.00    (#   2035:10  Unique         3.25, 3.49 A)
 &rst
  ixpk= 2035, nxpk= 10, iat=1013,1023, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50,  &end
#
#   69 GLY  HA-          69 GLY  HN          3.50    (#   2036:10  Unique         2.20, 2.57 A)
 &rst
  ixpk= 2036, nxpk= 10, iat=  -1,1023, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1=1025,1026,
 &end
#
#   70 SER  HN           69 GLY  HN          5.00    (#   2045:10  Preassigned    2.31, 2.99 A)
 &rst
  ixpk= 2045, nxpk= 10, iat=1030,1023, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50,  &end
#
#   69 GLY  HA+          69 GLY  HN          5.00    (#   2048:10  Unique         2.20, 2.57 A)
 &rst
  ixpk= 2048, nxpk= 10, iat=  -1,1023, r1= 1.30, r2= 1.80, r3= 5.61, r4= 6.11,
 igr1=1025,1026,
 &end
#
#    0 AMB  10-2:2056    91 ASN  HD21        5.00    (#   2056:10  Single Ambig)
 &rst
  ixpk= 2056, nxpk= 10, iat=  -1,1373, r1= 1.30, r2= 1.80, r3= 6.30, r4= 6.80,
 igr1=1368,1369, 568, 569,
 &end
#
#   40 PHE  HN           91 ASN  HD22        5.00    (#   2058:10  Preassigned    2.83, 3.03 A)
 &rst
  ixpk= 2058, nxpk= 10, iat= 564,1374, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50,  &end
#
#   40 PHE  HN           91 ASN  HD21        5.00    (#   2061:10  Unique         2.11, 2.28 A)
 &rst
  ixpk= 2061, nxpk= 10, iat= 564,1373, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50,  &end
#
#   91 ASN  HB+          91 ASN  HD22        6.00    (#   2064:10  Unique         2.45, 2.63 A)
 &rst
  ixpk= 2064, nxpk= 10, iat=  -1,1374, r1= 1.30, r2= 1.80, r3= 6.73, r4= 7.23,
 igr1=1368,1369,
 &end
#
#   95 GLU  HN           94 GLY  HN          5.00    (#   2084:10  Preassigned    4.26, 4.32 A)
 &rst
  ixpk= 2084, nxpk= 10, iat=1417,1410, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50,  &end
#
#   90 GLU  HA           94 GLY  HN          6.00    (#   2085:10  Unique         4.55, 4.68 A)
 &rst
  ixpk= 2085, nxpk= 10, iat=1351,1410, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,  &end
#
#    0 AMB  10-2:2091    94 GLY  HN          5.00    (#   2091:10  Single Ambig)
 &rst
  ixpk= 2091, nxpk= 10, iat=  -1,1410, r1= 1.30, r2= 1.80, r3= 7.07, r4= 7.57,
 igr1= 169, 170, 166, 167,1424,1425,1356,1357,
 &end
#
#    0 AMB  10-2:2092    94 GLY  HN          6.00    (#   2092:10  Single Ambig)
 &rst
  ixpk= 2092, nxpk= 10, iat=  -1,1410, r1= 1.30, r2= 1.80, r3= 8.09, r4= 8.59,
 igr1= 180, 181, 183, 184,1382,1383,
 &end
#
#   91 ASN  HN           94 GLY  HN          3.50    (#   2093:10  Preassigned    2.85, 2.91 A)
 &rst
  ixpk= 2093, nxpk= 10, iat=1364,1410, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#    0 AMB  10-2:2095    94 GLY  HN          3.50    (#   2095:10  Single Ambig)
 &rst
  ixpk= 2095, nxpk= 10, iat=  -1,1410, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1= 172,1402,
 &end
#
#   94 GLY  HA+          94 GLY  HN          3.50    (#   2096:10  Unique         2.75, 2.82 A)
 &rst
  ixpk= 2096, nxpk= 10, iat=  -1,1410, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1=1412,1413,
 &end
#
#   92 LYS  HA           94 GLY  HN          5.00    (#   2097:10  Unique         4.04, 4.35 A)
 &rst
  ixpk= 2097, nxpk= 10, iat=1380,1410, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50,  &end
#
#   94 GLY  HA-          94 GLY  HN          3.50    (#   2098:10  Unique         2.75, 2.82 A)
 &rst
  ixpk= 2098, nxpk= 10, iat=  -1,1410, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1=1412,1413,
 &end
#
#   12 PRO  HD+          94 GLY  HN          5.00    (#   2099:10  Unique         2.51, 3.25 A)
 &rst
  ixpk= 2099, nxpk= 10, iat=  -1,1410, r1= 1.30, r2= 1.80, r3= 5.61, r4= 6.11,
 igr1= 177, 178,
 &end
#
#   12 PRO  HD-          94 GLY  HN          5.00    (#   2100:10  Unique         2.51, 3.25 A)
 &rst
  ixpk= 2100, nxpk= 10, iat=  -1,1410, r1= 1.30, r2= 1.80, r3= 5.61, r4= 6.11,
 igr1= 177, 178,
 &end
#
#   93 ALA  MB           94 GLY  HN          3.50    (#   2101:10  Unique         2.73, 3.78 A)
 &rst
  ixpk= 2101, nxpk= 10, iat=  -1,1410, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
 igr1=1404,1405,1406,
 &end
#
#   43 PRO  HD+          39 GLY  HN          3.50    (#   2151:10  Unique         2.23, 3.16 A)
 &rst
  ixpk= 2151, nxpk= 10, iat=  -1, 557, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1= 614, 615,
 &end
#
#   10 VAL  MG1          39 GLY  HN          5.00    (#   2160:10  Preassigned    5.06, 6.06 A)
 &rst
  ixpk= 2160, nxpk= 10, iat=  -1, 557, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,
 igr1= 152, 153, 154,
 &end
#
#   38 ASP  HN           39 GLY  HN          5.00    (#   2161:10  Unique         4.27, 4.36 A)
 &rst
  ixpk= 2161, nxpk= 10, iat= 545, 557, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50,  &end
#
#   40 PHE  HN           39 GLY  HN          5.00    (#   2162:10  Preassigned    4.30, 4.34 A)
 &rst
  ixpk= 2162, nxpk= 10, iat= 564, 557, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50,  &end
#
#   38 ASP  HA           39 GLY  HN          2.70    (#   2164:10  Unique         1.99, 2.14 A)
 &rst
  ixpk= 2164, nxpk= 10, iat= 547, 557, r1= 1.30, r2= 1.80, r3= 2.70, r4= 3.20,  &end
#
#   42 GLU  HA           39 GLY  HN          5.00    (#   2165:10  Unique         3.43, 4.40 A)
 &rst
  ixpk= 2165, nxpk= 10, iat= 600, 557, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50,  &end
#
#   39 GLY  HA+          39 GLY  HN          3.50    (#   2166:10  Preassigned    2.59, 2.79 A)
 &rst
  ixpk= 2166, nxpk= 10, iat=  -1, 557, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1= 559, 560,
 &end
#
#   39 GLY  HA-          39 GLY  HN          3.50    (#   2167:10  Preassigned    2.59, 2.79 A)
 &rst
  ixpk= 2167, nxpk= 10, iat=  -1, 557, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1= 559, 560,
 &end
#
#   38 ASP  QB           39 GLY  HN          3.50    (#   2169:10  Preassigned    3.57, 4.07 A)
 &rst
  ixpk= 2169, nxpk= 10, iat=  -1, 557, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1= 549, 550,
 &end
#
#   78 ASP  HB+          78 ASP  HN          5.00    (#   2185:10  Unique         3.00, 3.45 A)
 &rst
  ixpk= 2185, nxpk= 10, iat=  -1,1173, r1= 1.30, r2= 1.80, r3= 5.61, r4= 6.11,
 igr1=1177,1178,
 &end
#
#    0 AMB  10-2:2187    78 ASP  HN          3.50    (#   2187:10  Single Ambig)
 &rst
  ixpk= 2187, nxpk= 10, iat=  -1,1173, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1=1163,1164,1165,1568,1569,1570,1572,1573,1574,
 &end
#
#   81 ASP  HB-          78 ASP  HN          6.00    (#   2188:10  Unique         2.33, 3.30 A)
 &rst
  ixpk= 2188, nxpk= 10, iat=  -1,1173, r1= 1.30, r2= 1.80, r3= 6.73, r4= 7.23,
 igr1=1222,1223,
 &end
#
#   73 ILE  MD1          33 LEU  HN          6.00    (#   2193:10  Preassigned    5.01, 6.18 A)
 &rst
  ixpk= 2193, nxpk= 10, iat=  -1, 484, r1= 1.30, r2= 1.80, r3= 7.21, r4= 7.71,
 igr1=1088,1089,1090,
 &end
#
#   72 LEU  HN           33 LEU  HN          3.50    (#   2194:10  Preassigned    2.88, 2.97 A)
 &rst
  ixpk= 2194, nxpk= 10, iat=1056, 484, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#    0 AMB  10-2:2202    49 LYS  HN          5.00    (#   2202:10  Single Ambig)
 &rst
  ixpk= 2202, nxpk= 10, iat=  -1, 710, r1= 1.30, r2= 1.80, r3= 6.54, r4= 7.04,
 igr1= 756, 770, 771,1259,1260,
 &end
#
#    0 AMB  10-2:2203    49 LYS  HN          6.00    (#   2203:10  Single Ambig)
 &rst
  ixpk= 2203, nxpk= 10, iat=  -1, 710, r1= 1.30, r2= 1.80, r3= 6.73, r4= 7.23,
 igr1= 744,1291,
 &end
#
#    0 AMB  10-2:2204    89 ALA  HN          5.00    (#   2204:10  Single Ambig)
 &rst
  ixpk= 2204, nxpk= 10, iat=  -1,1339, r1= 1.30, r2= 1.80, r3= 5.61, r4= 6.11,
 igr1=1324, 205,
 &end
#
#    0 AMB  10-2:2205    89 ALA  HN          5.00    (#   2205:10  Single Ambig)
 &rst
  ixpk= 2205, nxpk= 10, iat=  -1,1339, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,
 igr1=1453,1454,1314,
 &end
#
#   97 ASP  HB+          89 ALA  HN          5.00    (#   2206:10  Unique         3.78, 4.36 A)
 &rst
  ixpk= 2206, nxpk= 10, iat=  -1,1339, r1= 1.30, r2= 1.80, r3= 5.61, r4= 6.11,
 igr1=1453,1454,
 &end
#
#    0 AMB  10-2:2207    91 ASN  HN          2.70    (#   2207:10  Single Ambig)
 &rst
  ixpk= 2207, nxpk= 10, iat=  -1,1364, r1= 1.30, r2= 1.80, r3= 3.64, r4= 4.14,
 igr1= 180, 181,1353,1354, 183, 184,
 &end
#
#   12 PRO  HD-          91 ASN  HN          5.00    (#   2208:10  Unique         3.00, 3.46 A)
 &rst
  ixpk= 2208, nxpk= 10, iat=  -1,1364, r1= 1.30, r2= 1.80, r3= 5.61, r4= 6.11,
 igr1= 177, 178,
 &end
#
#    0 AMB  10-2:2209    91 ASN  HN          5.00    (#   2209:10  Single Ambig)
 &rst
  ixpk= 2209, nxpk= 10, iat=  -1,1364, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,
 igr1= 172, 623,1402,
 &end
#
#   87 CYS  HN           88 ILE  HN          5.00    (#   2210:10  Unique         4.23, 4.35 A)
 &rst
  ixpk= 2210, nxpk= 10, iat=1310,1320, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50,  &end
#
#   45 MET  HA           88 ILE  HN          5.00    (#   2211:10  Unique         4.66, 4.84 A)
 &rst
  ixpk= 2211, nxpk= 10, iat= 643,1320, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50,  &end
#
#   88 ILE  HB           88 ILE  HN          3.50    (#   2212:10  Unique         2.50, 2.59 A)
 &rst
  ixpk= 2212, nxpk= 10, iat=1324,1320, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   15 ARG  HA           16 ALA  HN          2.70    (#   2213:10  Unique         2.05, 2.19 A)
 &rst
  ixpk= 2213, nxpk= 10, iat= 219, 241, r1= 1.30, r2= 1.80, r3= 2.70, r4= 3.20,  &end
#
#   55 GLU  HA           47 TRP  HN          5.00    (#   2216:10  Unique         2.97, 3.51 A)
 &rst
  ixpk= 2216, nxpk= 10, iat= 801, 672, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50,  &end
#
#    0 AMB  10-2:2217    47 TRP  HN          5.00    (#   2217:10  Single Ambig)
 &rst
  ixpk= 2217, nxpk= 10, iat=  -1, 672, r1= 1.30, r2= 1.80, r3= 6.54, r4= 7.04,
 igr1= 702, 703, 704, 790, 791,
 &end
#
#   48 THR  HN           47 TRP  HN          5.00    (#   2219:10  Unique         4.30, 4.38 A)
 &rst
  ixpk= 2219, nxpk= 10, iat= 696, 672, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50,  &end
#
#   78 ASP  HB-          79 LYS  HN          3.50    (#   2221:10  Unique         2.11, 3.17 A)
 &rst
  ixpk= 2221, nxpk= 10, iat=  -1,1185, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1=1177,1178,
 &end
#
#   81 ASP  HN           79 LYS  HN          5.00    (#   2222:10  Unique         4.20, 4.39 A)
 &rst
  ixpk= 2222, nxpk= 10, iat=1218,1185, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50,  &end
#
#  104 VAL  MGX          79 LYS  HN          5.00    (#   2224:10  Unique         3.50, 5.33 A)
 &rst
  ixpk= 2224, nxpk= 10, iat=  -1,1185, r1= 1.30, r2= 1.80, r3= 6.74, r4= 7.24,
 igr1=1568,1569,1570,1572,1573,1574,
 &end
#
#  104 VAL  MGX          79 LYS  HN          5.00    (#   2225:10  Unique         3.50, 5.33 A)
 &rst
  ixpk= 2225, nxpk= 10, iat=  -1,1185, r1= 1.30, r2= 1.80, r3= 6.74, r4= 7.24,
 igr1=1568,1569,1570,1572,1573,1574,
 &end
#
#  104 VAL  HA          105 PHE  HN          2.70    (#   2226:10  Preassigned    2.25, 2.29 A)
 &rst
  ixpk= 2226, nxpk= 10, iat=1564,1578, r1= 1.30, r2= 1.80, r3= 2.70, r4= 3.20,  &end
#
#    0 AMB  10-2:2227    42 GLU  HN          5.00    (#   2227:10  Single Ambig)
 &rst
  ixpk= 2227, nxpk= 10, iat=  -1, 598, r1= 1.30, r2= 1.80, r3= 6.30, r4= 6.80,
 igr1= 614, 615, 559, 560,
 &end
#
#    0 AMB  10-2:2228    42 GLU  HN          3.50    (#   2228:10  Single Ambig)
 &rst
  ixpk= 2228, nxpk= 10, iat=  -1, 598, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,
 igr1= 605, 606, 605, 606,
 &end
#
#   41 PRO  QG           42 GLU  HN          5.00    (#   2229:10  Unique         4.26, 4.88 A)
 &rst
  ixpk= 2229, nxpk= 10, iat=  -1, 598, r1= 1.30, r2= 1.80, r3= 5.61, r4= 6.11,
 igr1= 588, 589,
 &end
#
#    0 AMB  10-2:2230    96 GLN  HN          3.50    (#   2230:10  Single Ambig)
 &rst
  ixpk= 2230, nxpk= 10, iat=  -1,1432, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,
 igr1=1436,1437,1421,1422,1421,1422,
 &end
#
#  103 LYS  HB+         103 LYS  HN          3.50    (#   2232:10  Unique         2.40, 3.20 A)
 &rst
  ixpk= 2232, nxpk= 10, iat=  -1,1540, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1=1544,1545,
 &end
#
#   36 ASP  HN           17 ARG  HN          5.00    (#   2233:10  Preassigned    2.38, 3.21 A)
 &rst
  ixpk= 2233, nxpk= 10, iat= 523, 251, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50,  &end
#
#   36 ASP  HB3          17 ARG  HN          5.00    (#   2234:10  Preassigned    4.47, 4.97 A)
 &rst
  ixpk= 2234, nxpk= 10, iat= 528, 251, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50,  &end
#
#   18 GLN  HN           17 ARG  HN          3.50    (#   2235:10  Unique         2.57, 3.11 A)
 &rst
  ixpk= 2235, nxpk= 10, iat= 275, 251, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   16 ALA  MB           17 ARG  HN          3.50    (#   2236:10  Preassigned    3.38, 4.26 A)
 &rst
  ixpk= 2236, nxpk= 10, iat=  -1, 251, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
 igr1= 245, 246, 247,
 &end
#
#   27 LEU  HB-          28 SER  HN          5.00    (#   2238:10  Unique         1.97, 3.24 A)
 &rst
  ixpk= 2238, nxpk= 10, iat=  -1, 415, r1= 1.30, r2= 1.80, r3= 5.61, r4= 6.11,
 igr1= 400, 401,
 &end
#
#   76 LYS  HA           28 SER  HN          5.00    (#   2240:10  Unique         3.72, 4.71 A)
 &rst
  ixpk= 2240, nxpk= 10, iat=1137, 415, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50,  &end
#
#   19 SER  HB-          19 SER  HN          5.00    (#   2241:10  Unique         2.48, 3.21 A)
 &rst
  ixpk= 2241, nxpk= 10, iat=  -1, 292, r1= 1.30, r2= 1.80, r3= 5.61, r4= 6.11,
 igr1= 296, 297,
 &end
#
#   18 GLN  HB+          19 SER  HN          5.00    (#   2242:10  Unique         2.85, 4.20 A)
 &rst
  ixpk= 2242, nxpk= 10, iat=  -1, 292, r1= 1.30, r2= 1.80, r3= 5.61, r4= 6.11,
 igr1= 279, 280,
 &end
#
#  102 LEU  HN           21 MET  HN          5.00    (#   2243:10  Preassigned    4.56, 4.69 A)
 &rst
  ixpk= 2243, nxpk= 10, iat=1521, 317, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50,  &end
#
#   43 PRO  HG-          44 THR  HN          5.00    (#   2244:10  Unique         4.01, 4.58 A)
 &rst
  ixpk= 2244, nxpk= 10, iat=  -1, 627, r1= 1.30, r2= 1.80, r3= 5.61, r4= 6.11,
 igr1= 617, 618,
 &end
#
#    0 AMB  10-2:2245    44 THR  HN          5.00    (#   2245:10  Single Ambig)
 &rst
  ixpk= 2245, nxpk= 10, iat=  -1, 627, r1= 1.30, r2= 1.80, r3= 6.74, r4= 7.24,
 igr1= 633, 634, 635, 539, 540, 541,
 &end
#
#  105 PHE  HB2         106 ALA  HN          5.00    (#   2246:10  Unique         2.83, 3.07 A)
 &rst
  ixpk= 2246, nxpk= 10, iat=1582,1598, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50,  &end
#
#    0 AMB  10-2:2248   101 HIS  HN          5.00    (#   2248:10  Single Ambig)
 &rst
  ixpk= 2248, nxpk= 10, iat=  -1,1504, r1= 1.30, r2= 1.80, r3= 6.74, r4= 7.24,
 igr1=1495,1496,1550,1551,1550,1551,
 &end
#
#    0 AMB  10-2:2249   101 HIS  HN          5.00    (#   2249:10  Single Ambig)
 &rst
  ixpk= 2249, nxpk= 10, iat=  -1,1504, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,
 igr1= 296, 297, 307,
 &end
#
#    0 AMB  10-2:2252     0 AMB  10-1:2252   5.00    (#   2252:10  Double Ambig)
 &rst
  ixpk= 2252, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.07, r4= 7.57,
 igr1= 862, 863, 862, 863,
 igr2= 872, 846,
 &end
#
#  106 ALA  HA           25 ALA  HN          5.00    (#   2255:10  Unique         3.11, 3.62 A)
 &rst
  ixpk= 2255, nxpk= 10, iat=1600, 372, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50,  &end
#
#   26 ASN  HN           25 ALA  HN          5.00    (#   2256:10  Unique         4.49, 4.59 A)
 &rst
  ixpk= 2256, nxpk= 10, iat= 382, 372, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50,  &end
#
#    0 AMB  10-2:2257    25 ALA  HN          5.00    (#   2257:10  Single Ambig)
 &rst
  ixpk= 2257, nxpk= 10, iat=  -1, 372, r1= 1.30, r2= 1.80, r3= 7.21, r4= 7.71,
 igr1=1198,1199, 386, 387, 386, 387,1583,1621,1622,
 &end
#
#  105 PHE  QD           23 ALA  HN          5.00    (#   2259:10  Unique         2.48, 4.52 A)
 &rst
  ixpk= 2259, nxpk= 10, iat=  -1, 348, r1= 1.30, r2= 1.80, r3= 5.61, r4= 6.11,
 igr1=1586,1594,
 &end
#
#   72 LEU  MDX          72 LEU  HN          5.00    (#   2260:10  Unique         4.45, 5.34 A)
 &rst
  ixpk= 2260, nxpk= 10, iat=  -1,1056, r1= 1.30, r2= 1.80, r3= 6.74, r4= 7.24,
 igr1=1065,1066,1067,1069,1070,1071,
 &end
#
#   71 GLU  QG           72 LEU  HN          5.00    (#   2261:10  Unique         4.20, 4.84 A)
 &rst
  ixpk= 2261, nxpk= 10, iat=  -1,1056, r1= 1.30, r2= 1.80, r3= 5.61, r4= 6.11,
 igr1=1048,1049,
 &end
#
#   33 LEU  HN           72 LEU  HN          3.50    (#   2262:10  Unique         2.88, 2.97 A)
 &rst
  ixpk= 2262, nxpk= 10, iat= 484,1056, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   96 GLN  HG-          14 VAL  HN          5.00    (#   2263:10  Unique         3.75, 4.81 A)
 &rst
  ixpk= 2263, nxpk= 10, iat=  -1, 201, r1= 1.30, r2= 1.80, r3= 5.61, r4= 6.11,
 igr1=1439,1440,
 &end
#
#   78 ASP  HB+          80 SER  HN          5.00    (#   2264:10  Unique         2.53, 3.87 A)
 &rst
  ixpk= 2264, nxpk= 10, iat=  -1,1207, r1= 1.30, r2= 1.80, r3= 5.61, r4= 6.11,
 igr1=1177,1178,
 &end
#
#   63 TYR  HN           64 SER  HN          5.00    (#   2266:10  Unique         4.30, 4.37 A)
 &rst
  ixpk= 2266, nxpk= 10, iat= 924, 945, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50,  &end
#
#   54 ILE  HN           55 GLU  HN          6.00    (#   2267:10  Unique         3.11, 3.33 A)
 &rst
  ixpk= 2267, nxpk= 10, iat= 780, 799, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,  &end
#
#   59 ASN  HD22         55 GLU  HN          5.00    (#   2268:10  Unique         2.82, 3.67 A)
 &rst
  ixpk= 2268, nxpk= 10, iat= 868, 799, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50,  &end
#
#   54 ILE  HG1+         55 GLU  HN          5.00    (#   2269:10  Unique         4.72, 5.10 A)
 &rst
  ixpk= 2269, nxpk= 10, iat=  -1, 799, r1= 1.30, r2= 1.80, r3= 5.61, r4= 6.11,
 igr1= 790, 791,
 &end
#
#    4 ILE  HN            3 ASP  HN          5.00    (#   2272:10  Unique         2.11, 3.98 A)
 &rst
  ixpk= 2272, nxpk= 10, iat=  45,  33, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50,  &end
#
#    0 AMB  10-2:2274    24 THR  HN          5.00    (#   2274:10  Single Ambig)
 &rst
  ixpk= 2274, nxpk= 10, iat=  -1, 358, r1= 1.30, r2= 1.80, r3= 6.74, r4= 7.24,
 igr1=1167,1168,1169, 464, 465, 466,
 &end
#
#    0 AMB  10-2:2275    87 CYS  HN          5.00    (#   2275:10  Single Ambig)
 &rst
  ixpk= 2275, nxpk= 10, iat=  -1,1310, r1= 1.30, r2= 1.80, r3= 6.30, r4= 6.80,
 igr1=1295, 652, 653, 654,
 &end
#
#   48 THR  MG2          87 CYS  HN          6.00    (#   2276:10  Unique         6.13, 7.44 A)
 &rst
  ixpk= 2276, nxpk= 10, iat=  -1,1310, r1= 1.30, r2= 1.80, r3= 7.21, r4= 7.71,
 igr1= 702, 703, 704,
 &end
#
#   45 MET  ME           70 SER  HN          5.00    (#   2277:10  Preassigned    4.44, 5.87 A)
 &rst
  ixpk= 2277, nxpk= 10, iat=  -1,1030, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,
 igr1= 652, 653, 654,
 &end
#
#   69 GLY  HA-          70 SER  HN          5.00    (#   2278:10  Preassigned    2.31, 3.14 A)
 &rst
  ixpk= 2278, nxpk= 10, iat=  -1,1030, r1= 1.30, r2= 1.80, r3= 5.61, r4= 6.11,
 igr1=1025,1026,
 &end
#
#    4 ILE  HB            5 GLN  HN          5.00    (#   2279:10  Unique         1.97, 2.37 A)
 &rst
  ixpk= 2279, nxpk= 10, iat=  49,  64, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50,  &end
#
#    5 GLN  QG            5 GLN  HN          5.00    (#   2280:10  Unique         2.50, 3.62 A)
 &rst
  ixpk= 2280, nxpk= 10, iat=  -1,  64, r1= 1.30, r2= 1.80, r3= 5.61, r4= 6.11,
 igr1=  71,  72,
 &end
#
#    0 AMB  10-2:2281    27 LEU  HN          5.00    (#   2281:10  Single Ambig)
 &rst
  ixpk= 2281, nxpk= 10, iat=  -1, 396, r1= 1.30, r2= 1.80, r3= 6.74, r4= 7.24,
 igr1= 364, 365, 366, 352, 353, 354,
 &end
#
#    0 AMB  10-2:2282    27 LEU  HN          2.70    (#   2282:10  Single Ambig)
 &rst
  ixpk= 2282, nxpk= 10, iat=  -1, 396, r1= 1.30, r2= 1.80, r3= 3.03, r4= 3.53,
 igr1= 384, 398,
 &end
#
#    0 AMB  10-2:2283    27 LEU  HN          5.00    (#   2283:10  Single Ambig)
 &rst
  ixpk= 2283, nxpk= 10, iat=  -1, 396, r1= 1.30, r2= 1.80, r3= 6.30, r4= 6.80,
 igr1=1621,1622, 386, 387,
 &end
#
#    0 AMB  10-2:2284    27 LEU  HN          5.00    (#   2284:10  Single Ambig)
 &rst
  ixpk= 2284, nxpk= 10, iat=  -1, 396, r1= 1.30, r2= 1.80, r3= 6.30, r4= 6.80,
 igr1=1621,1622, 386, 387,
 &end
#
#   60 GLU  HB+          61 GLU  HN          3.50    (#   2286:10  Unique         2.57, 3.84 A)
 &rst
  ixpk= 2286, nxpk= 10, iat=  -1, 887, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1= 876, 877,
 &end
#
#   59 ASN  HB-          61 GLU  HN          5.00    (#   2287:10  Unique         4.43, 4.96 A)
 &rst
  ixpk= 2287, nxpk= 10, iat=  -1, 887, r1= 1.30, r2= 1.80, r3= 5.61, r4= 6.11,
 igr1= 862, 863,
 &end
#
#    0 AMB  10-2:2288    59 ASN  HN          5.00    (#   2288:10  Single Ambig)
 &rst
  ixpk= 2288, nxpk= 10, iat=  -1, 858, r1= 1.30, r2= 1.80, r3= 6.74, r4= 7.24,
 igr1= 838, 839, 879, 880, 773, 774,
 &end
#
#   99 THR  HN           98 ALA  HN          5.00    (#   2291:10  Unique         4.34, 4.36 A)
 &rst
  ixpk= 2291, nxpk= 10, iat=1471,1461, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50,  &end
#
#   98 ALA  HA           98 ALA  HN          3.50    (#   2293:10  Unique         2.87, 2.92 A)
 &rst
  ixpk= 2293, nxpk= 10, iat=1463,1461, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   77 VAL  HA           77 VAL  HN          3.50    (#   2294:10  Unique         2.24, 2.75 A)
 &rst
  ixpk= 2294, nxpk= 10, iat=1159,1157, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   77 VAL  MG2          77 VAL  HN          2.70    (#   2295:10  Preassigned    2.11, 3.30 A)
 &rst
  ixpk= 2295, nxpk= 10, iat=  -1,1157, r1= 1.30, r2= 1.80, r3= 3.24, r4= 3.74,
 igr1=1167,1168,1169,
 &end
#
#    0 AMB  10-2:2296   102 LEU  HN          5.00    (#   2296:10  Single Ambig)
 &rst
  ixpk= 2296, nxpk= 10, iat=  -1,1521, r1= 1.30, r2= 1.80, r3= 5.61, r4= 6.11,
 igr1=1232, 712,
 &end
#
#   79 LYS  HN           81 ASP  HN          5.00    (#   2297:10  Unique         4.20, 4.39 A)
 &rst
  ixpk= 2297, nxpk= 10, iat=1185,1218, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50,  &end
#
#   35 CYS  HN           34 ALA  HN          5.00    (#   2298:10  Preassigned    4.37, 4.42 A)
 &rst
  ixpk= 2298, nxpk= 10, iat= 513, 503, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50,  &end
#
#    0 AMB  10-2:2299    13 SER  HN          5.00    (#   2299:10  Single Ambig)
 &rst
  ixpk= 2299, nxpk= 10, iat=  -1, 190, r1= 1.30, r2= 1.80, r3= 6.74, r4= 7.24,
 igr1=1343,1344,1345, 156, 157, 158,
 &end
#
#    0 AMB  10-2:2300    91 ASN  HD21        5.00    (#   2300:10  Single Ambig)
 &rst
  ixpk= 2300, nxpk= 10, iat=  -1,1373, r1= 1.30, r2= 1.80, r3= 6.30, r4= 6.80,
 igr1= 177, 178, 163, 164,
 &end
#
#   39 GLY  HA+          91 ASN  HD21        5.00    (#   2301:10  Unique         2.82, 3.49 A)
 &rst
  ixpk= 2301, nxpk= 10, iat=  -1,1373, r1= 1.30, r2= 1.80, r3= 5.61, r4= 6.11,
 igr1= 559, 560,
 &end
#
#   61 GLU  QG           62 LYS  HN          5.00    (#   2303:10  Unique         2.02, 4.35 A)
 &rst
  ixpk= 2303, nxpk= 10, iat=  -1, 902, r1= 1.30, r2= 1.80, r3= 5.61, r4= 6.11,
 igr1= 894, 895,
 &end
#
#   62 LYS  HB-          62 LYS  HN          3.50    (#   2306:10  Unique         3.46, 3.79 A)
 &rst
  ixpk= 2306, nxpk= 10, iat=  -1, 902, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1= 906, 907,
 &end
#
#    0 AMB  10-2:2307    62 LYS  HN          3.50    (#   2307:10  Single Ambig)
 &rst
  ixpk= 2307, nxpk= 10, iat=  -1, 902, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,
 igr1= 906, 907,1104,1105,
 &end
#
#    0 AMB  10-2:2309     8 VAL  HN          5.00    (#   2309:10  Single Ambig)
 &rst
  ixpk= 2309, nxpk= 10, iat=  -1, 116, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,
 igr1= 101,  15,  16,
 &end
#
#    8 VAL  HB            8 VAL  HN          3.50    (#   2311:10  Preassigned    2.39, 2.68 A)
 &rst
  ixpk= 2311, nxpk= 10, iat= 120, 116, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   10 VAL  HN            8 VAL  HN          6.00    (#   2313:10  Preassigned    4.92, 5.09 A)
 &rst
  ixpk= 2313, nxpk= 10, iat= 146, 116, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,  &end
#
#   70 SER  HN           71 GLU  HN          2.70    (#   2315:10  Preassigned    2.78, 3.27 A)
 &rst
  ixpk= 2315, nxpk= 10, iat=1030,1041, r1= 1.30, r2= 1.80, r3= 2.70, r4= 3.20,  &end
#
#   70 SER  HA           71 GLU  HN          5.00    (#   2316:10  Unique         2.21, 3.03 A)
 &rst
  ixpk= 2316, nxpk= 10, iat=1032,1041, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50,  &end
#
#   69 GLY  HA-          71 GLU  HN          5.00    (#   2317:10  Unique         4.29, 4.93 A)
 &rst
  ixpk= 2317, nxpk= 10, iat=  -1,1041, r1= 1.30, r2= 1.80, r3= 5.61, r4= 6.11,
 igr1=1025,1026,
 &end
#
#    0 AMB  10-2:2320    93 ALA  HN          5.00    (#   2320:10  Single Ambig)
 &rst
  ixpk= 2320, nxpk= 10, iat=  -1,1400, r1= 1.30, r2= 1.80, r3= 6.74, r4= 7.24,
 igr1= 177, 178, 163, 164, 163, 164,
 &end
#
#    0 AMB  10-2:2321    93 ALA  HN          5.00    (#   2321:10  Single Ambig)
 &rst
  ixpk= 2321, nxpk= 10, iat=  -1,1400, r1= 1.30, r2= 1.80, r3= 5.61, r4= 6.11,
 igr1=1366, 148,
 &end
#
#   91 ASN  HB+          93 ALA  HN          5.00    (#   2322:10  Preassigned    3.68, 4.11 A)
 &rst
  ixpk= 2322, nxpk= 10, iat=  -1,1400, r1= 1.30, r2= 1.80, r3= 5.61, r4= 6.11,
 igr1=1368,1369,
 &end
#
#   92 LYS  HA           93 ALA  HN          5.00    (#   2323:10  Unique         3.37, 3.45 A)
 &rst
  ixpk= 2323, nxpk= 10, iat=1380,1400, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50,  &end
#
#    0 AMB  10-2:2325    91 ASN  HD22        5.00    (#   2325:10  Single Ambig)
 &rst
  ixpk= 2325, nxpk= 10, iat=  -1,1374, r1= 1.30, r2= 1.80, r3= 5.61, r4= 6.11,
 igr1= 623, 172,
 &end
#
#   96 GLN  HG+          96 GLN  HE22        5.00    (#   2326:10  Unique         2.29, 3.34 A)
 &rst
  ixpk= 2326, nxpk= 10, iat=  -1,1445, r1= 1.30, r2= 1.80, r3= 5.61, r4= 6.11,
 igr1=1439,1440,
 &end
#
#   22 ASN  QB           22 ASN  HD22        5.00    (#   2327:10  Unique         3.25, 3.43 A)
 &rst
  ixpk= 2327, nxpk= 10, iat=  -1, 344, r1= 1.30, r2= 1.80, r3= 5.61, r4= 6.11,
 igr1= 338, 339,
 &end
#
#    0 AMB  10-2:2328     9 ASN  HD22        3.50    (#   2328:10  Single Ambig)
 &rst
  ixpk= 2328, nxpk= 10, iat=  -1, 142, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,
 igr1= 136, 137,  37,  38,
 &end
#
#   51 GLY  HA-          51 GLY  HN          2.70    (#   2329:10  Unique         2.30, 2.74 A)
 &rst
  ixpk= 2329, nxpk= 10, iat=  -1, 744, r1= 1.30, r2= 1.80, r3= 3.03, r4= 3.53,
 igr1= 746, 747,
 &end
#
#   96 GLN  HB-          96 GLN  HE21        5.00    (#   2330:10  Unique         2.02, 4.01 A)
 &rst
  ixpk= 2330, nxpk= 10, iat=  -1,1444, r1= 1.30, r2= 1.80, r3= 5.61, r4= 6.11,
 igr1=1436,1437,
 &end
#
#   37 ALA  MB           39 GLY  HN          6.00    (#   2331:10  Unique         4.92, 5.85 A)
 &rst
  ixpk= 2331, nxpk= 10, iat=  -1, 557, r1= 1.30, r2= 1.80, r3= 7.21, r4= 7.71,
 igr1= 539, 540, 541,
 &end
#
#   56 GLN  HA           56 GLN  HN          3.50    (#   2332:10  Unique         2.55, 2.63 A)
 &rst
  ixpk= 2332, nxpk= 10, iat= 816, 814, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   56 GLN  HG-          56 GLN  HN          2.70    (#   2334:10  Unique         1.99, 2.71 A)
 &rst
  ixpk= 2334, nxpk= 10, iat=  -1, 814, r1= 1.30, r2= 1.80, r3= 3.03, r4= 3.53,
 igr1= 821, 822,
 &end
#
#    0 AMB  10-2:2335    45 MET  HN          5.00    (#   2335:10  Single Ambig)
 &rst
  ixpk= 2335, nxpk= 10, iat=  -1, 641, r1= 1.30, r2= 1.80, r3= 6.74, r4= 7.24,
 igr1= 645, 620, 621, 652, 653, 654,
 &end
#
#   86 ILE  HB           86 ILE  HN          3.50    (#   2336:10  Unique         2.55, 2.63 A)
 &rst
  ixpk= 2336, nxpk= 10, iat=1295,1291, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#  chirality for residue 1 atoms:  N C HA2 HA3
 &rst iat=1,8,6,7, 
   r1=10., r2=60., r3=80., r4=130., rk2 = 150., rk3=150.,  &end
#
#  chirality for residue 2 atoms:  CA CG HB2 HB3
 &rst iat=12,17,15,16, &end
#
#  chirality for residue 2 atoms:  CB CD HG2 HG3
 &rst iat=14,20,18,19, &end
#
#  chirality for residue 2 atoms:  CD NZ HE2 HE3
 &rst iat=20,26,24,25, &end
#
#  chirality for residue 2 atoms:  CG CE HD2 HD3
 &rst iat=17,23,21,22, &end
#
#  chirality for residue 2 atoms:  N C HA CB
 &rst iat=10,30,13,14, &end
#
#  chirality for residue 3 atoms:  CA CG HB2 HB3
 &rst iat=34,39,37,38, &end
#
#  chirality for residue 3 atoms:  N C HA CB
 &rst iat=32,42,35,36, &end
#
#  chirality for residue 4 atoms:  CA CG2 CG1 HB
 &rst iat=46,50,54,49, &end
bad constraint for residue 4 atoms:  CB CD1 HG12 HG13
#
#  chirality for residue 4 atoms:  N C HA CB
 &rst iat=44,61,47,48, &end
#
#  chirality for residue 5 atoms:  CA CG HB2 HB3
 &rst iat=65,70,68,69, &end
#
#  chirality for residue 5 atoms:  CB CD HG2 HG3
 &rst iat=67,73,71,72, &end
#
#  chirality for residue 5 atoms:  N C HA CB
 &rst iat=63,78,66,67, &end
#
#  chirality for residue 6 atoms:  CA CG1 CG2 HB
 &rst iat=82,86,90,85, &end
#
#  chirality for residue 6 atoms:  N C HA CB
 &rst iat=80,94,83,84, &end
#
#  chirality for residue 7 atoms:  CA CG2 CG1 HB
 &rst iat=98,102,106,101, &end
bad constraint for residue 7 atoms:  CB CD1 HG12 HG13
#
#  chirality for residue 7 atoms:  N C HA CB
 &rst iat=96,113,99,100, &end
#
#  chirality for residue 8 atoms:  CA CG1 CG2 HB
 &rst iat=117,121,125,120, &end
#
#  chirality for residue 8 atoms:  N C HA CB
 &rst iat=115,129,118,119, &end
#
#  chirality for residue 9 atoms:  CA CG HB2 HB3
 &rst iat=133,138,136,137, &end
#
#  chirality for residue 9 atoms:  N C HA CB
 &rst iat=131,143,134,135, &end
#
#  chirality for residue 10 atoms:  CA CG1 CG2 HB
 &rst iat=147,151,155,150, &end
#
#  chirality for residue 10 atoms:  N C HA CB
 &rst iat=145,159,148,149, &end
#
#  chirality for residue 11 atoms:  CA CG HB2 HB3
 &rst iat=171,165,169,170, &end
#
#  chirality for residue 11 atoms:  CB CD HG2 HG3
 &rst iat=168,162,166,167, &end
#
#  chirality for residue 11 atoms:  CG N HD2 HD3
 &rst iat=165,161,163,164, &end
#
#  chirality for residue 11 atoms:  N C HA CB
 &rst iat=161,173,172,168, &end
#
#  chirality for residue 12 atoms:  CA CG HB2 HB3
 &rst iat=185,179,183,184, &end
#
#  chirality for residue 12 atoms:  CB CD HG2 HG3
 &rst iat=182,176,180,181, &end
#
#  chirality for residue 12 atoms:  CG N HD2 HD3
 &rst iat=179,175,177,178, &end
#
#  chirality for residue 12 atoms:  N C HA CB
 &rst iat=175,187,186,182, &end
#
#  chirality for residue 13 atoms:  CA OG HB2 HB3
 &rst iat=191,196,194,195, &end
#
#  chirality for residue 13 atoms:  N C HA CB
 &rst iat=189,198,192,193, &end
#
#  chirality for residue 14 atoms:  CA CG1 CG2 HB
 &rst iat=202,206,210,205, &end
#
#  chirality for residue 14 atoms:  N C HA CB
 &rst iat=200,214,203,204, &end
#
#  chirality for residue 15 atoms:  CA CG HB2 HB3
 &rst iat=218,223,221,222, &end
#
#  chirality for residue 15 atoms:  CB CD HG2 HG3
 &rst iat=220,226,224,225, &end
#
#  chirality for residue 15 atoms:  CG NE HD2 HD3
 &rst iat=223,229,227,228, &end
#
#  chirality for residue 15 atoms:  N C HA CB
 &rst iat=216,238,219,220, &end
#
#  chirality for residue 16 atoms:  N C HA CB
 &rst iat=240,248,243,244, &end
#
#  chirality for residue 17 atoms:  CA CG HB2 HB3
 &rst iat=252,257,255,256, &end
#
#  chirality for residue 17 atoms:  CB CD HG2 HG3
 &rst iat=254,260,258,259, &end
#
#  chirality for residue 17 atoms:  CG NE HD2 HD3
 &rst iat=257,263,261,262, &end
#
#  chirality for residue 17 atoms:  N C HA CB
 &rst iat=250,272,253,254, &end
#
#  chirality for residue 18 atoms:  CA CG HB2 HB3
 &rst iat=276,281,279,280, &end
#
#  chirality for residue 18 atoms:  CB CD HG2 HG3
 &rst iat=278,284,282,283, &end
#
#  chirality for residue 18 atoms:  N C HA CB
 &rst iat=274,289,277,278, &end
#
#  chirality for residue 19 atoms:  CA OG HB2 HB3
 &rst iat=293,298,296,297, &end
#
#  chirality for residue 19 atoms:  N C HA CB
 &rst iat=291,300,294,295, &end
#
#  chirality for residue 20 atoms:  CA CG2 OG1 HB
 &rst iat=304,308,312,307, &end
#
#  chirality for residue 20 atoms:  N C HA CB
 &rst iat=302,314,305,306, &end
#
#  chirality for residue 21 atoms:  CA CG HB2 HB3
 &rst iat=318,323,321,322, &end
#
#  chirality for residue 21 atoms:  CB SD HG2 HG3
 &rst iat=320,326,324,325, &end
#
#  chirality for residue 21 atoms:  N C HA CB
 &rst iat=316,331,319,320, &end
#
#  chirality for residue 22 atoms:  CA CG HB2 HB3
 &rst iat=335,340,338,339, &end
#
#  chirality for residue 22 atoms:  N C HA CB
 &rst iat=333,345,336,337, &end
#
#  chirality for residue 23 atoms:  N C HA CB
 &rst iat=347,355,350,351, &end
#
#  chirality for residue 24 atoms:  CA CG2 OG1 HB
 &rst iat=359,363,367,362, &end
#
#  chirality for residue 24 atoms:  N C HA CB
 &rst iat=357,369,360,361, &end
#
#  chirality for residue 25 atoms:  N C HA CB
 &rst iat=371,379,374,375, &end
#
#  chirality for residue 26 atoms:  CA CG HB2 HB3
 &rst iat=383,388,386,387, &end
#
#  chirality for residue 26 atoms:  N C HA CB
 &rst iat=381,393,384,385, &end
#
#  chirality for residue 27 atoms:  CA CG HB2 HB3
 &rst iat=397,402,400,401, &end
#
#  chirality for residue 27 atoms:  CB CD1 CD2 HG
 &rst iat=399,404,408,403, &end
#
#  chirality for residue 27 atoms:  N C HA CB
 &rst iat=395,412,398,399, &end
#
#  chirality for residue 28 atoms:  CA OG HB2 HB3
 &rst iat=416,421,419,420, &end
#
#  chirality for residue 28 atoms:  N C HA CB
 &rst iat=414,423,417,418, &end
#
#  chirality for residue 29 atoms:  CA CG HB2 HB3
 &rst iat=427,432,430,431, &end
#
#  chirality for residue 29 atoms:  CB CD HG2 HG3
 &rst iat=429,435,433,434, &end
#
#  chirality for residue 29 atoms:  N C HA CB
 &rst iat=425,440,428,429, &end
#
#  chirality for residue 30 atoms:  CA OG HB2 HB3
 &rst iat=444,449,447,448, &end
#
#  chirality for residue 30 atoms:  N C HA CB
 &rst iat=442,451,445,446, &end
#
#  chirality for residue 31 atoms:  CA CG1 CG2 HB
 &rst iat=455,459,463,458, &end
#
#  chirality for residue 31 atoms:  N C HA CB
 &rst iat=453,467,456,457, &end
#
#  chirality for residue 32 atoms:  CA CG2 OG1 HB
 &rst iat=471,475,479,474, &end
#
#  chirality for residue 32 atoms:  N C HA CB
 &rst iat=469,481,472,473, &end
#
#  chirality for residue 33 atoms:  CA CG HB2 HB3
 &rst iat=485,490,488,489, &end
#
#  chirality for residue 33 atoms:  CB CD1 CD2 HG
 &rst iat=487,492,496,491, &end
#
#  chirality for residue 33 atoms:  N C HA CB
 &rst iat=483,500,486,487, &end
#
#  chirality for residue 34 atoms:  N C HA CB
 &rst iat=502,510,505,506, &end
#
#  chirality for residue 35 atoms:  CA SG HB2 HB3
 &rst iat=514,519,517,518, &end
#
#  chirality for residue 35 atoms:  N C HA CB
 &rst iat=512,520,515,516, &end
#
#  chirality for residue 36 atoms:  CA CG HB2 HB3
 &rst iat=524,529,527,528, &end
#
#  chirality for residue 36 atoms:  N C HA CB
 &rst iat=522,532,525,526, &end
#
#  chirality for residue 37 atoms:  N C HA CB
 &rst iat=534,542,537,538, &end
#
#  chirality for residue 38 atoms:  CA CG HB2 HB3
 &rst iat=546,551,549,550, &end
#
#  chirality for residue 38 atoms:  N C HA CB
 &rst iat=544,554,547,548, &end
#
#  chirality for residue 39 atoms:  N C HA2 HA3
 &rst iat=556,561,559,560, &end
#
#  chirality for residue 40 atoms:  CA CG HB2 HB3
 &rst iat=565,570,568,569, &end
#
#  chirality for residue 40 atoms:  N C HA CB
 &rst iat=563,581,566,567, &end
#
#  chirality for residue 41 atoms:  CA CG HB2 HB3
 &rst iat=593,587,591,592, &end
#
#  chirality for residue 41 atoms:  CB CD HG2 HG3
 &rst iat=590,584,588,589, &end
#
#  chirality for residue 41 atoms:  CG N HD2 HD3
 &rst iat=587,583,585,586, &end
#
#  chirality for residue 41 atoms:  N C HA CB
 &rst iat=583,595,594,590, &end
#
#  chirality for residue 42 atoms:  CA CG HB2 HB3
 &rst iat=599,604,602,603, &end
#
#  chirality for residue 42 atoms:  CB CD HG2 HG3
 &rst iat=601,607,605,606, &end
#
#  chirality for residue 42 atoms:  N C HA CB
 &rst iat=597,610,600,601, &end
#
#  chirality for residue 43 atoms:  CA CG HB2 HB3
 &rst iat=622,616,620,621, &end
#
#  chirality for residue 43 atoms:  CB CD HG2 HG3
 &rst iat=619,613,617,618, &end
#
#  chirality for residue 43 atoms:  CG N HD2 HD3
 &rst iat=616,612,614,615, &end
#
#  chirality for residue 43 atoms:  N C HA CB
 &rst iat=612,624,623,619, &end
#
#  chirality for residue 44 atoms:  CA CG2 OG1 HB
 &rst iat=628,632,636,631, &end
#
#  chirality for residue 44 atoms:  N C HA CB
 &rst iat=626,638,629,630, &end
#
#  chirality for residue 45 atoms:  CA CG HB2 HB3
 &rst iat=642,647,645,646, &end
#
#  chirality for residue 45 atoms:  CB SD HG2 HG3
 &rst iat=644,650,648,649, &end
#
#  chirality for residue 45 atoms:  N C HA CB
 &rst iat=640,655,643,644, &end
#
#  chirality for residue 46 atoms:  CA CG2 OG1 HB
 &rst iat=659,663,667,662, &end
#
#  chirality for residue 46 atoms:  N C HA CB
 &rst iat=657,669,660,661, &end
#
#  chirality for residue 47 atoms:  CA CG HB2 HB3
 &rst iat=673,678,676,677, &end
#
#  chirality for residue 47 atoms:  N C HA CB
 &rst iat=671,693,674,675, &end
#
#  chirality for residue 48 atoms:  CA CG2 OG1 HB
 &rst iat=697,701,705,700, &end
#
#  chirality for residue 48 atoms:  N C HA CB
 &rst iat=695,707,698,699, &end
#
#  chirality for residue 49 atoms:  CA CG HB2 HB3
 &rst iat=711,716,714,715, &end
#
#  chirality for residue 49 atoms:  CB CD HG2 HG3
 &rst iat=713,719,717,718, &end
#
#  chirality for residue 49 atoms:  CD NZ HE2 HE3
 &rst iat=719,725,723,724, &end
#
#  chirality for residue 49 atoms:  CG CE HD2 HD3
 &rst iat=716,722,720,721, &end
#
#  chirality for residue 49 atoms:  N C HA CB
 &rst iat=709,729,712,713, &end
#
#  chirality for residue 50 atoms:  CA CG HB2 HB3
 &rst iat=733,738,736,737, &end
#
#  chirality for residue 50 atoms:  N C HA CB
 &rst iat=731,741,734,735, &end
#
#  chirality for residue 51 atoms:  N C HA2 HA3
 &rst iat=743,748,746,747, &end
#
#  chirality for residue 52 atoms:  CA CG HB2 HB3
 &rst iat=752,757,755,756, &end
#
#  chirality for residue 52 atoms:  CB CD HG2 HG3
 &rst iat=754,760,758,759, &end
#
#  chirality for residue 52 atoms:  N C HA CB
 &rst iat=750,763,753,754, &end
#
#  chirality for residue 53 atoms:  CA CG HB2 HB3
 &rst iat=775,769,773,774, &end
#
#  chirality for residue 53 atoms:  CB CD HG2 HG3
 &rst iat=772,766,770,771, &end
#
#  chirality for residue 53 atoms:  CG N HD2 HD3
 &rst iat=769,765,767,768, &end
#
#  chirality for residue 53 atoms:  N C HA CB
 &rst iat=765,777,776,772, &end
#
#  chirality for residue 54 atoms:  CA CG2 CG1 HB
 &rst iat=781,785,789,784, &end
bad constraint for residue 54 atoms:  CB CD1 HG12 HG13
#
#  chirality for residue 54 atoms:  N C HA CB
 &rst iat=779,796,782,783, &end
#
#  chirality for residue 55 atoms:  CA CG HB2 HB3
 &rst iat=800,805,803,804, &end
#
#  chirality for residue 55 atoms:  CB CD HG2 HG3
 &rst iat=802,808,806,807, &end
#
#  chirality for residue 55 atoms:  N C HA CB
 &rst iat=798,811,801,802, &end
#
#  chirality for residue 56 atoms:  CA CG HB2 HB3
 &rst iat=815,820,818,819, &end
#
#  chirality for residue 56 atoms:  CB CD HG2 HG3
 &rst iat=817,823,821,822, &end
#
#  chirality for residue 56 atoms:  N C HA CB
 &rst iat=813,828,816,817, &end
#
#  chirality for residue 57 atoms:  CA CG HB2 HB3
 &rst iat=832,837,835,836, &end
#
#  chirality for residue 57 atoms:  CB CD HG2 HG3
 &rst iat=834,840,838,839, &end
#
#  chirality for residue 57 atoms:  N C HA CB
 &rst iat=830,843,833,834, &end
#
#  chirality for residue 58 atoms:  CA CG HB2 HB3
 &rst iat=847,852,850,851, &end
#
#  chirality for residue 58 atoms:  N C HA CB
 &rst iat=845,855,848,849, &end
#
#  chirality for residue 59 atoms:  CA CG HB2 HB3
 &rst iat=859,864,862,863, &end
#
#  chirality for residue 59 atoms:  N C HA CB
 &rst iat=857,869,860,861, &end
#
#  chirality for residue 60 atoms:  CA CG HB2 HB3
 &rst iat=873,878,876,877, &end
#
#  chirality for residue 60 atoms:  CB CD HG2 HG3
 &rst iat=875,881,879,880, &end
#
#  chirality for residue 60 atoms:  N C HA CB
 &rst iat=871,884,874,875, &end
#
#  chirality for residue 61 atoms:  CA CG HB2 HB3
 &rst iat=888,893,891,892, &end
#
#  chirality for residue 61 atoms:  CB CD HG2 HG3
 &rst iat=890,896,894,895, &end
#
#  chirality for residue 61 atoms:  N C HA CB
 &rst iat=886,899,889,890, &end
#
#  chirality for residue 62 atoms:  CA CG HB2 HB3
 &rst iat=903,908,906,907, &end
#
#  chirality for residue 62 atoms:  CB CD HG2 HG3
 &rst iat=905,911,909,910, &end
#
#  chirality for residue 62 atoms:  CD NZ HE2 HE3
 &rst iat=911,917,915,916, &end
#
#  chirality for residue 62 atoms:  CG CE HD2 HD3
 &rst iat=908,914,912,913, &end
#
#  chirality for residue 62 atoms:  N C HA CB
 &rst iat=901,921,904,905, &end
#
#  chirality for residue 63 atoms:  CA CG HB2 HB3
 &rst iat=925,930,928,929, &end
#
#  chirality for residue 63 atoms:  N C HA CB
 &rst iat=923,942,926,927, &end
#
#  chirality for residue 64 atoms:  CA OG HB2 HB3
 &rst iat=946,951,949,950, &end
#
#  chirality for residue 64 atoms:  N C HA CB
 &rst iat=944,953,947,948, &end
#
#  chirality for residue 65 atoms:  CA CG HB2 HB3
 &rst iat=957,962,960,961, &end
#
#  chirality for residue 65 atoms:  N C HA CB
 &rst iat=955,973,958,959, &end
#
#  chirality for residue 66 atoms:  CA CG HB2 HB3
 &rst iat=977,982,980,981, &end
#
#  chirality for residue 66 atoms:  N C HA CB
 &rst iat=975,987,978,979, &end
#
#  chirality for residue 67 atoms:  CA CG HB2 HB3
 &rst iat=991,996,994,995, &end
#
#  chirality for residue 67 atoms:  N C HA CB
 &rst iat=989,1008,992,993, &end
#
#  chirality for residue 68 atoms:  CA CG HB2 HB3
 &rst iat=1012,1017,1015,1016, &end
#
#  chirality for residue 68 atoms:  N C HA CB
 &rst iat=1010,1020,1013,1014, &end
#
#  chirality for residue 69 atoms:  N C HA2 HA3
 &rst iat=1022,1027,1025,1026, &end
#
#  chirality for residue 70 atoms:  CA OG HB2 HB3
 &rst iat=1031,1036,1034,1035, &end
#
#  chirality for residue 70 atoms:  N C HA CB
 &rst iat=1029,1038,1032,1033, &end
#
#  chirality for residue 71 atoms:  CA CG HB2 HB3
 &rst iat=1042,1047,1045,1046, &end
#
#  chirality for residue 71 atoms:  CB CD HG2 HG3
 &rst iat=1044,1050,1048,1049, &end
#
#  chirality for residue 71 atoms:  N C HA CB
 &rst iat=1040,1053,1043,1044, &end
#
#  chirality for residue 72 atoms:  CA CG HB2 HB3
 &rst iat=1057,1062,1060,1061, &end
#
#  chirality for residue 72 atoms:  CB CD1 CD2 HG
 &rst iat=1059,1064,1068,1063, &end
#
#  chirality for residue 72 atoms:  N C HA CB
 &rst iat=1055,1072,1058,1059, &end
#
#  chirality for residue 73 atoms:  CA CG2 CG1 HB
 &rst iat=1076,1080,1084,1079, &end
bad constraint for residue 73 atoms:  CB CD1 HG12 HG13
#
#  chirality for residue 73 atoms:  N C HA CB
 &rst iat=1074,1091,1077,1078, &end
#
#  chirality for residue 74 atoms:  CA CG2 CG1 HB
 &rst iat=1095,1099,1103,1098, &end
bad constraint for residue 74 atoms:  CB CD1 HG12 HG13
#
#  chirality for residue 74 atoms:  N C HA CB
 &rst iat=1093,1110,1096,1097, &end
#
#  chirality for residue 75 atoms:  CA CG HB2 HB3
 &rst iat=1114,1119,1117,1118, &end
#
#  chirality for residue 75 atoms:  CB CD HG2 HG3
 &rst iat=1116,1122,1120,1121, &end
#
#  chirality for residue 75 atoms:  CD NZ HE2 HE3
 &rst iat=1122,1128,1126,1127, &end
#
#  chirality for residue 75 atoms:  CG CE HD2 HD3
 &rst iat=1119,1125,1123,1124, &end
#
#  chirality for residue 75 atoms:  N C HA CB
 &rst iat=1112,1132,1115,1116, &end
#
#  chirality for residue 76 atoms:  CA CG HB2 HB3
 &rst iat=1136,1141,1139,1140, &end
#
#  chirality for residue 76 atoms:  CB CD HG2 HG3
 &rst iat=1138,1144,1142,1143, &end
#
#  chirality for residue 76 atoms:  CD NZ HE2 HE3
 &rst iat=1144,1150,1148,1149, &end
#
#  chirality for residue 76 atoms:  CG CE HD2 HD3
 &rst iat=1141,1147,1145,1146, &end
#
#  chirality for residue 76 atoms:  N C HA CB
 &rst iat=1134,1154,1137,1138, &end
#
#  chirality for residue 77 atoms:  CA CG1 CG2 HB
 &rst iat=1158,1162,1166,1161, &end
#
#  chirality for residue 77 atoms:  N C HA CB
 &rst iat=1156,1170,1159,1160, &end
#
#  chirality for residue 78 atoms:  CA CG HB2 HB3
 &rst iat=1174,1179,1177,1178, &end
#
#  chirality for residue 78 atoms:  N C HA CB
 &rst iat=1172,1182,1175,1176, &end
#
#  chirality for residue 79 atoms:  CA CG HB2 HB3
 &rst iat=1186,1191,1189,1190, &end
#
#  chirality for residue 79 atoms:  CB CD HG2 HG3
 &rst iat=1188,1194,1192,1193, &end
#
#  chirality for residue 79 atoms:  CD NZ HE2 HE3
 &rst iat=1194,1200,1198,1199, &end
#
#  chirality for residue 79 atoms:  CG CE HD2 HD3
 &rst iat=1191,1197,1195,1196, &end
#
#  chirality for residue 79 atoms:  N C HA CB
 &rst iat=1184,1204,1187,1188, &end
#
#  chirality for residue 80 atoms:  CA OG HB2 HB3
 &rst iat=1208,1213,1211,1212, &end
#
#  chirality for residue 80 atoms:  N C HA CB
 &rst iat=1206,1215,1209,1210, &end
#
#  chirality for residue 81 atoms:  CA CG HB2 HB3
 &rst iat=1219,1224,1222,1223, &end
#
#  chirality for residue 81 atoms:  N C HA CB
 &rst iat=1217,1227,1220,1221, &end
#
#  chirality for residue 82 atoms:  CA CG HB2 HB3
 &rst iat=1231,1236,1234,1235, &end
#
#  chirality for residue 82 atoms:  CB CD HG2 HG3
 &rst iat=1233,1239,1237,1238, &end
#
#  chirality for residue 82 atoms:  N C HA CB
 &rst iat=1229,1242,1232,1233, &end
#
#  chirality for residue 83 atoms:  N C HA CB
 &rst iat=1244,1252,1247,1248, &end
#
#  chirality for residue 84 atoms:  CA CG HB2 HB3
 &rst iat=1256,1261,1259,1260, &end
#
#  chirality for residue 84 atoms:  CB CD HG2 HG3
 &rst iat=1258,1264,1262,1263, &end
#
#  chirality for residue 84 atoms:  N C HA CB
 &rst iat=1254,1267,1257,1258, &end
#
#  chirality for residue 85 atoms:  CA CG HB2 HB3
 &rst iat=1271,1276,1274,1275, &end
#
#  chirality for residue 85 atoms:  N C HA CB
 &rst iat=1269,1288,1272,1273, &end
#
#  chirality for residue 86 atoms:  CA CG2 CG1 HB
 &rst iat=1292,1296,1300,1295, &end
bad constraint for residue 86 atoms:  CB CD1 HG12 HG13
#
#  chirality for residue 86 atoms:  N C HA CB
 &rst iat=1290,1307,1293,1294, &end
#
#  chirality for residue 87 atoms:  CA SG HB2 HB3
 &rst iat=1311,1316,1314,1315, &end
#
#  chirality for residue 87 atoms:  N C HA CB
 &rst iat=1309,1317,1312,1313, &end
#
#  chirality for residue 88 atoms:  CA CG2 CG1 HB
 &rst iat=1321,1325,1329,1324, &end
bad constraint for residue 88 atoms:  CB CD1 HG12 HG13
#
#  chirality for residue 88 atoms:  N C HA CB
 &rst iat=1319,1336,1322,1323, &end
#
#  chirality for residue 89 atoms:  N C HA CB
 &rst iat=1338,1346,1341,1342, &end
#
#  chirality for residue 90 atoms:  CA CG HB2 HB3
 &rst iat=1350,1355,1353,1354, &end
#
#  chirality for residue 90 atoms:  CB CD HG2 HG3
 &rst iat=1352,1358,1356,1357, &end
#
#  chirality for residue 90 atoms:  N C HA CB
 &rst iat=1348,1361,1351,1352, &end
#
#  chirality for residue 91 atoms:  CA CG HB2 HB3
 &rst iat=1365,1370,1368,1369, &end
#
#  chirality for residue 91 atoms:  N C HA CB
 &rst iat=1363,1375,1366,1367, &end
#
#  chirality for residue 92 atoms:  CA CG HB2 HB3
 &rst iat=1379,1384,1382,1383, &end
#
#  chirality for residue 92 atoms:  CB CD HG2 HG3
 &rst iat=1381,1387,1385,1386, &end
#
#  chirality for residue 92 atoms:  CD NZ HE2 HE3
 &rst iat=1387,1393,1391,1392, &end
#
#  chirality for residue 92 atoms:  CG CE HD2 HD3
 &rst iat=1384,1390,1388,1389, &end
#
#  chirality for residue 92 atoms:  N C HA CB
 &rst iat=1377,1397,1380,1381, &end
#
#  chirality for residue 93 atoms:  N C HA CB
 &rst iat=1399,1407,1402,1403, &end
#
#  chirality for residue 94 atoms:  N C HA2 HA3
 &rst iat=1409,1414,1412,1413, &end
#
#  chirality for residue 95 atoms:  CA CG HB2 HB3
 &rst iat=1418,1423,1421,1422, &end
#
#  chirality for residue 95 atoms:  CB CD HG2 HG3
 &rst iat=1420,1426,1424,1425, &end
#
#  chirality for residue 95 atoms:  N C HA CB
 &rst iat=1416,1429,1419,1420, &end
#
#  chirality for residue 96 atoms:  CA CG HB2 HB3
 &rst iat=1433,1438,1436,1437, &end
#
#  chirality for residue 96 atoms:  CB CD HG2 HG3
 &rst iat=1435,1441,1439,1440, &end
#
#  chirality for residue 96 atoms:  N C HA CB
 &rst iat=1431,1446,1434,1435, &end
#
#  chirality for residue 97 atoms:  CA CG HB2 HB3
 &rst iat=1450,1455,1453,1454, &end
#
#  chirality for residue 97 atoms:  N C HA CB
 &rst iat=1448,1458,1451,1452, &end
#
#  chirality for residue 98 atoms:  N C HA CB
 &rst iat=1460,1468,1463,1464, &end
#
#  chirality for residue 99 atoms:  CA CG2 OG1 HB
 &rst iat=1472,1476,1480,1475, &end
#
#  chirality for residue 99 atoms:  N C HA CB
 &rst iat=1470,1482,1473,1474, &end
#
#  chirality for residue 100 atoms:  CA CG2 CG1 HB
 &rst iat=1486,1490,1494,1489, &end
bad constraint for residue 100 atoms:  CB CD1 HG12 HG13
#
#  chirality for residue 100 atoms:  N C HA CB
 &rst iat=1484,1501,1487,1488, &end
#
#  chirality for residue 102 atoms:  CA CG HB2 HB3
 &rst iat=1522,1527,1525,1526, &end
#
#  chirality for residue 102 atoms:  CB CD1 CD2 HG
 &rst iat=1524,1529,1533,1528, &end
#
#  chirality for residue 102 atoms:  N C HA CB
 &rst iat=1520,1537,1523,1524, &end
#
#  chirality for residue 103 atoms:  CA CG HB2 HB3
 &rst iat=1541,1546,1544,1545, &end
#
#  chirality for residue 103 atoms:  CB CD HG2 HG3
 &rst iat=1543,1549,1547,1548, &end
#
#  chirality for residue 103 atoms:  CD NZ HE2 HE3
 &rst iat=1549,1555,1553,1554, &end
#
#  chirality for residue 103 atoms:  CG CE HD2 HD3
 &rst iat=1546,1552,1550,1551, &end
#
#  chirality for residue 103 atoms:  N C HA CB
 &rst iat=1539,1559,1542,1543, &end
#
#  chirality for residue 104 atoms:  CA CG1 CG2 HB
 &rst iat=1563,1567,1571,1566, &end
#
#  chirality for residue 104 atoms:  N C HA CB
 &rst iat=1561,1575,1564,1565, &end
#
#  chirality for residue 105 atoms:  CA CG HB2 HB3
 &rst iat=1579,1584,1582,1583, &end
#
#  chirality for residue 105 atoms:  N C HA CB
 &rst iat=1577,1595,1580,1581, &end
#
#  chirality for residue 106 atoms:  N C HA CB
 &rst iat=1597,1605,1600,1601, &end
#
#  chirality for residue 107 atoms:  CA CG HB2 HB3
 &rst iat=1609,1614,1612,1613, &end
#
#  chirality for residue 107 atoms:  CB CD HG2 HG3
 &rst iat=1611,1617,1615,1616, &end
#
#  chirality for residue 107 atoms:  CD NZ HE2 HE3
 &rst iat=1617,1623,1621,1622, &end
#
#  chirality for residue 107 atoms:  CG CE HD2 HD3
 &rst iat=1614,1620,1618,1619, &end
#
#  chirality for residue 107 atoms:  N C HA CB
 &rst iat=1607,1627,1610,1611, &end
#
#  trans-omega constraint for residue 2
 &rst iat=12,10,8,5, 
   r1=150., r2=170., r3=190., r4=210., rk2 =150., rk3=150.,  &end
#
#  trans-omega constraint for residue 3
 &rst iat=34,32,30,12, &end
#
#  trans-omega constraint for residue 4
 &rst iat=46,44,42,34, &end
#
#  trans-omega constraint for residue 5
 &rst iat=65,63,61,46, &end
#
#  trans-omega constraint for residue 6
 &rst iat=82,80,78,65, &end
#
#  trans-omega constraint for residue 7
 &rst iat=98,96,94,82, &end
#
#  trans-omega constraint for residue 8
 &rst iat=117,115,113,98, &end
#
#  trans-omega constraint for residue 9
 &rst iat=133,131,129,117, &end
#
#  trans-omega constraint for residue 10
 &rst iat=147,145,143,133, &end
#
#  trans-omega constraint for residue 11
 &rst iat=171,161,159,147, &end
#
#  trans-omega constraint for residue 12
 &rst iat=185,175,173,171, &end
#
#  trans-omega constraint for residue 13
 &rst iat=191,189,187,185, &end
#
#  trans-omega constraint for residue 14
 &rst iat=202,200,198,191, &end
#
#  trans-omega constraint for residue 15
 &rst iat=218,216,214,202, &end
#
#  trans-omega constraint for residue 16
 &rst iat=242,240,238,218, &end
#
#  trans-omega constraint for residue 17
 &rst iat=252,250,248,242, &end
#
#  trans-omega constraint for residue 18
 &rst iat=276,274,272,252, &end
#
#  trans-omega constraint for residue 19
 &rst iat=293,291,289,276, &end
#
#  trans-omega constraint for residue 20
 &rst iat=304,302,300,293, &end
#
#  trans-omega constraint for residue 21
 &rst iat=318,316,314,304, &end
#
#  trans-omega constraint for residue 22
 &rst iat=335,333,331,318, &end
#
#  trans-omega constraint for residue 23
 &rst iat=349,347,345,335, &end
#
#  trans-omega constraint for residue 24
 &rst iat=359,357,355,349, &end
#
#  trans-omega constraint for residue 25
 &rst iat=373,371,369,359, &end
#
#  trans-omega constraint for residue 26
 &rst iat=383,381,379,373, &end
#
#  trans-omega constraint for residue 27
 &rst iat=397,395,393,383, &end
#
#  trans-omega constraint for residue 28
 &rst iat=416,414,412,397, &end
#
#  trans-omega constraint for residue 29
 &rst iat=427,425,423,416, &end
#
#  trans-omega constraint for residue 30
 &rst iat=444,442,440,427, &end
#
#  trans-omega constraint for residue 31
 &rst iat=455,453,451,444, &end
#
#  trans-omega constraint for residue 32
 &rst iat=471,469,467,455, &end
#
#  trans-omega constraint for residue 33
 &rst iat=485,483,481,471, &end
#
#  trans-omega constraint for residue 34
 &rst iat=504,502,500,485, &end
#
#  trans-omega constraint for residue 35
 &rst iat=514,512,510,504, &end
#
#  trans-omega constraint for residue 36
 &rst iat=524,522,520,514, &end
#
#  trans-omega constraint for residue 37
 &rst iat=536,534,532,524, &end
#
#  trans-omega constraint for residue 38
 &rst iat=546,544,542,536, &end
#
#  trans-omega constraint for residue 39
 &rst iat=558,556,554,546, &end
#
#  trans-omega constraint for residue 40
 &rst iat=565,563,561,558, &end
#
#  trans-omega constraint for residue 41
# cis proline
 &rst iat=593,583,581,565, 
   r1=330., r2=350., r3=370., r4=390., rk2 =150., rk3=150.,  &end
#
#  trans-omega constraint for residue 42
 &rst iat=599,597,595,593,
   r1=150., r2=170., r3=190., r4=210., rk2 =150., rk3=150.,  &end
#
#  trans-omega constraint for residue 43
 &rst iat=622,612,610,599, &end
#
#  trans-omega constraint for residue 44
 &rst iat=628,626,624,622, &end
#
#  trans-omega constraint for residue 45
 &rst iat=642,640,638,628, &end
#
#  trans-omega constraint for residue 46
 &rst iat=659,657,655,642, &end
#
#  trans-omega constraint for residue 47
 &rst iat=673,671,669,659, &end
#
#  trans-omega constraint for residue 48
 &rst iat=697,695,693,673, &end
#
#  trans-omega constraint for residue 49
 &rst iat=711,709,707,697, &end
#
#  trans-omega constraint for residue 50
 &rst iat=733,731,729,711, &end
#
#  trans-omega constraint for residue 51
 &rst iat=745,743,741,733, &end
#
#  trans-omega constraint for residue 52
 &rst iat=752,750,748,745, &end
#
#  trans-omega constraint for residue 53
 &rst iat=775,765,763,752, &end
#
#  trans-omega constraint for residue 54
 &rst iat=781,779,777,775, &end
#
#  trans-omega constraint for residue 55
 &rst iat=800,798,796,781, &end
#
#  trans-omega constraint for residue 56
 &rst iat=815,813,811,800, &end
#
#  trans-omega constraint for residue 57
 &rst iat=832,830,828,815, &end
#
#  trans-omega constraint for residue 58
 &rst iat=847,845,843,832, &end
#
#  trans-omega constraint for residue 59
 &rst iat=859,857,855,847, &end
#
#  trans-omega constraint for residue 60
 &rst iat=873,871,869,859, &end
#
#  trans-omega constraint for residue 61
 &rst iat=888,886,884,873, &end
#
#  trans-omega constraint for residue 62
 &rst iat=903,901,899,888, &end
#
#  trans-omega constraint for residue 63
 &rst iat=925,923,921,903, &end
#
#  trans-omega constraint for residue 64
 &rst iat=946,944,942,925, &end
#
#  trans-omega constraint for residue 65
 &rst iat=957,955,953,946, &end
#
#  trans-omega constraint for residue 66
 &rst iat=977,975,973,957, &end
#
#  trans-omega constraint for residue 67
 &rst iat=991,989,987,977, &end
#
#  trans-omega constraint for residue 68
 &rst iat=1012,1010,1008,991, &end
#
#  trans-omega constraint for residue 69
 &rst iat=1024,1022,1020,1012, &end
#
#  trans-omega constraint for residue 70
 &rst iat=1031,1029,1027,1024, &end
#
#  trans-omega constraint for residue 71
 &rst iat=1042,1040,1038,1031, &end
#
#  trans-omega constraint for residue 72
 &rst iat=1057,1055,1053,1042, &end
#
#  trans-omega constraint for residue 73
 &rst iat=1076,1074,1072,1057, &end
#
#  trans-omega constraint for residue 74
 &rst iat=1095,1093,1091,1076, &end
#
#  trans-omega constraint for residue 75
 &rst iat=1114,1112,1110,1095, &end
#
#  trans-omega constraint for residue 76
 &rst iat=1136,1134,1132,1114, &end
#
#  trans-omega constraint for residue 77
 &rst iat=1158,1156,1154,1136, &end
#
#  trans-omega constraint for residue 78
 &rst iat=1174,1172,1170,1158, &end
#
#  trans-omega constraint for residue 79
 &rst iat=1186,1184,1182,1174, &end
#
#  trans-omega constraint for residue 80
 &rst iat=1208,1206,1204,1186, &end
#
#  trans-omega constraint for residue 81
 &rst iat=1219,1217,1215,1208, &end
#
#  trans-omega constraint for residue 82
 &rst iat=1231,1229,1227,1219, &end
#
#  trans-omega constraint for residue 83
 &rst iat=1246,1244,1242,1231, &end
#
#  trans-omega constraint for residue 84
 &rst iat=1256,1254,1252,1246, &end
#
#  trans-omega constraint for residue 85
 &rst iat=1271,1269,1267,1256, &end
#
#  trans-omega constraint for residue 86
 &rst iat=1292,1290,1288,1271, &end
#
#  trans-omega constraint for residue 87
 &rst iat=1311,1309,1307,1292, &end
#
#  trans-omega constraint for residue 88
 &rst iat=1321,1319,1317,1311, &end
#
#  trans-omega constraint for residue 89
 &rst iat=1340,1338,1336,1321, &end
#
#  trans-omega constraint for residue 90
 &rst iat=1350,1348,1346,1340, &end
#
#  trans-omega constraint for residue 91
 &rst iat=1365,1363,1361,1350, &end
#
#  trans-omega constraint for residue 92
 &rst iat=1379,1377,1375,1365, &end
#
#  trans-omega constraint for residue 93
 &rst iat=1401,1399,1397,1379, &end
#
#  trans-omega constraint for residue 94
 &rst iat=1411,1409,1407,1401, &end
#
#  trans-omega constraint for residue 95
 &rst iat=1418,1416,1414,1411, &end
#
#  trans-omega constraint for residue 96
 &rst iat=1433,1431,1429,1418, &end
#
#  trans-omega constraint for residue 97
 &rst iat=1450,1448,1446,1433, &end
#
#  trans-omega constraint for residue 98
 &rst iat=1462,1460,1458,1450, &end
#
#  trans-omega constraint for residue 99
 &rst iat=1472,1470,1468,1462, &end
#
#  trans-omega constraint for residue 100
 &rst iat=1486,1484,1482,1472, &end
#
#  trans-omega constraint for residue 101
 &rst iat=1505,1503,1501,1486, &end
#
#  trans-omega constraint for residue 102
 &rst iat=1522,1520,1518,1505, &end
#
#  trans-omega constraint for residue 103
 &rst iat=1541,1539,1537,1522, &end
#
#  trans-omega constraint for residue 104
 &rst iat=1563,1561,1559,1541, &end
#
#  trans-omega constraint for residue 105
 &rst iat=1579,1577,1575,1563, &end
#
#  trans-omega constraint for residue 106
 &rst iat=1599,1597,1595,1579, &end
#
#  trans-omega constraint for residue 107
 &rst iat=1609,1607,1605,1599, &end
# 1629 atoms read from pdb file ig3.pdb.
# 2 LYS PHI:  (1 GLY C) - (2 LYS N) - (2 LYS CA) - (2 LYS C) -180.0 -40.0
 &rst     iat =     8,    10,    12,    30,
   r1 = -190.0, r2 = -180.0, r3 = -40.0, r4 = -30.0,
          rk2 = 150.0, rk3 = 150.0,                             &end

# 3 ASP PHI:  (2 LYS C) - (3 ASP N) - (3 ASP CA) - (3 ASP C) -180.0 -40.0
 &rst     iat =    30,    32,    34,    42,
   r1 = -190.0, r2 = -180.0, r3 = -40.0, r4 = -30.0,    &end

# 4 ILE PHI:  (3 ASP C) - (4 ILE N) - (4 ILE CA) - (4 ILE C) -180.0 -40.0
 &rst     iat =    42,    44,    46,    61,
   r1 = -190.0, r2 = -180.0, r3 = -40.0, r4 = -30.0, &end

# 5 GLN PHI:  (4 ILE C) - (5 GLN N) - (5 GLN CA) - (5 GLN C) -180.0 -40.0
 &rst     iat =    61,    63,    65,    78,
   r1 = -190.0, r2 = -180.0, r3 = -40.0, r4 = -30.0, &end

# 6 VAL PHI:  (5 GLN C) - (6 VAL N) - (6 VAL CA) - (6 VAL C) -180.0 -40.0
 &rst     iat =    78,    80,    82,    94,
   r1 = -190.0, r2 = -180.0, r3 = -40.0, r4 = -30.0, &end

# 7 ILE PHI:  (6 VAL C) - (7 ILE N) - (7 ILE CA) - (7 ILE C) -180.0 -40.0
 &rst     iat =    94,    96,    98,   113,
   r1 = -190.0, r2 = -180.0, r3 = -40.0, r4 = -30.0, &end

# 8 VAL PHI:  (7 ILE C) - (8 VAL N) - (8 VAL CA) - (8 VAL C) -180.0 -40.0
 &rst     iat =   113,   115,   117,   129,
   r1 = -190.0, r2 = -180.0, r3 = -40.0, r4 = -30.0, &end

# 8 VAL PHI:  (7 ILE C) - (8 VAL N) - (8 VAL CA) - (8 VAL C) -180.0 -40.0
 &rst     iat =   113,   115,   117,   129,
   r1 = -190.0, r2 = -180.0, r3 = -40.0, r4 = -30.0, &end

# 57 GLU PHI:  (56 GLN C) - (57 GLU N) - (57 GLU CA) - (57 GLU C) -180.0 -40.0
 &rst     iat =   828,   830,   832,   843,
   r1 = -190.0, r2 = -180.0, r3 = -40.0, r4 = -30.0, &end

# 60 GLU PHI:  (59 ASN C) - (60 GLU N) - (60 GLU CA) - (60 GLU C) -180.0 -40.0
 &rst     iat =   869,   871,   873,   884,
   r1 = -190.0, r2 = -180.0, r3 = -40.0, r4 = -30.0, &end

# 70 SER PHI:  (69 GLY C) - (70 SER N) - (70 SER CA) - (70 SER C) -180.0 -40.0
 &rst     iat =  1027,  1029,  1031,  1038,
   r1 = -190.0, r2 = -180.0, r3 = -40.0, r4 = -30.0, &end

# 106 ALA PHI:  (105 PHE C) - (106 ALA N) - (106 ALA CA) - (106 ALA C) -180.0 -40.0
 &rst     iat =  1595,  1597,  1599,  1605,
   r1 = -190.0, r2 = -180.0, r3 = -40.0, r4 = -30.0, &end

# 106 ALA PHI:  (105 PHE C) - (106 ALA N) - (106 ALA CA) - (106 ALA C) -180.0 -40.0
 &rst     iat =  1595,  1597,  1599,  1605,
   r1 = -190.0, r2 = -180.0, r3 = -40.0, r4 = -30.0, &end

# 13 SER PHI:  (12 PRO C) - (13 SER N) - (13 SER CA) - (13 SER C) -180.0 -40.0
 &rst     iat =   187,   189,   191,   198,
   r1 = -190.0, r2 = -180.0, r3 = -40.0, r4 = -30.0, &end

# 14 VAL PHI:  (13 SER C) - (14 VAL N) - (14 VAL CA) - (14 VAL C) -180.0 -40.0
 &rst     iat =   198,   200,   202,   214,
   r1 = -190.0, r2 = -180.0, r3 = -40.0, r4 = -30.0, &end

# 15 ARG PHI:  (14 VAL C) - (15 ARG N) - (15 ARG CA) - (15 ARG C) -180.0 -40.0
 &rst     iat =   214,   216,   218,   238,
   r1 = -190.0, r2 = -180.0, r3 = -40.0, r4 = -30.0, &end

# 20 THR PHI:  (19 SER C) - (20 THR N) - (20 THR CA) - (20 THR C) -180.0 -40.0
 &rst     iat =   300,   302,   304,   314,
   r1 = -190.0, r2 = -180.0, r3 = -40.0, r4 = -30.0, &end

# 21 MET PHI:  (20 THR C) - (21 MET N) - (21 MET CA) - (21 MET C) -180.0 -40.0
 &rst     iat =   314,   316,   318,   331,
   r1 = -190.0, r2 = -180.0, r3 = -40.0, r4 = -30.0, &end

# 22 ASN PHI:  (21 MET C) - (22 ASN N) - (22 ASN CA) - (22 ASN C) -180.0 -40.0
 &rst     iat =   331,   333,   335,   345,
   r1 = -190.0, r2 = -180.0, r3 = -40.0, r4 = -30.0, &end

# 23 ALA PHI:  (22 ASN C) - (23 ALA N) - (23 ALA CA) - (23 ALA C) -180.0 -40.0
 &rst     iat =   345,   347,   349,   355,
   r1 = -190.0, r2 = -180.0, r3 = -40.0, r4 = -30.0, &end

# 30 SER PHI:  (29 GLN C) - (30 SER N) - (30 SER CA) - (30 SER C) -180.0 -40.0
 &rst     iat =   440,   442,   444,   451,
   r1 = -190.0, r2 = -180.0, r3 = -40.0, r4 = -30.0, &end

# 31 VAL PHI:  (30 SER C) - (31 VAL N) - (31 VAL CA) - (31 VAL C) -180.0 -40.0
 &rst     iat =   451,   453,   455,   467,
   r1 = -190.0, r2 = -180.0, r3 = -40.0, r4 = -30.0, &end

# 32 THR PHI:  (31 VAL C) - (32 THR N) - (32 THR CA) - (32 THR C) -180.0 -40.0
 &rst     iat =   467,   469,   471,   481,
   r1 = -190.0, r2 = -180.0, r3 = -40.0, r4 = -30.0, &end

# 33 LEU PHI:  (32 THR C) - (33 LEU N) - (33 LEU CA) - (33 LEU C) -180.0 -40.0
 &rst     iat =   481,   483,   485,   500,
   r1 = -190.0, r2 = -180.0, r3 = -40.0, r4 = -30.0, &end

# 34 ALA PHI:  (33 LEU C) - (34 ALA N) - (34 ALA CA) - (34 ALA C) -180.0 -40.0
 &rst     iat =   500,   502,   504,   510,
   r1 = -190.0, r2 = -180.0, r3 = -40.0, r4 = -30.0, &end

# 35 CYS PHI:  (34 ALA C) - (35 CYS N) - (35 CYS CA) - (35 CYS C) -180.0 -40.0
 &rst     iat =   510,   512,   514,   520,
   r1 = -190.0, r2 = -180.0, r3 = -40.0, r4 = -30.0, &end

# 36 ASP PHI:  (35 CYS C) - (36 ASP N) - (36 ASP CA) - (36 ASP C) -180.0 -40.0
 &rst     iat =   520,   522,   524,   532,
   r1 = -190.0, r2 = -180.0, r3 = -40.0, r4 = -30.0, &end

# 37 ALA PHI:  (36 ASP C) - (37 ALA N) - (37 ALA CA) - (37 ALA C) -180.0 -40.0
 &rst     iat =   532,   534,   536,   542,
   r1 = -190.0, r2 = -180.0, r3 = -40.0, r4 = -30.0, &end

# 38 ASP PHI:  (37 ALA C) - (38 ASP N) - (38 ASP CA) - (38 ASP C) -180.0 -40.0
 &rst     iat =   542,   544,   546,   554,
   r1 = -190.0, r2 = -180.0, r3 = -40.0, r4 = -30.0, &end

# 44 THR PHI:  (43 PRO C) - (44 THR N) - (44 THR CA) - (44 THR C) -180.0 -40.0
 &rst     iat =   624,   626,   628,   638,
   r1 = -190.0, r2 = -180.0, r3 = -40.0, r4 = -30.0, &end

# 45 MET PHI:  (44 THR C) - (45 MET N) - (45 MET CA) - (45 MET C) -180.0 -40.0
 &rst     iat =   638,   640,   642,   655,
   r1 = -190.0, r2 = -180.0, r3 = -40.0, r4 = -30.0, &end

# 46 THR PHI:  (45 MET C) - (46 THR N) - (46 THR CA) - (46 THR C) -180.0 -40.0
 &rst     iat =   655,   657,   659,   669,
   r1 = -190.0, r2 = -180.0, r3 = -40.0, r4 = -30.0, &end

# 47 TRP PHI:  (46 THR C) - (47 TRP N) - (47 TRP CA) - (47 TRP C) -180.0 -40.0
 &rst     iat =   669,   671,   673,   693,
   r1 = -190.0, r2 = -180.0, r3 = -40.0, r4 = -30.0, &end

# 48 THR PHI:  (47 TRP C) - (48 THR N) - (48 THR CA) - (48 THR C) -180.0 -40.0
 &rst     iat =   693,   695,   697,   707,
   r1 = -190.0, r2 = -180.0, r3 = -40.0, r4 = -30.0, &end

# 49 LYS PHI:  (48 THR C) - (49 LYS N) - (49 LYS CA) - (49 LYS C) -180.0 -40.0
 &rst     iat =   707,   709,   711,   729,
   r1 = -190.0, r2 = -180.0, r3 = -40.0, r4 = -30.0, &end

# 52 GLU PHI:  (51 GLY C) - (52 GLU N) - (52 GLU CA) - (52 GLU C) -180.0 -40.0
 &rst     iat =   748,   750,   752,   763,
   r1 = -190.0, r2 = -180.0, r3 = -40.0, r4 = -30.0, &end

# 62 LYS PHI:  (61 GLU C) - (62 LYS N) - (62 LYS CA) - (62 LYS C) -180.0 -40.0
 &rst     iat =   899,   901,   903,   921,
   r1 = -190.0, r2 = -180.0, r3 = -40.0, r4 = -30.0, &end

# 63 TYR PHI:  (62 LYS C) - (63 TYR N) - (63 TYR CA) - (63 TYR C) -180.0 -40.0
 &rst     iat =   921,   923,   925,   942,
   r1 = -190.0, r2 = -180.0, r3 = -40.0, r4 = -30.0, &end

# 64 SER PHI:  (63 TYR C) - (64 SER N) - (64 SER CA) - (64 SER C) -180.0 -40.0
 &rst     iat =   942,   944,   946,   953,
   r1 = -190.0, r2 = -180.0, r3 = -40.0, r4 = -30.0, &end

# 65 PHE PHI:  (64 SER C) - (65 PHE N) - (65 PHE CA) - (65 PHE C) -180.0 -40.0
 &rst     iat =   953,   955,   957,   973,
   r1 = -190.0, r2 = -180.0, r3 = -40.0, r4 = -30.0, &end

# 79 LYS PHI:  (78 ASP C) - (79 LYS N) - (79 LYS CA) - (79 LYS C) 155.0 370.0
 &rst     iat =  1182,  1184,  1186,  1204,
   r1 = 145.0, r2 = 155.0, r3 = 370.0, r4 = 380.0, &end

# 80 SER PHI:  (79 LYS C) - (80 SER N) - (80 SER CA) - (80 SER C) 155.0 370.0
 &rst     iat =  1204,  1206,  1208,  1215,
   r1 = 145.0, r2 = 155.0, r3 = 370.0, r4 = 380.0, &end

# 81 ASP PHI:  (80 SER C) - (81 ASP N) - (81 ASP CA) - (81 ASP C) 155.0 370.0
 &rst     iat =  1215,  1217,  1219,  1227,
   r1 = 145.0, r2 = 155.0, r3 = 370.0, r4 = 380.0, &end

# 83 ALA PHI:  (82 GLU C) - (83 ALA N) - (83 ALA CA) - (83 ALA C) -180.0 -40.0
 &rst     iat =  1242,  1244,  1246,  1252,
   r1 = -190.0, r2 = -180.0, r3 = -40.0, r4 = -30.0, &end

# 84 GLU PHI:  (83 ALA C) - (84 GLU N) - (84 GLU CA) - (84 GLU C) -180.0 -40.0
 &rst     iat =  1252,  1254,  1256,  1267,
   r1 = -190.0, r2 = -180.0, r3 = -40.0, r4 = -30.0, &end

# 85 TYR PHI:  (84 GLU C) - (85 TYR N) - (85 TYR CA) - (85 TYR C) -180.0 -40.0
 &rst     iat =  1267,  1269,  1271,  1288,
   r1 = -190.0, r2 = -180.0, r3 = -40.0, r4 = -30.0, &end

# 86 ILE PHI:  (85 TYR C) - (86 ILE N) - (86 ILE CA) - (86 ILE C) -180.0 -40.0
 &rst     iat =  1288,  1290,  1292,  1307,
   r1 = -190.0, r2 = -180.0, r3 = -40.0, r4 = -30.0, &end

# 89 ALA PHI:  (88 ILE C) - (89 ALA N) - (89 ALA CA) - (89 ALA C) -180.0 -40.0
 &rst     iat =  1336,  1338,  1340,  1346,
   r1 = -190.0, r2 = -180.0, r3 = -40.0, r4 = -30.0, &end

# 90 GLU PHI:  (89 ALA C) - (90 GLU N) - (90 GLU CA) - (90 GLU C) -180.0 -40.0
 &rst     iat =  1346,  1348,  1350,  1361,
   r1 = -190.0, r2 = -180.0, r3 = -40.0, r4 = -30.0, &end

# 91 ASN PHI:  (90 GLU C) - (91 ASN N) - (91 ASN CA) - (91 ASN C) -180.0 -40.0
 &rst     iat =  1361,  1363,  1365,  1375,
   r1 = -190.0, r2 = -180.0, r3 = -40.0, r4 = -30.0, &end

# 97 ASP PHI:  (96 GLN C) - (97 ASP N) - (97 ASP CA) - (97 ASP C) -180.0 -40.0
 &rst     iat =  1446,  1448,  1450,  1458,
   r1 = -190.0, r2 = -180.0, r3 = -40.0, r4 = -30.0, &end

# 98 ALA PHI:  (97 ASP C) - (98 ALA N) - (98 ALA CA) - (98 ALA C) -180.0 -40.0
 &rst     iat =  1458,  1460,  1462,  1468,
   r1 = -190.0, r2 = -180.0, r3 = -40.0, r4 = -30.0, &end

# 99 THR PHI:  (98 ALA C) - (99 THR N) - (99 THR CA) - (99 THR C) -180.0 -40.0
 &rst     iat =  1468,  1470,  1472,  1482,
   r1 = -190.0, r2 = -180.0, r3 = -40.0, r4 = -30.0, &end

# 100 ILE PHI:  (99 THR C) - (100 ILE N) - (100 ILE CA) - (100 ILE C) -180.0 -40.0
 &rst     iat =  1482,  1484,  1486,  1501,
   r1 = -190.0, r2 = -180.0, r3 = -40.0, r4 = -30.0, &end

# 102 LEU PHI:  (101 HIS C) - (102 LEU N) - (102 LEU CA) - (102 LEU C) -180.0 -40.0
 &rst     iat =  1518,  1520,  1522,  1537,
   r1 = -190.0, r2 = -180.0, r3 = -40.0, r4 = -30.0, &end

# 103 LYS PHI:  (102 LEU C) - (103 LYS N) - (103 LYS CA) - (103 LYS C) -180.0 -40.0
 &rst     iat =  1537,  1539,  1541,  1559,
   r1 = -190.0, r2 = -180.0, r3 = -40.0, r4 = -30.0, &end

# 104 VAL PHI:  (103 LYS C) - (104 VAL N) - (104 VAL CA) - (104 VAL C) -180.0 -40.0
 &rst     iat =  1559,  1561,  1563,  1575,
   r1 = -190.0, r2 = -180.0, r3 = -40.0, r4 = -30.0, &end

# 104 VAL PHI:  (103 LYS C) - (104 VAL N) - (104 VAL CA) - (104 VAL C) -180.0 -40.0
 &rst     iat =  1559,  1561,  1563,  1575,
   r1 = -190.0, r2 = -180.0, r3 = -40.0, r4 = -30.0, &end

# 26 ASN PHI:  (25 ALA C) - (26 ASN N) - (26 ASN CA) - (26 ASN C)   0.0 120.0
 &rst     iat =   379,   381,   383,   393,
   r1 = -10.0, r2 =   0.0, r3 = 120.0, r4 = 130.0, &end

# 28 SER PHI:  (27 LEU C) - (28 SER N) - (28 SER CA) - (28 SER C)   0.0 120.0
 &rst     iat =   412,   414,   416,   423,
   r1 = -10.0, r2 =   0.0, r3 = 120.0, r4 = 130.0, &end

# 50 ASP PHI:  (49 LYS C) - (50 ASP N) - (50 ASP CA) - (50 ASP C)   0.0 120.0
 &rst     iat =   729,   731,   733,   741,
   r1 = -10.0, r2 =   0.0, r3 = 120.0, r4 = 130.0, &end

# 76 LYS PHI:  (75 LYS C) - (76 LYS N) - (76 LYS CA) - (76 LYS C)   0.0 120.0
 &rst     iat =  1132,  1134,  1136,  1154,
   r1 = -10.0, r2 =   0.0, r3 = 120.0, r4 = 130.0, &end

# 76 LYS PHI:  (75 LYS C) - (76 LYS N) - (76 LYS CA) - (76 LYS C)   0.0 120.0
 &rst     iat =  1132,  1134,  1136,  1154,
   r1 = -10.0, r2 =   0.0, r3 = 120.0, r4 = 130.0, &end

# 12 PRO PSI:  (12 PRO N) - (12 PRO CA) - (12 PRO C) - (13 SER N)  50.0 210.0
 &rst     iat =   175,   185,   187,   189,
   r1 =  40.0, r2 =  50.0, r3 = 210.0, r4 = 220.0, &end

# 13 SER PSI:  (13 SER N) - (13 SER CA) - (13 SER C) - (14 VAL N)  50.0 210.0
 &rst     iat =   189,   191,   198,   200,
   r1 =  40.0, r2 =  50.0, r3 = 210.0, r4 = 220.0, &end

# 14 VAL PSI:  (14 VAL N) - (14 VAL CA) - (14 VAL C) - (15 ARG N)  50.0 210.0
 &rst     iat =   200,   202,   214,   216,
   r1 =  40.0, r2 =  50.0, r3 = 210.0, r4 = 220.0, &end

# 15 ARG PSI:  (15 ARG N) - (15 ARG CA) - (15 ARG C) - (16 ALA N)  50.0 210.0
 &rst     iat =   216,   218,   238,   240,
   r1 =  40.0, r2 =  50.0, r3 = 210.0, r4 = 220.0, &end

# 20 THR PSI:  (20 THR N) - (20 THR CA) - (20 THR C) - (21 MET N)  50.0 210.0
 &rst     iat =   302,   304,   314,   316,
   r1 =  40.0, r2 =  50.0, r3 = 210.0, r4 = 220.0, &end

# 21 MET PSI:  (21 MET N) - (21 MET CA) - (21 MET C) - (22 ASN N)  50.0 210.0
 &rst     iat =   316,   318,   331,   333,
   r1 =  40.0, r2 =  50.0, r3 = 210.0, r4 = 220.0, &end

# 22 ASN PSI:  (22 ASN N) - (22 ASN CA) - (22 ASN C) - (23 ALA N)  50.0 210.0
 &rst     iat =   333,   335,   345,   347,
   r1 =  40.0, r2 =  50.0, r3 = 210.0, r4 = 220.0, &end

# 23 ALA PSI:  (23 ALA N) - (23 ALA CA) - (23 ALA C) - (24 THR N)  50.0 210.0
 &rst     iat =   347,   349,   355,   357,
   r1 =  40.0, r2 =  50.0, r3 = 210.0, r4 = 220.0, &end

# 30 SER PSI:  (30 SER N) - (30 SER CA) - (30 SER C) - (31 VAL N)  50.0 210.0
 &rst     iat =   442,   444,   451,   453,
   r1 =  40.0, r2 =  50.0, r3 = 210.0, r4 = 220.0, &end

# 31 VAL PSI:  (31 VAL N) - (31 VAL CA) - (31 VAL C) - (32 THR N)  50.0 210.0
 &rst     iat =   453,   455,   467,   469,
   r1 =  40.0, r2 =  50.0, r3 = 210.0, r4 = 220.0, &end

# 32 THR PSI:  (32 THR N) - (32 THR CA) - (32 THR C) - (33 LEU N)  50.0 210.0
 &rst     iat =   469,   471,   481,   483,
   r1 =  40.0, r2 =  50.0, r3 = 210.0, r4 = 220.0, &end

# 33 LEU PSI:  (33 LEU N) - (33 LEU CA) - (33 LEU C) - (34 ALA N)  50.0 210.0
 &rst     iat =   483,   485,   500,   502,
   r1 =  40.0, r2 =  50.0, r3 = 210.0, r4 = 220.0, &end

# 34 ALA PSI:  (34 ALA N) - (34 ALA CA) - (34 ALA C) - (35 CYS N)  50.0 210.0
 &rst     iat =   502,   504,   510,   512,
   r1 =  40.0, r2 =  50.0, r3 = 210.0, r4 = 220.0, &end

# 35 CYS PSI:  (35 CYS N) - (35 CYS CA) - (35 CYS C) - (36 ASP N)  50.0 210.0
 &rst     iat =   512,   514,   520,   522,
   r1 =  40.0, r2 =  50.0, r3 = 210.0, r4 = 220.0, &end

# 36 ASP PSI:  (36 ASP N) - (36 ASP CA) - (36 ASP C) - (37 ALA N)  50.0 210.0
 &rst     iat =   522,   524,   532,   534,
   r1 =  40.0, r2 =  50.0, r3 = 210.0, r4 = 220.0, &end

# 37 ALA PSI:  (37 ALA N) - (37 ALA CA) - (37 ALA C) - (38 ASP N)  50.0 210.0
 &rst     iat =   534,   536,   542,   544,
   r1 =  40.0, r2 =  50.0, r3 = 210.0, r4 = 220.0, &end

# 38 ASP PSI:  (38 ASP N) - (38 ASP CA) - (38 ASP C) - (39 GLY N)  50.0 210.0
 &rst     iat =   544,   546,   554,   556,
   r1 =  40.0, r2 =  50.0, r3 = 210.0, r4 = 220.0, &end

# 44 THR PSI:  (44 THR N) - (44 THR CA) - (44 THR C) - (45 MET N)  50.0 210.0
 &rst     iat =   626,   628,   638,   640,
   r1 =  40.0, r2 =  50.0, r3 = 210.0, r4 = 220.0, &end

# 45 MET PSI:  (45 MET N) - (45 MET CA) - (45 MET C) - (46 THR N)  50.0 210.0
 &rst     iat =   640,   642,   655,   657,
   r1 =  40.0, r2 =  50.0, r3 = 210.0, r4 = 220.0, &end

# 46 THR PSI:  (46 THR N) - (46 THR CA) - (46 THR C) - (47 TRP N)  50.0 210.0
 &rst     iat =   657,   659,   669,   671,
   r1 =  40.0, r2 =  50.0, r3 = 210.0, r4 = 220.0, &end

# 47 TRP PSI:  (47 TRP N) - (47 TRP CA) - (47 TRP C) - (48 THR N)  50.0 210.0
 &rst     iat =   671,   673,   693,   695,
   r1 =  40.0, r2 =  50.0, r3 = 210.0, r4 = 220.0, &end

# 48 THR PSI:  (48 THR N) - (48 THR CA) - (48 THR C) - (49 LYS N)  50.0 210.0
 &rst     iat =   695,   697,   707,   709,
   r1 =  40.0, r2 =  50.0, r3 = 210.0, r4 = 220.0, &end

# 49 LYS PSI:  (49 LYS N) - (49 LYS CA) - (49 LYS C) - (50 ASP N)  50.0 210.0
 &rst     iat =   709,   711,   729,   731,
   r1 =  40.0, r2 =  50.0, r3 = 210.0, r4 = 220.0, &end

# 52 GLU PSI:  (52 GLU N) - (52 GLU CA) - (52 GLU C) - (53 PRO N)  50.0 210.0
 &rst     iat =   750,   752,   763,   765,
   r1 =  40.0, r2 =  50.0, r3 = 210.0, r4 = 220.0, &end

# 62 LYS PSI:  (62 LYS N) - (62 LYS CA) - (62 LYS C) - (63 TYR N)  50.0 210.0
 &rst     iat =   901,   903,   921,   923,
   r1 =  40.0, r2 =  50.0, r3 = 210.0, r4 = 220.0, &end

# 63 TYR PSI:  (63 TYR N) - (63 TYR CA) - (63 TYR C) - (64 SER N)  50.0 210.0
 &rst     iat =   923,   925,   942,   944,
   r1 =  40.0, r2 =  50.0, r3 = 210.0, r4 = 220.0, &end

# 64 SER PSI:  (64 SER N) - (64 SER CA) - (64 SER C) - (65 PHE N)  50.0 210.0
 &rst     iat =   944,   946,   953,   955,
   r1 =  40.0, r2 =  50.0, r3 = 210.0, r4 = 220.0, &end

# 65 PHE PSI:  (65 PHE N) - (65 PHE CA) - (65 PHE C) - (66 ASN N)  50.0 210.0
 &rst     iat =   955,   957,   973,   975,
   r1 =  40.0, r2 =  50.0, r3 = 210.0, r4 = 220.0, &end

# 79 LYS PSI:  (79 LYS N) - (79 LYS CA) - (79 LYS C) - (80 SER N) -120.0  30.0
 &rst     iat =  1184,  1186,  1204,  1206,
   r1 = -130.0, r2 = -120.0, r3 =  30.0, r4 =  40.0, &end

# 80 SER PSI:  (80 SER N) - (80 SER CA) - (80 SER C) - (81 ASP N) -120.0  30.0
 &rst     iat =  1206,  1208,  1215,  1217,
   r1 = -130.0, r2 = -120.0, r3 =  30.0, r4 =  40.0, &end

# 81 ASP PSI:  (81 ASP N) - (81 ASP CA) - (81 ASP C) - (82 GLU N) -120.0  30.0
 &rst     iat =  1217,  1219,  1227,  1229,
   r1 = -130.0, r2 = -120.0, r3 =  30.0, r4 =  40.0, &end

# 83 ALA PSI:  (83 ALA N) - (83 ALA CA) - (83 ALA C) - (84 GLU N)  50.0 210.0
 &rst     iat =  1244,  1246,  1252,  1254,
   r1 =  40.0, r2 =  50.0, r3 = 210.0, r4 = 220.0, &end

# 84 GLU PSI:  (84 GLU N) - (84 GLU CA) - (84 GLU C) - (85 TYR N)  50.0 210.0
 &rst     iat =  1254,  1256,  1267,  1269,
   r1 =  40.0, r2 =  50.0, r3 = 210.0, r4 = 220.0, &end

# 85 TYR PSI:  (85 TYR N) - (85 TYR CA) - (85 TYR C) - (86 ILE N)  50.0 210.0
 &rst     iat =  1269,  1271,  1288,  1290,
   r1 =  40.0, r2 =  50.0, r3 = 210.0, r4 = 220.0, &end

# 86 ILE PSI:  (86 ILE N) - (86 ILE CA) - (86 ILE C) - (87 CYS N)  50.0 210.0
 &rst     iat =  1290,  1292,  1307,  1309,
   r1 =  40.0, r2 =  50.0, r3 = 210.0, r4 = 220.0, &end

# 89 ALA PSI:  (89 ALA N) - (89 ALA CA) - (89 ALA C) - (90 GLU N)  50.0 210.0
 &rst     iat =  1338,  1340,  1346,  1348,
   r1 =  40.0, r2 =  50.0, r3 = 210.0, r4 = 220.0, &end

# 90 GLU PSI:  (90 GLU N) - (90 GLU CA) - (90 GLU C) - (91 ASN N)  50.0 210.0
 &rst     iat =  1348,  1350,  1361,  1363,
   r1 =  40.0, r2 =  50.0, r3 = 210.0, r4 = 220.0, &end

# 91 ASN PSI:  (91 ASN N) - (91 ASN CA) - (91 ASN C) - (92 LYS N)  50.0 210.0
 &rst     iat =  1363,  1365,  1375,  1377,
   r1 =  40.0, r2 =  50.0, r3 = 210.0, r4 = 220.0, &end

# 97 ASP PSI:  (97 ASP N) - (97 ASP CA) - (97 ASP C) - (98 ALA N)  50.0 210.0
 &rst     iat =  1448,  1450,  1458,  1460,
   r1 =  40.0, r2 =  50.0, r3 = 210.0, r4 = 220.0, &end

# 98 ALA PSI:  (98 ALA N) - (98 ALA CA) - (98 ALA C) - (99 THR N)  50.0 210.0
 &rst     iat =  1460,  1462,  1468,  1470,
   r1 =  40.0, r2 =  50.0, r3 = 210.0, r4 = 220.0, &end

# 99 THR PSI:  (99 THR N) - (99 THR CA) - (99 THR C) - (100 ILE N)  50.0 210.0
 &rst     iat =  1470,  1472,  1482,  1484,
   r1 =  40.0, r2 =  50.0, r3 = 210.0, r4 = 220.0, &end

# 100 ILE PSI:  (100 ILE N) - (100 ILE CA) - (100 ILE C) - (101 HIS N)  50.0 210.0
 &rst     iat =  1484,  1486,  1501,  1503,
   r1 =  40.0, r2 =  50.0, r3 = 210.0, r4 = 220.0, &end

# 102 LEU PSI:  (102 LEU N) - (102 LEU CA) - (102 LEU C) - (103 LYS N)  50.0 210.0
 &rst     iat =  1520,  1522,  1537,  1539,
   r1 =  40.0, r2 =  50.0, r3 = 210.0, r4 = 220.0, &end

# 103 LYS PSI:  (103 LYS N) - (103 LYS CA) - (103 LYS C) - (104 VAL N)  50.0 210.0
 &rst     iat =  1539,  1541,  1559,  1561,
   r1 =  40.0, r2 =  50.0, r3 = 210.0, r4 = 220.0, &end

# 104 VAL PSI:  (104 VAL N) - (104 VAL CA) - (104 VAL C) - (105 PHE N)  50.0 210.0
 &rst     iat =  1561,  1563,  1575,  1577,
   r1 =  40.0, r2 =  50.0, r3 = 210.0, r4 = 220.0, &end

# 104 VAL PSI:  (104 VAL N) - (104 VAL CA) - (104 VAL C) - (105 PHE N)  50.0 210.0
 &rst     iat =  1561,  1563,  1575,  1577,
   r1 =  40.0, r2 =  50.0, r3 = 210.0, r4 = 220.0, &end

# 4 ILE CHI1:  (4 ILE N) - (4 ILE CA) - (4 ILE CB) - (4 ILE CG1) -80.0 -40.0
 &rst     iat =    44,    46,    48,    54,
   r1 = -90.0, r2 = -80.0, r3 = -40.0, r4 = -30.0, &end

# 6 VAL CHI1:  (6 VAL N) - (6 VAL CA) - (6 VAL CB) - (6 VAL CG1) 160.0 200.0
 &rst     iat =    80,    82,    84,    86,
   r1 = 150.0, r2 = 160.0, r3 = 200.0, r4 = 210.0, &end

# 7 ILE CHI1:  (7 ILE N) - (7 ILE CA) - (7 ILE CB) - (7 ILE CG1) -80.0 -40.0
 &rst     iat =    96,    98,   100,   106,
   r1 = -90.0, r2 = -80.0, r3 = -40.0, r4 = -30.0, &end

# 8 VAL CHI1:  (8 VAL N) - (8 VAL CA) - (8 VAL CB) - (8 VAL CG1) 160.0 200.0
 &rst     iat =   115,   117,   119,   121,
   r1 = 150.0, r2 = 160.0, r3 = 200.0, r4 = 210.0, &end

# 10 VAL CHI1:  (10 VAL N) - (10 VAL CA) - (10 VAL CB) - (10 VAL CG1) 160.0 200.0
 &rst     iat =   145,   147,   149,   151,
   r1 = 150.0, r2 = 160.0, r3 = 200.0, r4 = 210.0, &end

# 20 THR CHI1:  (20 THR N) - (20 THR CA) - (20 THR CB) - (20 THR OG1) -80.0 -40.0
 &rst     iat =   302,   304,   306,   312,
   r1 = -90.0, r2 = -80.0, r3 = -40.0, r4 = -30.0, &end

# 21 MET CHI1:  (21 MET N) - (21 MET CA) - (21 MET CB) - (21 MET CG) -80.0 -40.0
 &rst     iat =   316,   318,   320,   323,
   r1 = -90.0, r2 = -80.0, r3 = -40.0, r4 = -30.0, &end

# 24 THR CHI1:  (24 THR N) - (24 THR CA) - (24 THR CB) - (24 THR OG1) -80.0 -40.0
 &rst     iat =   357,   359,   361,   367,
   r1 = -90.0, r2 = -80.0, r3 = -40.0, r4 = -30.0, &end

# 31 VAL CHI1:  (31 VAL N) - (31 VAL CA) - (31 VAL CB) - (31 VAL CG1) 160.0 200.0
 &rst     iat =   453,   455,   457,   459,
   r1 = 150.0, r2 = 160.0, r3 = 200.0, r4 = 210.0, &end

# 33 LEU CHI1:  (33 LEU N) - (33 LEU CA) - (33 LEU CB) - (33 LEU CG)  40.0  80.0
 &rst     iat =   483,   485,   487,   490,
   r1 =  30.0, r2 =  40.0, r3 =  80.0, r4 =  90.0, &end

# 36 ASP CHI1:  (36 ASP N) - (36 ASP CA) - (36 ASP CB) - (36 ASP CG)  40.0  80.0
 &rst     iat =   522,   524,   526,   529,
   r1 =  30.0, r2 =  40.0, r3 =  80.0, r4 =  90.0, &end

# 44 THR CHI1:  (44 THR N) - (44 THR CA) - (44 THR CB) - (44 THR OG1) -80.0 -40.0
 &rst     iat =   626,   628,   630,   636,
   r1 = -90.0, r2 = -80.0, r3 = -40.0, r4 = -30.0, &end

# 45 MET CHI1:  (45 MET N) - (45 MET CA) - (45 MET CB) - (45 MET CG)  40.0  80.0
 &rst     iat =   640,   642,   644,   647,
   r1 =  30.0, r2 =  40.0, r3 =  80.0, r4 =  90.0, &end

# 47 TRP CHI1:  (47 TRP N) - (47 TRP CA) - (47 TRP CB) - (47 TRP CG)  40.0  80.0
 &rst     iat =   671,   673,   675,   678,
   r1 =  30.0, r2 =  40.0, r3 =  80.0, r4 =  90.0, &end

# 52 GLU CHI1:  (52 GLU N) - (52 GLU CA) - (52 GLU CB) - (52 GLU CG)  40.0  80.0
 &rst     iat =   750,   752,   754,   757,
   r1 =  30.0, r2 =  40.0, r3 =  80.0, r4 =  90.0, &end

# 54 ILE CHI1:  (54 ILE N) - (54 ILE CA) - (54 ILE CB) - (54 ILE CG1) -80.0 -40.0
 &rst     iat =   779,   781,   783,   789,
   r1 = -90.0, r2 = -80.0, r3 = -40.0, r4 = -30.0, &end

# 55 GLU CHI1:  (55 GLU N) - (55 GLU CA) - (55 GLU CB) - (55 GLU CG)  40.0  80.0
 &rst     iat =   798,   800,   802,   805,
   r1 =  30.0, r2 =  40.0, r3 =  80.0, r4 =  90.0, &end

# 65 PHE CHI1:  (65 PHE N) - (65 PHE CA) - (65 PHE CB) - (65 PHE CG)  40.0  80.0
 &rst     iat =   955,   957,   959,   962,
   r1 =  30.0, r2 =  40.0, r3 =  80.0, r4 =  90.0, &end

# 73 ILE CHI1:  (73 ILE N) - (73 ILE CA) - (73 ILE CB) - (73 ILE CG1) -80.0 -40.0
 &rst     iat =  1074,  1076,  1078,  1084,
   r1 = -90.0, r2 = -80.0, r3 = -40.0, r4 = -30.0, &end

# 74 ILE CHI1:  (74 ILE N) - (74 ILE CA) - (74 ILE CB) - (74 ILE CG1) -80.0 -40.0
 &rst     iat =  1093,  1095,  1097,  1103,
   r1 = -90.0, r2 = -80.0, r3 = -40.0, r4 = -30.0, &end

# 77 VAL CHI1:  (77 VAL N) - (77 VAL CA) - (77 VAL CB) - (77 VAL CG1) 160.0 200.0
 &rst     iat =  1156,  1158,  1160,  1162,
   r1 = 150.0, r2 = 160.0, r3 = 200.0, r4 = 210.0, &end

# 80 SER CHI1:  (80 SER N) - (80 SER CA) - (80 SER CB) - (80 SER OG)  40.0  80.0
 &rst     iat =  1206,  1208,  1210,  1213,
   r1 =  30.0, r2 =  40.0, r3 =  80.0, r4 =  90.0, &end

# 86 ILE CHI1:  (86 ILE N) - (86 ILE CA) - (86 ILE CB) - (86 ILE CG1) -80.0 -40.0
 &rst     iat =  1290,  1292,  1294,  1300,
   r1 = -90.0, r2 = -80.0, r3 = -40.0, r4 = -30.0, &end

# 87 CYS CHI1:  (87 CYS N) - (87 CYS CA) - (87 CYS CB) - (87 CYS SG)  40.0  80.0
 &rst     iat =  1309,  1311,  1313,  1316,
   r1 =  30.0, r2 =  40.0, r3 =  80.0, r4 =  90.0, &end

# 88 ILE CHI1:  (88 ILE N) - (88 ILE CA) - (88 ILE CB) - (88 ILE CG1) -80.0 -40.0
 &rst     iat =  1319,  1321,  1323,  1329,
   r1 = -90.0, r2 = -80.0, r3 = -40.0, r4 = -30.0, &end

# 99 THR CHI1:  (99 THR N) - (99 THR CA) - (99 THR CB) - (99 THR OG1) -80.0 -40.0
 &rst     iat =  1470,  1472,  1474,  1480,
   r1 = -90.0, r2 = -80.0, r3 = -40.0, r4 = -30.0, &end

# 105 PHE CHI1:  (105 PHE N) - (105 PHE CA) - (105 PHE CB) - (105 PHE CG)  40.0  80.0
 &rst     iat =  1577,  1579,  1581,  1584,
   r1 =  30.0, r2 =  40.0, r3 =  80.0, r4 =  90.0, &end


  Entry H atom name         Submitted Coord H atom name
  Start of MODEL    1
    1   1H    GLY   1          H1        GLY   1  -4.954  -0.036   4.064
    2   2H    GLY   1          H2        GLY   1  -3.778  -0.710   3.136
    3   3H    GLY   1          H3        GLY   1  -3.383   0.195   4.436
    4   1HA   GLY   1          HA2       GLY   1  -4.787   1.192   2.055
    5   2HA   GLY   1          HA3       GLY   1  -4.288   2.159   3.478
    6    H    LYS   2           H        LYS   2  -3.558   2.649   0.709
    7    HA   LYS   2           HA       LYS   2  -0.658   2.828   0.971
    8   1HB   LYS   2          HB2       LYS   2  -0.047   1.545  -1.004
    9   2HB   LYS   2          HB3       LYS   2  -0.843   0.481   0.181
   10   1HG   LYS   2          HG2       LYS   2  -2.933   0.569  -1.170
   11   2HG   LYS   2          HG3       LYS   2  -2.142   1.722  -2.285
   12   1HD   LYS   2          HD2       LYS   2  -0.352   0.016  -2.734
   13   2HD   LYS   2          HD3       LYS   2  -1.277  -1.156  -1.783
   14   1HE   LYS   2          HE2       LYS   2  -3.141  -1.110  -3.268
   15   2HE   LYS   2          HE3       LYS   2  -2.566   0.348  -4.084
   16   1HZ   LYS   2          HZ1       LYS   2  -0.751  -0.920  -5.005
   17   2HZ   LYS   2          HZ2       LYS   2  -1.212  -2.304  -4.195
   18   3HZ   LYS   2          HZ3       LYS   2  -2.146  -1.652  -5.370
   19    H    ASP   3           H        ASP   3   0.391   3.908  -0.768
   20    HA   ASP   3           HA       ASP   3  -1.176   6.133  -1.886
   21   1HB   ASP   3          HB2       ASP   3   1.038   6.469  -0.888
   22   2HB   ASP   3          HB3       ASP   3   1.780   5.387  -2.038
   23    H    ILE   4           H        ILE   4   0.944   3.661  -3.239
   24    HA   ILE   4           HA       ILE   4  -0.829   2.954  -5.444
   25    HB   ILE   4           HB       ILE   4   1.959   3.884  -6.226
   26   1HG1  ILE   4          2HG1      ILE   4  -0.632   5.384  -6.772
   27   2HG1  ILE   4          3HG1      ILE   4   0.656   5.938  -5.708
   28   1HG2  ILE   4          1HG2      ILE   4  -0.445   3.091  -7.947
   29   2HG2  ILE   4          2HG2      ILE   4   1.202   3.468  -8.517
   30   3HG2  ILE   4          3HG2      ILE   4   0.929   2.032  -7.571
   31   1HD1  ILE   4          1HD1      ILE   4   2.202   5.836  -7.731
   32   2HD1  ILE   4          2HD1      ILE   4   0.707   5.682  -8.701
   33   3HD1  ILE   4          3HD1      ILE   4   0.964   7.101  -7.703
   34    H    GLN   5           H        GLN   5   2.535   2.699  -4.290
   35    HA   GLN   5           HA       GLN   5   2.250  -0.196  -3.752
   36   1HB   GLN   5          HB2       GLN   5   4.450   1.006  -5.512
   37   2HB   GLN   5          HB3       GLN   5   4.436  -0.643  -4.882
   38   1HG   GLN   5          HG2       GLN   5   2.308  -1.074  -6.131
   39   2HG   GLN   5          HG3       GLN   5   2.521   0.494  -6.933
   40   1HE2  GLN   5          1HE2      GLN   5   4.055  -2.401  -8.910
   41   2HE2  GLN   5          2HE2      GLN   5   2.512  -2.310  -8.043
   42    H    VAL   6           H        VAL   6   2.331   2.014  -2.026
   43    HA   VAL   6           HA       VAL   6   4.601   1.395  -0.277
   44    HB   VAL   6           HB       VAL   6   4.037   4.313  -0.994
   45   1HG1  VAL   6          1HG1      VAL   6   6.143   4.720   0.261
   46   2HG1  VAL   6          2HG1      VAL   6   5.004   3.923   1.311
   47   3HG1  VAL   6          3HG1      VAL   6   6.322   2.997   0.592
   48   1HG2  VAL   6          1HG2      VAL   6   5.103   3.334  -2.950
   49   2HG2  VAL   6          2HG2      VAL   6   6.264   4.341  -2.087
   50   3HG2  VAL   6          3HG2      VAL   6   6.357   2.565  -1.941
   51    H    ILE   7           H        ILE   7   3.974   1.558   1.873
   52    HA   ILE   7           HA       ILE   7   1.092   1.855   2.352
   53    HB   ILE   7           HB       ILE   7   3.385   1.055   4.227
   54   1HG1  ILE   7          2HG1      ILE   7   2.200  -1.170   4.170
   55   2HG1  ILE   7          3HG1      ILE   7   1.211  -0.585   2.868
   56   1HG2  ILE   7          1HG2      ILE   7   1.466   2.050   5.530
   57   2HG2  ILE   7          2HG2      ILE   7   0.353   1.021   4.640
   58   3HG2  ILE   7          3HG2      ILE   7   1.562   0.314   5.752
   59   1HD1  ILE   7          1HD1      ILE   7   4.233  -0.800   2.691
   60   2HD1  ILE   7          2HD1      ILE   7   3.126  -2.067   2.198
   61   3HD1  ILE   7          3HD1      ILE   7   3.077  -0.537   1.343
   62    H    VAL   8           H        VAL   8   0.573   3.935   2.072
   63    HA   VAL   8           HA       VAL   8   1.149   5.832   4.252
   64    HB   VAL   8           HB       VAL   8   1.200   6.684   1.324
   65   1HG1  VAL   8          1HG1      VAL   8   1.888   8.156   3.922
   66   2HG1  VAL   8          2HG1      VAL   8   2.106   8.813   2.291
   67   3HG1  VAL   8          3HG1      VAL   8   0.481   8.475   2.891
   68   1HG2  VAL   8          1HG2      VAL   8   3.594   7.198   1.566
   69   2HG2  VAL   8          2HG2      VAL   8   3.599   6.345   3.155
   70   3HG2  VAL   8          3HG2      VAL   8   3.259   5.484   1.617
   71    H    ASN   9           H        ASN   9  -0.724   7.094   4.610
   72    HA   ASN   9           HA       ASN   9  -3.003   6.886   2.717
   73   1HB   ASN   9          HB2       ASN   9  -4.574   6.501   4.492
   74   2HB   ASN   9          HB3       ASN   9  -3.326   5.266   4.572
   75   1HD2  ASN   9          1HD2      ASN   9  -1.681   5.485   6.358
   76   2HD2  ASN   9          2HD2      ASN   9  -2.208   6.316   7.807
   77    H    VAL  10           H        VAL  10  -3.284   8.682   1.919
   78    HA   VAL  10           HA       VAL  10  -2.301  11.184   3.142
   79    HB   VAL  10           HB       VAL  10  -3.127  10.510   0.303
   80   1HG1  VAL  10          1HG1      VAL  10  -3.467  12.900   0.617
   81   2HG1  VAL  10          2HG1      VAL  10  -1.852  13.033   1.403
   82   3HG1  VAL  10          3HG1      VAL  10  -2.024  12.604  -0.326
   83   1HG2  VAL  10          1HG2      VAL  10  -0.393  10.905   1.557
   84   2HG2  VAL  10          2HG2      VAL  10  -1.063   9.384   0.949
   85   3HG2  VAL  10          3HG2      VAL  10  -0.720  10.681  -0.197
   86    HA   PRO  11           HA       PRO  11  -6.700  12.238   4.072
   87   1HB   PRO  11          HB2       PRO  11  -5.374  14.905   4.520
   88   2HB   PRO  11          HB3       PRO  11  -6.617  14.077   5.516
   89   1HG   PRO  11          HG2       PRO  11  -4.031  14.070   6.267
   90   2HG   PRO  11          HG3       PRO  11  -4.983  12.553   6.369
   91   1HD   PRO  11          HD2       PRO  11  -3.038  13.389   4.223
   92   2HD   PRO  11          HD3       PRO  11  -3.189  11.806   5.053
   93    HA   PRO  12           HA       PRO  12  -7.732  13.944   0.224
   94   1HB   PRO  12          HB2       PRO  12 -10.334  14.793   0.472
   95   2HB   PRO  12          HB3       PRO  12  -9.849  13.083   0.706
   96   1HG   PRO  12          HG2       PRO  12 -10.318  15.225   2.801
   97   2HG   PRO  12          HG3       PRO  12 -10.886  13.509   2.748
   98   1HD   PRO  12          HD2       PRO  12  -8.627  14.356   4.131
   99   2HD   PRO  12          HD3       PRO  12  -8.860  12.695   3.530
  100    H    SER  13           H        SER  13  -8.151  15.797  -1.039
  101    HA   SER  13           HA       SER  13  -8.018  18.484   0.262
  102   1HB   SER  13          HB2       SER  13  -5.700  17.804  -0.267
  103   2HB   SER  13          HB3       SER  13  -6.149  17.559  -1.955
  104    HG   SER  13           HG       SER  13  -6.087  19.981  -0.476
  105    H    VAL  14           H        VAL  14  -9.960  19.198  -0.338
  106    HA   VAL  14           HA       VAL  14 -10.678  19.126  -3.231
  107    HB   VAL  14           HB       VAL  14 -12.357  18.054  -1.736
  108   1HG1  VAL  14          1HG1      VAL  14 -13.022  20.847  -0.720
  109   2HG1  VAL  14          2HG1      VAL  14 -13.767  19.291  -0.270
  110   3HG1  VAL  14          3HG1      VAL  14 -12.108  19.664   0.236
  111   1HG2  VAL  14          1HG2      VAL  14 -13.340  20.574  -3.090
  112   2HG2  VAL  14          2HG2      VAL  14 -13.017  19.036  -3.901
  113   3HG2  VAL  14          3HG2      VAL  14 -14.309  19.151  -2.683
  114    H    ARG  15           H        ARG  15 -10.991  21.095  -4.269
  115    HA   ARG  15           HA       ARG  15 -11.150  23.577  -2.676
  116   1HB   ARG  15          HB2       ARG  15  -9.322  24.690  -3.590
  117   2HB   ARG  15          HB3       ARG  15  -8.720  23.129  -2.968
  118   1HG   ARG  15          HG2       ARG  15  -9.223  23.938  -5.871
  119   2HG   ARG  15          HG3       ARG  15  -7.666  23.909  -5.078
  120   1HD   ARG  15          HD2       ARG  15  -9.400  21.522  -5.760
  121   2HD   ARG  15          HD3       ARG  15  -7.947  22.030  -6.562
  122    HE   ARG  15           HE       ARG  15  -7.491  21.442  -3.738
  123   1HH1  ARG  15          1HH1      ARG  15  -6.614  18.635  -6.459
  124   2HH1  ARG  15          2HH1      ARG  15  -7.687  19.943  -6.928
  125   1HH2  ARG  15          1HH2      ARG  15  -6.247  19.622  -3.202
  126   2HH2  ARG  15          2HH2      ARG  15  -5.853  18.480  -4.454
  127    H    ALA  16           H        ALA  16 -11.774  25.447  -3.739
  128    HA   ALA  16           HA       ALA  16 -13.737  24.905  -5.869
  129   1HB   ALA  16          HB1       ALA  16 -14.405  26.160  -3.917
  130   2HB   ALA  16          HB2       ALA  16 -13.138  27.384  -4.187
  131   3HB   ALA  16          HB3       ALA  16 -14.464  27.188  -5.372
  132    H    ARG  17           H        ARG  17 -12.659  24.563  -7.633
  133    HA   ARG  17           HA       ARG  17 -10.357  25.179  -8.693
  134   1HB   ARG  17          HB2       ARG  17 -12.051  23.788  -9.761
  135   2HB   ARG  17          HB3       ARG  17 -12.820  25.238 -10.443
  136   1HG   ARG  17          HG2       ARG  17 -10.846  25.734 -11.752
  137   2HG   ARG  17          HG3       ARG  17  -9.933  24.453 -10.982
  138   1HD   ARG  17          HD2       ARG  17 -12.447  23.969 -12.644
  139   2HD   ARG  17          HD3       ARG  17 -10.832  24.059 -13.354
  140    HE   ARG  17           HE       ARG  17 -12.001  21.777 -12.035
  141   1HH1  ARG  17          1HH1      ARG  17 -10.974  19.940 -11.968
  142   2HH1  ARG  17          2HH1      ARG  17  -9.216  19.864 -12.041
  143   1HH2  ARG  17          1HH2      ARG  17  -8.839  23.252 -12.525
  144   2HH2  ARG  17          2HH2      ARG  17  -8.008  21.721 -12.361
  145    H    GLN  18           H        GLN  18 -12.902  27.672  -9.078
  146    HA   GLN  18           HA       GLN  18 -10.679  29.647  -9.231
  147   1HB   GLN  18          HB2       GLN  18 -11.507  30.850 -11.121
  148   2HB   GLN  18          HB3       GLN  18 -11.254  29.165 -11.562
  149   1HG   GLN  18          HG2       GLN  18 -13.677  28.708 -11.406
  150   2HG   GLN  18          HG3       GLN  18 -13.995  30.398 -10.971
  151   1HE2  GLN  18          1HE2      GLN  18 -12.970  29.498 -14.864
  152   2HE2  GLN  18          2HE2      GLN  18 -12.687  28.308 -13.609
  153    H    SER  19           H        SER  19 -13.094  28.844  -7.397
  154    HA   SER  19           HA       SER  19 -14.176  29.774  -5.670
  155   1HB   SER  19          HB2       SER  19 -11.994  30.959  -5.442
  156   2HB   SER  19          HB3       SER  19 -12.734  32.349  -6.289
  157    HG   SER  19           HG       SER  19 -12.900  32.559  -4.016
  158    H    THR  20           H        THR  20 -14.381  31.935  -8.472
  159    HA   THR  20           HA       THR  20 -17.342  32.280  -8.004
  160    HB   THR  20           HB       THR  20 -15.402  34.583  -8.616
  161    HG1  THR  20           HG1      THR  20 -15.426  33.979  -6.420
  162   1HG2  THR  20          1HG2      THR  20 -17.435  35.981  -8.294
  163   2HG2  THR  20          2HG2      THR  20 -17.577  34.938  -9.702
  164   3HG2  THR  20          3HG2      THR  20 -18.437  34.484  -8.233
  165    H    MET  21           H        MET  21 -18.300  31.523  -9.667
  166    HA   MET  21           HA       MET  21 -17.280  31.824 -12.441
  167   1HB   MET  21          HB2       MET  21 -19.584  30.291 -11.159
  168   2HB   MET  21          HB3       MET  21 -19.336  30.352 -12.890
  169   1HG   MET  21          HG2       MET  21 -17.372  29.231 -10.850
  170   2HG   MET  21          HG3       MET  21 -18.480  28.290 -11.822
  171   1HE   MET  21          HE1       MET  21 -18.054  30.094 -14.779
  172   2HE   MET  21          HE2       MET  21 -17.018  28.855 -15.500
  173   3HE   MET  21          HE3       MET  21 -18.472  28.378 -14.566
  174    H    ASN  22           H        ASN  22 -18.949  32.514 -14.070
  175    HA   ASN  22           HA       ASN  22 -21.288  33.950 -13.088
  176   1HB   ASN  22          HB2       ASN  22 -20.790  36.057 -14.159
  177   2HB   ASN  22          HB3       ASN  22 -19.498  35.666 -13.030
  178   1HD2  ASN  22          1HD2      ASN  22 -16.996  35.492 -15.527
  179   2HD2  ASN  22          2HD2      ASN  22 -17.381  35.193 -13.851
  180    H    ALA  23           H        ALA  23 -22.815  34.448 -14.868
  181    HA   ALA  23           HA       ALA  23 -22.272  33.316 -17.525
  182   1HB   ALA  23          HB1       ALA  23 -24.220  31.952 -15.620
  183   2HB   ALA  23          HB2       ALA  23 -24.084  31.619 -17.384
  184   3HB   ALA  23          HB3       ALA  23 -22.735  31.249 -16.283
  185    H    THR  24           H        THR  24 -23.741  33.819 -19.079
  186    HA   THR  24           HA       THR  24 -25.609  36.030 -18.473
  187    HB   THR  24           HB       THR  24 -24.935  34.832 -21.159
  188    HG1  THR  24           HG1      THR  24 -23.071  35.734 -20.069
  189   1HG2  THR  24          1HG2      THR  24 -26.073  37.538 -20.337
  190   2HG2  THR  24          2HG2      THR  24 -25.631  37.057 -21.989
  191   3HG2  THR  24          3HG2      THR  24 -26.953  36.212 -21.159
  192    H    ALA  25           H        ALA  25 -27.671  35.579 -18.070
  193    HA   ALA  25           HA       ALA  25 -28.739  32.909 -18.530
  194   1HB   ALA  25          HB1       ALA  25 -28.966  34.461 -16.472
  195   2HB   ALA  25          HB2       ALA  25 -30.272  35.238 -17.353
  196   3HB   ALA  25          HB3       ALA  25 -30.340  33.492 -16.987
  197    H    ASN  26           H        ASN  26 -31.195  32.866 -19.107
  198    HA   ASN  26           HA       ASN  26 -32.754  32.756 -20.718
  199   1HB   ASN  26          HB2       ASN  26 -31.974  35.628 -21.318
  200   2HB   ASN  26          HB3       ASN  26 -33.482  34.869 -21.757
  201   1HD2  ASN  26          1HD2      ASN  26 -34.932  35.184 -18.543
  202   2HD2  ASN  26          2HD2      ASN  26 -35.011  34.242 -20.033
  203    H    LEU  27           H        LEU  27 -29.686  32.502 -21.617
  204    HA   LEU  27           HA       LEU  27 -30.167  32.635 -24.555
  205   1HB   LEU  27          HB2       LEU  27 -27.633  32.240 -22.924
  206   2HB   LEU  27          HB3       LEU  27 -27.684  32.189 -24.688
  207    HG   LEU  27           HG       LEU  27 -28.291  34.641 -22.941
  208   1HD1  LEU  27          1HD1      LEU  27 -25.931  33.961 -23.100
  209   2HD1  LEU  27          2HD1      LEU  27 -26.001  33.984 -24.875
  210   3HD1  LEU  27          3HD1      LEU  27 -26.218  35.484 -23.934
  211   1HD2  LEU  27          1HD2      LEU  27 -28.289  34.316 -25.985
  212   2HD2  LEU  27          2HD2      LEU  27 -29.681  34.741 -24.995
  213   3HD2  LEU  27          3HD2      LEU  27 -28.319  35.868 -25.125
  214    H    SER  28           H        SER  28 -30.350  30.264 -22.124
  215    HA   SER  28           HA       SER  28 -30.459  28.008 -22.104
  216   1HB   SER  28          HB2       SER  28 -31.051  28.246 -25.081
  217   2HB   SER  28          HB3       SER  28 -31.319  26.819 -24.063
  218    HG   SER  28           HG       SER  28 -33.216  28.069 -24.347
  219    H    GLN  29           H        GLN  29 -27.845  29.244 -22.542
  220    HA   GLN  29           HA       GLN  29 -26.282  27.377 -24.207
  221   1HB   GLN  29          HB2       GLN  29 -24.405  28.703 -23.607
  222   2HB   GLN  29          HB3       GLN  29 -25.737  29.773 -24.067
  223   1HG   GLN  29          HG2       GLN  29 -26.171  30.308 -21.705
  224   2HG   GLN  29          HG3       GLN  29 -24.931  29.197 -21.168
  225   1HE2  GLN  29          1HE2      GLN  29 -23.713  32.848 -21.574
  226   2HE2  GLN  29          2HE2      GLN  29 -25.246  32.253 -20.926
  227    H    SER  30           H        SER  30 -24.278  26.336 -23.266
  228    HA   SER  30           HA       SER  30 -24.917  24.969 -20.695
  229   1HB   SER  30          HB2       SER  30 -23.246  24.013 -23.049
  230   2HB   SER  30          HB3       SER  30 -23.470  23.144 -21.489
  231    HG   SER  30           HG       SER  30 -24.934  22.483 -23.231
  232    H    VAL  31           H        VAL  31 -23.301  24.738 -19.220
  233    HA   VAL  31           HA       VAL  31 -20.849  26.420 -19.526
  234    HB   VAL  31           HB       VAL  31 -22.864  26.802 -17.259
  235   1HG1  VAL  31          1HG1      VAL  31 -20.237  28.231 -17.826
  236   2HG1  VAL  31          2HG1      VAL  31 -21.456  28.708 -16.621
  237   3HG1  VAL  31          3HG1      VAL  31 -20.603  27.177 -16.450
  238   1HG2  VAL  31          1HG2      VAL  31 -22.126  28.637 -19.578
  239   2HG2  VAL  31          2HG2      VAL  31 -23.709  27.851 -19.296
  240   3HG2  VAL  31          3HG2      VAL  31 -23.115  29.106 -18.187
  241    H    THR  32           H        THR  32 -19.053  25.703 -18.349
  242    HA   THR  32           HA       THR  32 -19.414  23.291 -16.603
  243    HB   THR  32           HB       THR  32 -16.842  24.296 -17.878
  244    HG1  THR  32           HG1      THR  32 -18.315  23.682 -19.446
  245   1HG2  THR  32          1HG2      THR  32 -17.610  21.666 -16.510
  246   2HG2  THR  32          2HG2      THR  32 -16.135  21.910 -17.483
  247   3HG2  THR  32          3HG2      THR  32 -16.378  22.802 -15.967
  248    H    LEU  33           H        LEU  33 -18.607  23.261 -14.545
  249    HA   LEU  33           HA       LEU  33 -16.726  25.221 -13.534
  250   1HB   LEU  33          HB2       LEU  33 -18.167  26.014 -11.693
  251   2HB   LEU  33          HB3       LEU  33 -18.642  26.548 -13.296
  252    HG   LEU  33           HG       LEU  33 -20.491  24.812 -13.301
  253   1HD1  LEU  33          1HD1      LEU  33 -19.677  24.548 -10.379
  254   2HD1  LEU  33          2HD1      LEU  33 -21.272  24.097 -11.020
  255   3HD1  LEU  33          3HD1      LEU  33 -19.860  23.266 -11.621
  256   1HD2  LEU  33          1HD2      LEU  33 -21.926  26.197 -11.880
  257   2HD2  LEU  33          2HD2      LEU  33 -20.472  26.909 -11.124
  258   3HD2  LEU  33          3HD2      LEU  33 -20.829  27.196 -12.841
  259    H    ALA  34           H        ALA  34 -16.209  24.727 -11.086
  260    HA   ALA  34           HA       ALA  34 -16.634  21.886 -10.362
  261   1HB   ALA  34          HB1       ALA  34 -13.913  22.819 -11.307
  262   2HB   ALA  34          HB2       ALA  34 -14.410  21.166 -10.896
  263   3HB   ALA  34          HB3       ALA  34 -15.020  21.962 -12.357
  264    H    CYS  35           H        CYS  35 -15.901  21.266  -8.475
  265    HA   CYS  35           HA       CYS  35 -14.038  22.929  -6.866
  266   1HB   CYS  35          HB2       CYS  35 -16.303  23.175  -5.982
  267   2HB   CYS  35          HB3       CYS  35 -16.437  21.419  -5.790
  268    H    ASP  36           H        ASP  36 -12.208  21.657  -7.434
  269    HA   ASP  36           HA       ASP  36 -12.641  18.810  -8.028
  270   1HB   ASP  36          HB2       ASP  36 -10.542  18.816  -9.056
  271   2HB   ASP  36          HB3       ASP  36 -11.525  20.137  -9.689
  272    H    ALA  37           H        ALA  37 -11.716  17.080  -7.100
  273    HA   ALA  37           HA       ALA  37 -10.466  17.520  -4.454
  274   1HB   ALA  37          HB1       ALA  37 -12.874  16.839  -4.380
  275   2HB   ALA  37          HB2       ALA  37 -12.490  15.377  -5.283
  276   3HB   ALA  37          HB3       ALA  37 -11.811  15.623  -3.663
  277    H    ASP  38           H        ASP  38  -9.079  15.944  -3.642
  278    HA   ASP  38           HA       ASP  38  -8.194  13.645  -5.321
  279   1HB   ASP  38          HB2       ASP  38  -6.874  15.648  -6.085
  280   2HB   ASP  38          HB3       ASP  38  -6.390  15.958  -4.408
  281    H    GLY  39           H        GLY  39  -6.577  12.238  -4.066
  282   1HA   GLY  39          HA2       GLY  39  -5.689  12.412  -1.509
  283   2HA   GLY  39          HA3       GLY  39  -7.367  11.811  -1.291
  284    H    PHE  40           H        PHE  40  -5.205  10.187  -0.491
  285    HA   PHE  40           HA       PHE  40  -5.425   7.907  -2.390
  286   1HB   PHE  40          HB2       PHE  40  -2.813   8.897  -1.250
  287   2HB   PHE  40          HB3       PHE  40  -3.097   7.410  -2.189
  288    HD1  PHE  40           HD1      PHE  40  -2.756  11.078  -2.341
  289    HD2  PHE  40           HD2      PHE  40  -3.469   7.466  -4.606
  290    HE1  PHE  40           HE1      PHE  40  -2.453  12.343  -4.451
  291    HE2  PHE  40           HE2      PHE  40  -3.132   8.738  -6.707
  292    HZ   PHE  40           HZ       PHE  40  -2.647  11.168  -6.645
  293    HA   PRO  41           HA       PRO  41  -5.982   5.721  -2.268
  294   1HB   PRO  41          HB2       PRO  41  -8.126   4.752  -0.397
  295   2HB   PRO  41          HB3       PRO  41  -7.314   3.866  -1.725
  296   1HG   PRO  41          HG2       PRO  41  -6.575   3.408   0.849
  297   2HG   PRO  41          HG3       PRO  41  -5.288   3.615  -0.382
  298   1HD   PRO  41          HD2       PRO  41  -6.350   5.693   1.537
  299   2HD   PRO  41          HD3       PRO  41  -4.655   5.268   1.145
  300    H    GLU  42           H        GLU  42  -7.985   5.898  -3.475
  301    HA   GLU  42           HA       GLU  42  -8.739   8.403  -3.977
  302   1HB   GLU  42          HB2       GLU  42 -10.619   7.558  -5.273
  303   2HB   GLU  42          HB3       GLU  42  -9.128   6.620  -5.511
  304   1HG   GLU  42          HG2       GLU  42 -10.003   4.883  -3.942
  305   2HG   GLU  42          HG3       GLU  42 -11.509   5.804  -3.788
  306    HA   PRO  43           HA       PRO  43 -11.695   9.680  -0.955
  307   1HB   PRO  43          HB2       PRO  43 -12.264  12.199  -1.762
  308   2HB   PRO  43          HB3       PRO  43 -10.577  11.749  -1.340
  309   1HG   PRO  43          HG2       PRO  43 -11.847  11.795  -4.083
  310   2HG   PRO  43          HG3       PRO  43 -10.322  12.591  -3.576
  311   1HD   PRO  43          HD2       PRO  43 -10.336  10.102  -4.765
  312   2HD   PRO  43          HD3       PRO  43  -9.161  10.535  -3.494
  313    H    THR  44           H        THR  44 -13.782  10.599  -0.718
  314    HA   THR  44           HA       THR  44 -15.836  10.112  -2.849
  315    HB   THR  44           HB       THR  44 -16.093   9.671   0.172
  316    HG1  THR  44           HG1      THR  44 -16.283   7.508  -0.361
  317   1HG2  THR  44          1HG2      THR  44 -18.123   9.153  -2.083
  318   2HG2  THR  44          2HG2      THR  44 -18.320   8.698  -0.357
  319   3HG2  THR  44          3HG2      THR  44 -18.242  10.399  -0.820
  320    H    MET  45           H        MET  45 -17.426  11.787  -2.989
  321    HA   MET  45           HA       MET  45 -17.232  14.056  -1.159
  322   1HB   MET  45          HB2       MET  45 -16.443  15.653  -2.860
  323   2HB   MET  45          HB3       MET  45 -15.263  14.388  -2.550
  324   1HG   MET  45          HG2       MET  45 -15.148  14.382  -4.819
  325   2HG   MET  45          HG3       MET  45 -16.435  13.214  -4.651
  326   1HE   MET  45          HE1       MET  45 -16.615  17.496  -6.253
  327   2HE   MET  45          HE2       MET  45 -16.260  17.232  -4.523
  328   3HE   MET  45          HE3       MET  45 -15.190  16.555  -5.756
  329    H    THR  46           H        THR  46 -18.684  15.754  -1.595
  330    HA   THR  46           HA       THR  46 -20.800  15.537  -3.637
  331    HB   THR  46           HB       THR  46 -22.635  15.715  -1.957
  332    HG1  THR  46           HG1      THR  46 -22.230  14.905   0.120
  333   1HG2  THR  46          1HG2      THR  46 -22.963  13.404  -1.590
  334   2HG2  THR  46          2HG2      THR  46 -22.179  13.613  -3.170
  335   3HG2  THR  46          3HG2      THR  46 -21.226  13.037  -1.785
  336    H    TRP  47           H        TRP  47 -22.301  17.434  -3.509
  337    HA   TRP  47           HA       TRP  47 -21.447  19.703  -1.902
  338   1HB   TRP  47          HB2       TRP  47 -21.062  21.127  -3.976
  339   2HB   TRP  47          HB3       TRP  47 -19.829  20.076  -3.381
  340    HD1  TRP  47           HD1      TRP  47 -19.525  17.655  -4.795
  341    HE1  TRP  47           HE1      TRP  47 -18.932  17.597  -7.273
  342    HE3  TRP  47           HE3      TRP  47 -21.525  22.138  -6.173
  343    HZ2  TRP  47           HZ2      TRP  47 -18.874  19.499  -9.433
  344    HZ3  TRP  47           HZ3      TRP  47 -21.107  23.061  -8.447
  345    HH2  TRP  47           HH2      TRP  47 -19.775  21.725 -10.082
  346    H    THR  48           H        THR  48 -22.759  21.662  -2.283
  347    HA   THR  48           HA       THR  48 -25.565  20.851  -2.866
  348    HB   THR  48           HB       THR  48 -26.293  22.197  -0.989
  349    HG1  THR  48           HG1      THR  48 -24.718  23.118   0.396
  350   1HG2  THR  48          1HG2      THR  48 -25.602  19.834  -0.487
  351   2HG2  THR  48          2HG2      THR  48 -23.995  20.450  -0.026
  352   3HG2  THR  48          3HG2      THR  48 -25.420  20.952   0.889
  353    H    LYS  49           H        LYS  49 -27.112  22.444  -3.402
  354    HA   LYS  49           HA       LYS  49 -26.035  24.813  -4.841
  355   1HB   LYS  49          HB2       LYS  49 -27.496  23.045  -6.000
  356   2HB   LYS  49          HB3       LYS  49 -28.828  23.612  -5.042
  357   1HG   LYS  49          HG2       LYS  49 -28.479  25.921  -5.994
  358   2HG   LYS  49          HG3       LYS  49 -27.168  25.245  -6.997
  359   1HD   LYS  49          HD2       LYS  49 -28.795  23.698  -8.043
  360   2HD   LYS  49          HD3       LYS  49 -30.088  24.451  -7.110
  361   1HE   LYS  49          HE2       LYS  49 -28.302  25.899  -9.120
  362   2HE   LYS  49          HE3       LYS  49 -29.894  25.225  -9.503
  363   1HZ   LYS  49          HZ1       LYS  49 -30.306  27.433  -9.057
  364   2HZ   LYS  49          HZ2       LYS  49 -30.756  26.734  -7.661
  365   3HZ   LYS  49          HZ3       LYS  49 -29.308  27.541  -7.790
  366    H    ASP  50           H        ASP  50 -25.627  25.795  -2.742
  367    HA   ASP  50           HA       ASP  50 -26.003  27.290  -1.130
  368   1HB   ASP  50          HB2       ASP  50 -27.292  28.493  -2.865
  369   2HB   ASP  50          HB3       ASP  50 -28.776  27.734  -2.288
  370    H    GLY  51           H        GLY  51 -27.831  24.453  -1.207
  371   1HA   GLY  51          HA2       GLY  51 -27.765  24.112   1.603
  372   2HA   GLY  51          HA3       GLY  51 -29.361  24.687   1.193
  373    H    GLU  52           H        GLU  52 -29.595  23.272  -1.390
  374    HA   GLU  52           HA       GLU  52 -30.168  20.582  -0.334
  375   1HB   GLU  52          HB2       GLU  52 -31.549  20.309  -2.283
  376   2HB   GLU  52          HB3       GLU  52 -31.979  21.764  -1.373
  377   1HG   GLU  52          HG2       GLU  52 -30.738  23.156  -3.008
  378   2HG   GLU  52          HG3       GLU  52 -30.367  21.717  -3.980
  379    HA   PRO  53           HA       PRO  53 -26.659  18.885  -2.209
  380   1HB   PRO  53          HB2       PRO  53 -27.176  16.213  -2.285
  381   2HB   PRO  53          HB3       PRO  53 -27.061  17.132  -0.760
  382   1HG   PRO  53          HG2       PRO  53 -29.578  16.412  -2.291
  383   2HG   PRO  53          HG3       PRO  53 -29.247  16.131  -0.570
  384   1HD   PRO  53          HD2       PRO  53 -30.613  18.305  -1.410
  385   2HD   PRO  53          HD3       PRO  53 -29.435  18.438  -0.059
  386    H    ILE  54           H        ILE  54 -25.707  18.662  -4.092
  387    HA   ILE  54           HA       ILE  54 -27.162  18.026  -6.602
  388    HB   ILE  54           HB       ILE  54 -24.350  19.163  -6.333
  389   1HG1  ILE  54          2HG1      ILE  54 -26.702  20.976  -6.972
  390   2HG1  ILE  54          3HG1      ILE  54 -26.271  20.716  -5.287
  391   1HG2  ILE  54          1HG2      ILE  54 -24.751  20.039  -8.638
  392   2HG2  ILE  54          2HG2      ILE  54 -24.872  18.292  -8.594
  393   3HG2  ILE  54          3HG2      ILE  54 -26.361  19.246  -8.636
  394   1HD1  ILE  54          1HD1      ILE  54 -24.038  21.532  -5.611
  395   2HD1  ILE  54          2HD1      ILE  54 -24.277  21.722  -7.357
  396   3HD1  ILE  54          3HD1      ILE  54 -25.189  22.720  -6.261
  397    H    GLU  55           H        GLU  55 -26.793  15.946  -4.812
  398    HA   GLU  55           HA       GLU  55 -24.349  14.573  -4.911
  399   1HB   GLU  55          HB2       GLU  55 -25.612  12.662  -4.077
  400   2HB   GLU  55          HB3       GLU  55 -25.872  14.158  -3.161
  401   1HG   GLU  55          HG2       GLU  55 -28.066  14.468  -4.271
  402   2HG   GLU  55          HG3       GLU  55 -27.809  12.959  -5.171
  403    H    GLN  56           H        GLN  56 -23.314  13.574  -6.365
  404    HA   GLN  56           HA       GLN  56 -24.132  13.363  -8.997
  405   1HB   GLN  56          HB2       GLN  56 -21.838  11.780  -7.829
  406   2HB   GLN  56          HB3       GLN  56 -22.053  12.352  -9.478
  407   1HG   GLN  56          HG2       GLN  56 -20.533  13.887  -8.724
  408   2HG   GLN  56          HG3       GLN  56 -22.020  14.746  -8.396
  409   1HE2  GLN  56          1HE2      GLN  56 -19.676  13.430  -5.281
  410   2HE2  GLN  56          2HE2      GLN  56 -19.340  12.917  -6.956
  411    H    GLU  57           H        GLU  57 -25.021  11.132  -6.644
  412    HA   GLU  57           HA       GLU  57 -25.253   8.787  -8.469
  413   1HB   GLU  57          HB2       GLU  57 -25.736   9.062  -5.486
  414   2HB   GLU  57          HB3       GLU  57 -25.859   7.561  -6.393
  415   1HG   GLU  57          HG2       GLU  57 -23.446   7.735  -6.993
  416   2HG   GLU  57          HG3       GLU  57 -23.298   9.193  -6.025
  417    H    ASP  58           H        ASP  58 -27.208  11.423  -7.652
  418    HA   ASP  58           HA       ASP  58 -29.631   9.962  -8.547
  419   1HB   ASP  58          HB2       ASP  58 -29.496   9.603  -6.050
  420   2HB   ASP  58          HB3       ASP  58 -29.537  11.353  -5.843
  421    H    ASN  59           H        ASN  59 -27.991  13.028  -7.994
  422    HA   ASN  59           HA       ASN  59 -30.301  14.529  -9.152
  423   1HB   ASN  59          HB2       ASN  59 -29.436  15.181  -6.868
  424   2HB   ASN  59          HB3       ASN  59 -27.930  15.673  -7.656
  425   1HD2  ASN  59          1HD2      ASN  59 -30.173  18.667  -7.394
  426   2HD2  ASN  59          2HD2      ASN  59 -29.481  17.559  -6.220
  427    H    GLU  60           H        GLU  60 -30.076  14.419 -11.303
  428    HA   GLU  60           HA       GLU  60 -27.558  15.262 -12.644
  429   1HB   GLU  60          HB2       GLU  60 -27.980  12.711 -12.017
  430   2HB   GLU  60          HB3       GLU  60 -29.129  12.771 -13.357
  431   1HG   GLU  60          HG2       GLU  60 -27.276  13.477 -14.842
  432   2HG   GLU  60          HG3       GLU  60 -26.173  13.488 -13.471
  433    H    GLU  61           H        GLU  61 -30.579  16.125 -12.414
  434    HA   GLU  61           HA       GLU  61 -31.969  15.644 -14.770
  435   1HB   GLU  61          HB2       GLU  61 -33.397  17.481 -14.235
  436   2HB   GLU  61          HB3       GLU  61 -33.014  16.549 -12.791
  437   1HG   GLU  61          HG2       GLU  61 -31.399  18.222 -12.034
  438   2HG   GLU  61          HG3       GLU  61 -31.641  19.174 -13.524
  439    H    LYS  62           H        LYS  62 -29.455  18.082 -14.547
  440    HA   LYS  62           HA       LYS  62 -29.287  18.061 -17.434
  441   1HB   LYS  62          HB2       LYS  62 -29.580  20.400 -17.942
  442   2HB   LYS  62          HB3       LYS  62 -31.055  19.756 -17.218
  443   1HG   LYS  62          HG2       LYS  62 -30.185  20.802 -14.990
  444   2HG   LYS  62          HG3       LYS  62 -29.022  21.686 -16.011
  445   1HD   LYS  62          HD2       LYS  62 -31.103  22.404 -17.395
  446   2HD   LYS  62          HD3       LYS  62 -32.052  21.805 -16.048
  447   1HE   LYS  62          HE2       LYS  62 -31.867  23.999 -15.406
  448   2HE   LYS  62          HE3       LYS  62 -30.435  23.325 -14.601
  449   1HZ   LYS  62          HZ1       LYS  62 -29.710  25.270 -15.749
  450   2HZ   LYS  62          HZ2       LYS  62 -29.193  24.031 -16.688
  451   3HZ   LYS  62          HZ3       LYS  62 -30.511  24.884 -17.119
  452    H    TYR  63           H        TYR  63 -27.512  17.058 -15.725
  453    HA   TYR  63           HA       TYR  63 -25.191  18.550 -16.418
  454   1HB   TYR  63          HB2       TYR  63 -24.500  18.570 -13.802
  455   2HB   TYR  63          HB3       TYR  63 -25.089  19.939 -14.693
  456    HD1  TYR  63           HD1      TYR  63 -27.165  21.004 -14.094
  457    HD2  TYR  63           HD2      TYR  63 -26.029  17.260 -12.269
  458    HE1  TYR  63           HE1      TYR  63 -29.007  21.260 -12.448
  459    HE2  TYR  63           HE2      TYR  63 -27.876  17.532 -10.614
  460    HH   TYR  63           HH       TYR  63 -29.680  18.771  -9.972
  461    H    SER  64           H        SER  64 -23.196  17.557 -16.087
  462    HA   SER  64           HA       SER  64 -22.917  14.940 -14.866
  463   1HB   SER  64          HB2       SER  64 -22.288  13.810 -17.014
  464   2HB   SER  64          HB3       SER  64 -23.997  14.169 -16.864
  465    HG   SER  64           HG       SER  64 -23.048  14.647 -18.928
  466    H    PHE  65           H        PHE  65 -20.710  14.223 -14.833
  467    HA   PHE  65           HA       PHE  65 -18.579  16.109 -15.602
  468   1HB   PHE  65          HB2       PHE  65 -17.987  16.263 -13.360
  469   2HB   PHE  65          HB3       PHE  65 -19.717  16.388 -13.326
  470    HD1  PHE  65           HD1      PHE  65 -20.967  13.937 -12.979
  471    HD2  PHE  65           HD2      PHE  65 -16.985  14.972 -11.691
  472    HE1  PHE  65           HE1      PHE  65 -20.922  11.954 -11.436
  473    HE2  PHE  65           HE2      PHE  65 -17.018  13.090 -10.081
  474    HZ   PHE  65           HZ       PHE  65 -18.986  11.566  -9.986
  475    H    ASN  66           H        ASN  66 -16.427  15.229 -14.825
  476    HA   ASN  66           HA       ASN  66 -16.037  12.352 -15.574
  477   1HB   ASN  66          HB2       ASN  66 -13.669  13.082 -16.070
  478   2HB   ASN  66          HB3       ASN  66 -14.913  13.781 -17.100
  479   1HD2  ASN  66          1HD2      ASN  66 -13.123  16.374 -14.430
  480   2HD2  ASN  66          2HD2      ASN  66 -13.538  14.762 -13.868
  481    H    TYR  67           H        TYR  67 -14.433  11.099 -14.466
  482    HA   TYR  67           HA       TYR  67 -14.212  11.480 -11.579
  483   1HB   TYR  67          HB2       TYR  67 -14.436   9.259 -12.590
  484   2HB   TYR  67          HB3       TYR  67 -12.957   9.515 -13.531
  485    HD1  TYR  67           HD1      TYR  67 -14.179   9.500  -9.924
  486    HD2  TYR  67           HD2      TYR  67 -10.975   8.673 -12.679
  487    HE1  TYR  67           HE1      TYR  67 -12.829   8.599  -8.075
  488    HE2  TYR  67           HE2      TYR  67  -9.597   7.763 -10.782
  489    HH   TYR  67           HH       TYR  67  -9.502   7.359  -8.501
  490    H    ASP  68           H        ASP  68 -11.968  11.252 -10.548
  491    HA   ASP  68           HA       ASP  68 -10.046  12.302  -9.885
  492   1HB   ASP  68          HB2       ASP  68  -9.263  10.860 -11.796
  493   2HB   ASP  68          HB3       ASP  68  -9.325  12.275 -12.833
  494    H    GLY  69           H        GLY  69 -12.323  13.929 -10.458
  495   1HA   GLY  69          HA2       GLY  69 -11.462  16.577 -10.037
  496   2HA   GLY  69          HA3       GLY  69 -11.835  16.393 -11.763
  497    H    SER  70           H        SER  70 -13.481  18.045 -11.076
  498    HA   SER  70           HA       SER  70 -16.044  16.835 -10.096
  499   1HB   SER  70          HB2       SER  70 -14.831  19.393  -9.107
  500   2HB   SER  70          HB3       SER  70 -16.383  18.655  -8.600
  501    HG   SER  70           HG       SER  70 -14.544  18.246  -7.216
  502    H    GLU  71           H        GLU  71 -14.969  17.770 -12.773
  503    HA   GLU  71           HA       GLU  71 -16.051  20.404 -13.282
  504   1HB   GLU  71          HB2       GLU  71 -14.885  18.322 -15.147
  505   2HB   GLU  71          HB3       GLU  71 -15.373  19.950 -15.650
  506   1HG   GLU  71          HG2       GLU  71 -13.005  19.961 -15.346
  507   2HG   GLU  71          HG3       GLU  71 -13.739  20.931 -14.067
  508    H    LEU  72           H        LEU  72 -18.118  20.321 -12.685
  509    HA   LEU  72           HA       LEU  72 -20.041  18.510 -13.954
  510   1HB   LEU  72          HB2       LEU  72 -20.056  19.175 -11.509
  511   2HB   LEU  72          HB3       LEU  72 -20.457  20.810 -12.002
  512    HG   LEU  72           HG       LEU  72 -22.567  19.863 -13.095
  513   1HD1  LEU  72          1HD1      LEU  72 -21.931  17.511 -13.349
  514   2HD1  LEU  72          2HD1      LEU  72 -21.631  17.369 -11.613
  515   3HD1  LEU  72          3HD1      LEU  72 -23.276  17.586 -12.215
  516   1HD2  LEU  72          1HD2      LEU  72 -22.234  19.379 -10.096
  517   2HD2  LEU  72          2HD2      LEU  72 -22.668  20.920 -10.862
  518   3HD2  LEU  72          3HD2      LEU  72 -23.776  19.550 -10.959
  519    H    ILE  73           H        ILE  73 -20.584  18.889 -15.932
  520    HA   ILE  73           HA       ILE  73 -20.681  21.605 -17.091
  521    HB   ILE  73           HB       ILE  73 -21.147  18.922 -18.402
  522   1HG1  ILE  73          2HG1      ILE  73 -18.596  20.457 -18.795
  523   2HG1  ILE  73          3HG1      ILE  73 -18.720  19.478 -17.340
  524   1HG2  ILE  73          1HG2      ILE  73 -20.560  21.747 -19.433
  525   2HG2  ILE  73          2HG2      ILE  73 -20.721  20.287 -20.483
  526   3HG2  ILE  73          3HG2      ILE  73 -22.113  20.940 -19.566
  527   1HD1  ILE  73          1HD1      ILE  73 -17.678  18.223 -19.111
  528   2HD1  ILE  73          2HD1      ILE  73 -19.205  17.489 -18.627
  529   3HD1  ILE  73          3HD1      ILE  73 -19.123  18.413 -20.153
  530    H    ILE  74           H        ILE  74 -22.477  22.659 -16.946
  531    HA   ILE  74           HA       ILE  74 -25.097  21.345 -16.318
  532    HB   ILE  74           HB       ILE  74 -23.995  24.142 -15.850
  533   1HG1  ILE  74          2HG1      ILE  74 -25.091  22.163 -13.817
  534   2HG1  ILE  74          3HG1      ILE  74 -23.400  22.124 -14.325
  535   1HG2  ILE  74          1HG2      ILE  74 -26.830  23.088 -15.396
  536   2HG2  ILE  74          2HG2      ILE  74 -26.223  24.601 -14.707
  537   3HG2  ILE  74          3HG2      ILE  74 -26.347  24.426 -16.459
  538   1HD1  ILE  74          1HD1      ILE  74 -24.762  24.494 -12.972
  539   2HD1  ILE  74          2HD1      ILE  74 -23.600  23.387 -12.248
  540   3HD1  ILE  74          3HD1      ILE  74 -23.054  24.442 -13.552
  541    H    LYS  75           H        LYS  75 -26.682  21.324 -17.842
  542    HA   LYS  75           HA       LYS  75 -26.088  22.804 -20.372
  543   1HB   LYS  75          HB2       LYS  75 -28.540  21.112 -20.202
  544   2HB   LYS  75          HB3       LYS  75 -27.381  21.286 -21.499
  545   1HG   LYS  75          HG2       LYS  75 -27.208  19.499 -19.051
  546   2HG   LYS  75          HG3       LYS  75 -27.442  19.013 -20.718
  547   1HD   LYS  75          HD2       LYS  75 -25.156  19.609 -21.283
  548   2HD   LYS  75          HD3       LYS  75 -24.870  20.214 -19.627
  549   1HE   LYS  75          HE2       LYS  75 -25.717  17.903 -18.838
  550   2HE   LYS  75          HE3       LYS  75 -25.417  17.353 -20.493
  551   1HZ   LYS  75          HZ1       LYS  75 -23.415  18.551 -18.663
  552   2HZ   LYS  75          HZ2       LYS  75 -23.505  16.978 -19.059
  553   3HZ   LYS  75          HZ3       LYS  75 -23.087  18.075 -20.202
  554    H    LYS  76           H        LYS  76 -27.804  23.865 -21.436
  555    HA   LYS  76           HA       LYS  76 -28.967  25.843 -21.473
  556   1HB   LYS  76          HB2       LYS  76 -31.390  25.415 -21.331
  557   2HB   LYS  76          HB3       LYS  76 -30.472  24.282 -22.330
  558   1HG   LYS  76          HG2       LYS  76 -30.527  22.592 -20.515
  559   2HG   LYS  76          HG3       LYS  76 -31.470  23.696 -19.507
  560   1HD   LYS  76          HD2       LYS  76 -32.361  22.663 -22.236
  561   2HD   LYS  76          HD3       LYS  76 -32.819  21.934 -20.686
  562   1HE   LYS  76          HE2       LYS  76 -33.916  24.037 -19.999
  563   2HE   LYS  76          HE3       LYS  76 -33.455  24.791 -21.536
  564   1HZ   LYS  76          HZ1       LYS  76 -35.234  22.439 -21.245
  565   2HZ   LYS  76          HZ2       LYS  76 -35.730  23.955 -21.613
  566   3HZ   LYS  76          HZ3       LYS  76 -34.810  23.097 -22.657
  567    H    VAL  77           H        VAL  77 -27.803  26.943 -19.859
  568    HA   VAL  77           HA       VAL  77 -28.964  27.618 -17.292
  569    HB   VAL  77           HB       VAL  77 -26.878  28.923 -19.072
  570   1HG1  VAL  77          1HG1      VAL  77 -27.655  29.757 -16.248
  571   2HG1  VAL  77          2HG1      VAL  77 -26.236  30.315 -17.168
  572   3HG1  VAL  77          3HG1      VAL  77 -27.853  30.726 -17.706
  573   1HG2  VAL  77          1HG2      VAL  77 -26.699  27.408 -16.437
  574   2HG2  VAL  77          2HG2      VAL  77 -26.229  26.774 -18.028
  575   3HG2  VAL  77          3HG2      VAL  77 -25.332  28.104 -17.300
  576    H    ASP  78           H        ASP  78 -30.454  29.130 -16.772
  577    HA   ASP  78           HA       ASP  78 -31.697  30.698 -19.003
  578   1HB   ASP  78          HB2       ASP  78 -32.766  28.444 -18.751
  579   2HB   ASP  78          HB3       ASP  78 -33.150  28.846 -17.087
  580    H    LYS  79           H        LYS  79 -31.381  30.393 -15.546
  581    HA   LYS  79           HA       LYS  79 -31.138  32.960 -14.743
  582   1HB   LYS  79          HB2       LYS  79 -34.018  32.577 -15.429
  583   2HB   LYS  79          HB3       LYS  79 -33.757  33.124 -13.791
  584   1HG   LYS  79          HG2       LYS  79 -32.398  35.008 -14.525
  585   2HG   LYS  79          HG3       LYS  79 -32.489  34.467 -16.190
  586   1HD   LYS  79          HD2       LYS  79 -34.021  36.278 -15.945
  587   2HD   LYS  79          HD3       LYS  79 -34.954  34.787 -16.186
  588   1HE   LYS  79          HE2       LYS  79 -35.377  34.626 -13.751
  589   2HE   LYS  79          HE3       LYS  79 -34.358  36.069 -13.479
  590   1HZ   LYS  79          HZ1       LYS  79 -36.883  36.079 -15.051
  591   2HZ   LYS  79          HZ2       LYS  79 -36.757  36.548 -13.494
  592   3HZ   LYS  79          HZ3       LYS  79 -35.970  37.387 -14.664
  593    H    SER  80           H        SER  80 -32.747  29.923 -14.064
  594    HA   SER  80           HA       SER  80 -32.801  30.273 -11.185
  595   1HB   SER  80          HB2       SER  80 -33.649  27.911 -11.272
  596   2HB   SER  80          HB3       SER  80 -34.571  29.091 -12.194
  597    HG   SER  80           HG       SER  80 -34.189  27.168 -13.398
  598    H    ASP  81           H        ASP  81 -30.291  29.520 -13.200
  599    HA   ASP  81           HA       ASP  81 -29.036  27.345 -11.875
  600   1HB   ASP  81          HB2       ASP  81 -27.775  29.330 -13.784
  601   2HB   ASP  81          HB3       ASP  81 -27.317  27.652 -13.507
  602    H    GLU  82           H        GLU  82 -29.112  30.569 -10.864
  603    HA   GLU  82           HA       GLU  82 -26.549  31.108  -9.834
  604   1HB   GLU  82          HB2       GLU  82 -28.458  32.674 -10.001
  605   2HB   GLU  82          HB3       GLU  82 -29.252  31.852  -8.638
  606   1HG   GLU  82          HG2       GLU  82 -27.277  32.422  -7.216
  607   2HG   GLU  82          HG3       GLU  82 -26.606  33.355  -8.559
  608    H    ALA  83           H        ALA  83 -25.454  30.540  -7.936
  609    HA   ALA  83           HA       ALA  83 -26.673  28.805  -5.903
  610   1HB   ALA  83          HB1       ALA  83 -24.623  27.734  -7.907
  611   2HB   ALA  83          HB2       ALA  83 -25.205  26.835  -6.485
  612   3HB   ALA  83          HB3       ALA  83 -26.309  27.225  -7.817
  613    H    GLU  84           H        GLU  84 -25.327  28.174  -4.249
  614    HA   GLU  84           HA       GLU  84 -22.609  29.381  -4.034
  615   1HB   GLU  84          HB2       GLU  84 -24.208  30.586  -2.566
  616   2HB   GLU  84          HB3       GLU  84 -24.600  29.073  -1.740
  617   1HG   GLU  84          HG2       GLU  84 -22.263  28.845  -0.998
  618   2HG   GLU  84          HG3       GLU  84 -21.792  30.260  -1.960
  619    H    TYR  85           H        TYR  85 -21.514  27.651  -4.644
  620    HA   TYR  85           HA       TYR  85 -22.408  24.916  -4.173
  621   1HB   TYR  85          HB2       TYR  85 -20.183  26.142  -5.779
  622   2HB   TYR  85          HB3       TYR  85 -20.486  24.411  -5.682
  623    HD1  TYR  85           HD1      TYR  85 -20.926  27.158  -7.758
  624    HD2  TYR  85           HD2      TYR  85 -23.103  23.804  -6.148
  625    HE1  TYR  85           HE1      TYR  85 -22.404  27.131  -9.756
  626    HE2  TYR  85           HE2      TYR  85 -24.547  23.761  -8.196
  627    HH   TYR  85           HH       TYR  85 -24.159  26.093 -10.851
  628    H    ILE  86           H        ILE  86 -22.110  25.070  -1.829
  629    HA   ILE  86           HA       ILE  86 -19.365  24.936  -0.788
  630    HB   ILE  86           HB       ILE  86 -21.916  23.981   0.576
  631   1HG1  ILE  86          2HG1      ILE  86 -20.631  26.759   0.562
  632   2HG1  ILE  86          3HG1      ILE  86 -22.222  26.317  -0.025
  633   1HG2  ILE  86          1HG2      ILE  86 -19.777  23.100   1.527
  634   2HG2  ILE  86          2HG2      ILE  86 -19.197  24.760   1.708
  635   3HG2  ILE  86          3HG2      ILE  86 -20.577  24.181   2.645
  636   1HD1  ILE  86          1HD1      ILE  86 -22.877  25.669   2.290
  637   2HD1  ILE  86          2HD1      ILE  86 -21.334  26.329   2.868
  638   3HD1  ILE  86          3HD1      ILE  86 -22.532  27.384   2.074
  639    H    CYS  87           H        CYS  87 -18.104  23.203  -0.712
  640    HA   CYS  87           HA       CYS  87 -19.106  20.554  -1.587
  641   1HB   CYS  87          HB2       CYS  87 -16.872  20.504  -2.896
  642   2HB   CYS  87          HB3       CYS  87 -18.212  21.404  -3.584
  643    H    ILE  88           H        ILE  88 -18.327  18.796  -0.767
  644    HA   ILE  88           HA       ILE  88 -16.290  19.028   1.435
  645    HB   ILE  88           HB       ILE  88 -18.953  17.508   1.468
  646   1HG1  ILE  88          2HG1      ILE  88 -18.168  20.045   2.986
  647   2HG1  ILE  88          3HG1      ILE  88 -19.285  19.987   1.650
  648   1HG2  ILE  88          1HG2      ILE  88 -16.850  17.896   3.660
  649   2HG2  ILE  88          2HG2      ILE  88 -18.399  17.077   3.864
  650   3HG2  ILE  88          3HG2      ILE  88 -17.185  16.384   2.797
  651   1HD1  ILE  88          1HD1      ILE  88 -20.746  18.434   3.009
  652   2HD1  ILE  88          2HD1      ILE  88 -19.757  18.836   4.423
  653   3HD1  ILE  88          3HD1      ILE  88 -20.623  20.113   3.586
  654    H    ALA  89           H        ALA  89 -14.835  17.377   1.502
  655    HA   ALA  89           HA       ALA  89 -15.425  14.899  -0.002
  656   1HB   ALA  89          HB1       ALA  89 -12.790  16.423  -0.015
  657   2HB   ALA  89          HB2       ALA  89 -13.112  14.858  -0.816
  658   3HB   ALA  89          HB3       ALA  89 -13.939  16.315  -1.386
  659    H    GLU  90           H        GLU  90 -14.462  13.060   0.788
  660    HA   GLU  90           HA       GLU  90 -13.030  13.061   3.394
  661   1HB   GLU  90          HB2       GLU  90 -15.501  13.019   3.820
  662   2HB   GLU  90          HB3       GLU  90 -15.636  11.606   2.801
  663   1HG   GLU  90          HG2       GLU  90 -14.101  10.360   4.344
  664   2HG   GLU  90          HG3       GLU  90 -14.002  11.815   5.362
  665    H    ASN  91           H        ASN  91 -11.774  11.194   3.703
  666    HA   ASN  91           HA       ASN  91 -12.194   8.896   1.963
  667   1HB   ASN  91          HB2       ASN  91 -10.233   8.738   0.853
  668   2HB   ASN  91          HB3       ASN  91 -10.555  10.488   0.739
  669   1HD2  ASN  91          1HD2      ASN  91  -7.982   9.249   0.321
  670   2HD2  ASN  91          2HD2      ASN  91  -6.950   9.998   1.550
  671    H    LYS  92           H        LYS  92  -9.873   7.531   2.586
  672    HA   LYS  92           HA       LYS  92 -10.727   6.458   5.145
  673   1HB   LYS  92          HB2       LYS  92  -8.344   5.177   4.149
  674   2HB   LYS  92          HB3       LYS  92  -9.956   4.552   4.246
  675   1HG   LYS  92          HG2       LYS  92  -8.849   6.132   1.858
  676   2HG   LYS  92          HG3       LYS  92  -8.943   4.365   2.019
  677   1HD   LYS  92          HD2       LYS  92 -11.464   4.595   2.247
  678   2HD   LYS  92          HD3       LYS  92 -11.285   6.286   1.739
  679   1HE   LYS  92          HE2       LYS  92 -10.121   5.548  -0.325
  680   2HE   LYS  92          HE3       LYS  92 -10.421   3.856   0.145
  681   1HZ   LYS  92          HZ1       LYS  92 -12.839   4.429   0.142
  682   2HZ   LYS  92          HZ2       LYS  92 -12.469   5.900  -0.482
  683   3HZ   LYS  92          HZ3       LYS  92 -12.137   4.581  -1.357
  684    H    ALA  93           H        ALA  93  -8.455   8.800   4.323
  685    HA   ALA  93           HA       ALA  93  -6.875   8.516   6.847
  686   1HB   ALA  93          HB1       ALA  93  -5.648   8.503   4.767
  687   2HB   ALA  93          HB2       ALA  93  -6.383  10.032   4.260
  688   3HB   ALA  93          HB3       ALA  93  -5.297   9.988   5.663
  689    H    GLY  94           H        GLY  94  -9.252  10.719   5.282
  690   1HA   GLY  94          HA2       GLY  94  -9.524  12.335   7.660
  691   2HA   GLY  94          HA3       GLY  94  -8.481  13.102   6.510
  692    H    GLU  95           H        GLU  95 -10.035  14.846   6.477
  693    HA   GLU  95           HA       GLU  95 -12.292  14.604   4.598
  694   1HB   GLU  95          HB2       GLU  95 -13.240  13.923   6.799
  695   2HB   GLU  95          HB3       GLU  95 -12.635  15.422   7.514
  696   1HG   GLU  95          HG2       GLU  95 -14.184  16.708   5.947
  697   2HG   GLU  95          HG3       GLU  95 -14.727  15.171   5.293
  698    H    GLN  96           H        GLN  96 -12.852  16.649   3.695
  699    HA   GLN  96           HA       GLN  96 -11.514  19.135   4.609
  700   1HB   GLN  96          HB2       GLN  96 -10.107  17.530   2.928
  701   2HB   GLN  96          HB3       GLN  96 -11.109  18.314   1.755
  702   1HG   GLN  96          HG2       GLN  96  -9.142  19.589   1.865
  703   2HG   GLN  96          HG3       GLN  96 -10.300  20.567   2.764
  704   1HE2  GLN  96          1HE2      GLN  96  -7.263  18.677   4.870
  705   2HE2  GLN  96          2HE2      GLN  96  -7.803  17.999   3.322
  706    H    ASP  97           H        ASP  97 -12.229  21.055   3.222
  707    HA   ASP  97           HA       ASP  97 -14.583  20.657   1.532
  708   1HB   ASP  97          HB2       ASP  97 -16.101  21.994   2.787
  709   2HB   ASP  97          HB3       ASP  97 -15.524  20.716   3.851
  710    H    ALA  98           H        ALA  98 -15.308  22.574   0.382
  711    HA   ALA  98           HA       ALA  98 -13.924  25.152   0.704
  712   1HB   ALA  98          HB1       ALA  98 -12.422  23.904  -0.838
  713   2HB   ALA  98          HB2       ALA  98 -13.781  23.598  -1.931
  714   3HB   ALA  98          HB3       ALA  98 -13.193  25.269  -1.665
  715    H    THR  99           H        THR  99 -14.911  26.662  -1.296
  716    HA   THR  99           HA       THR  99 -17.777  26.024  -1.814
  717    HB   THR  99           HB       THR  99 -16.779  28.512  -0.378
  718    HG1  THR  99           HG1      THR  99 -17.974  27.760   1.319
  719   1HG2  THR  99          1HG2      THR  99 -18.596  29.206  -1.829
  720   2HG2  THR  99          2HG2      THR  99 -19.567  27.772  -1.385
  721   3HG2  THR  99          3HG2      THR  99 -19.212  29.069  -0.181
  722    H    ILE 100           H        ILE 100 -18.245  26.593  -3.875
  723    HA   ILE 100           HA       ILE 100 -16.735  28.779  -5.258
  724    HB   ILE 100           HB       ILE 100 -18.682  27.373  -6.907
  725   1HG1  ILE 100          2HG1      ILE 100 -16.304  25.630  -6.310
  726   2HG1  ILE 100          3HG1      ILE 100 -17.888  25.365  -5.566
  727   1HG2  ILE 100          1HG2      ILE 100 -16.961  27.497  -8.592
  728   2HG2  ILE 100          2HG2      ILE 100 -17.043  29.012  -7.731
  729   3HG2  ILE 100          3HG2      ILE 100 -15.729  27.904  -7.341
  730   1HD1  ILE 100          1HD1      ILE 100 -17.770  23.947  -7.479
  731   2HD1  ILE 100          2HD1      ILE 100 -18.909  25.215  -7.861
  732   3HD1  ILE 100          3HD1      ILE 100 -17.277  25.281  -8.551
  733    H    HIS 101           H        HIS 101 -17.993  30.416  -6.359
  734    HA   HIS 101           HA       HIS 101 -20.907  30.606  -5.633
  735   1HB   HIS 101          HB2       HIS 101 -18.884  32.825  -6.193
  736   2HB   HIS 101          HB3       HIS 101 -20.610  33.064  -5.926
  737    HD1  HIS 101           HD1      HIS 101 -21.474  32.862  -3.360
  738    HD2  HIS 101           HD2      HIS 101 -17.369  32.247  -4.029
  739    HE1  HIS 101           HE1      HIS 101 -20.404  32.883  -1.084
  740    H    LEU 102           H        LEU 102 -22.309  31.422  -7.348
  741    HA   LEU 102           HA       LEU 102 -21.103  31.750 -10.029
  742   1HB   LEU 102          HB2       LEU 102 -21.848  29.321  -9.601
  743   2HB   LEU 102          HB3       LEU 102 -23.493  29.903  -9.532
  744    HG   LEU 102           HG       LEU 102 -21.675  29.327 -11.752
  745   1HD1  LEU 102          1HD1      LEU 102 -23.789  28.143 -11.291
  746   2HD1  LEU 102          2HD1      LEU 102 -24.689  29.633 -11.684
  747   3HD1  LEU 102          3HD1      LEU 102 -23.738  28.789 -12.933
  748   1HD2  LEU 102          1HD2      LEU 102 -21.692  31.748 -12.212
  749   2HD2  LEU 102          2HD2      LEU 102 -22.542  30.826 -13.442
  750   3HD2  LEU 102          3HD2      LEU 102 -23.458  31.731 -12.237
  751    H    LYS 103           H        LYS 103 -21.609  33.842 -10.252
  752    HA   LYS 103           HA       LYS 103 -24.333  34.886  -9.670
  753   1HB   LYS 103          HB2       LYS 103 -23.451  37.104 -10.242
  754   2HB   LYS 103          HB3       LYS 103 -22.685  36.304  -8.884
  755   1HG   LYS 103          HG2       LYS 103 -20.727  35.695 -10.291
  756   2HG   LYS 103          HG3       LYS 103 -21.497  36.507 -11.690
  757   1HD   LYS 103          HD2       LYS 103 -21.459  38.632 -10.491
  758   2HD   LYS 103          HD3       LYS 103 -20.761  37.851  -9.073
  759   1HE   LYS 103          HE2       LYS 103 -18.755  37.194 -10.431
  760   2HE   LYS 103          HE3       LYS 103 -19.469  37.922 -11.857
  761   1HZ   LYS 103          HZ1       LYS 103 -17.867  39.421 -10.772
  762   2HZ   LYS 103          HZ2       LYS 103 -19.332  40.091 -10.749
  763   3HZ   LYS 103          HZ3       LYS 103 -18.720  39.395  -9.399
  764    H    VAL 104           H        VAL 104 -25.859  34.465 -10.988
  765    HA   VAL 104           HA       VAL 104 -25.426  34.353 -13.947
  766    HB   VAL 104           HB       VAL 104 -27.700  33.337 -12.211
  767   1HG1  VAL 104          1HG1      VAL 104 -27.135  33.053 -15.199
  768   2HG1  VAL 104          2HG1      VAL 104 -28.386  32.126 -14.309
  769   3HG1  VAL 104          3HG1      VAL 104 -28.527  33.880 -14.450
  770   1HG2  VAL 104          1HG2      VAL 104 -26.823  31.113 -12.848
  771   2HG2  VAL 104          2HG2      VAL 104 -25.420  31.893 -13.601
  772   3HG2  VAL 104          3HG2      VAL 104 -25.681  32.022 -11.854
  773    H    PHE 105           H        PHE 105 -25.888  36.188 -15.079
  774    HA   PHE 105           HA       PHE 105 -27.820  38.127 -13.936
  775   1HB   PHE 105          HB2       PHE 105 -26.487  39.742 -15.234
  776   2HB   PHE 105          HB3       PHE 105 -25.612  38.973 -13.933
  777    HD1  PHE 105           HD1      PHE 105 -25.918  39.407 -17.551
  778    HD2  PHE 105           HD2      PHE 105 -23.704  37.428 -14.415
  779    HE1  PHE 105           HE1      PHE 105 -24.053  38.966 -19.141
  780    HE2  PHE 105           HE2      PHE 105 -21.845  36.982 -16.034
  781    HZ   PHE 105           HZ       PHE 105 -22.026  37.750 -18.368
  782    H    ALA 106           H        ALA 106 -29.429  38.966 -15.125
  783    HA   ALA 106           HA       ALA 106 -30.217  37.471 -17.524
  784   1HB   ALA 106          HB1       ALA 106 -32.452  38.266 -16.996
  785   2HB   ALA 106          HB2       ALA 106 -31.692  37.602 -15.528
  786   3HB   ALA 106          HB3       ALA 106 -31.815  39.364 -15.779
  787    H    LYS 107           H        LYS 107 -28.189  39.076 -18.223
  788    HA   LYS 107           HA       LYS 107 -27.475  40.560 -19.826
  789   1HB   LYS 107          HB2       LYS 107 -30.318  40.241 -20.900
  790   2HB   LYS 107          HB3       LYS 107 -28.959  40.941 -21.792
  791   1HG   LYS 107          HG2       LYS 107 -27.722  38.822 -21.637
  792   2HG   LYS 107          HG3       LYS 107 -29.048  38.067 -20.752
  793   1HD   LYS 107          HD2       LYS 107 -29.206  39.169 -23.611
  794   2HD   LYS 107          HD3       LYS 107 -29.008  37.482 -23.164
  795   1HE   LYS 107          HE2       LYS 107 -31.169  37.536 -21.920
  796   2HE   LYS 107          HE3       LYS 107 -31.410  39.212 -22.426
  797   1HZ   LYS 107          HZ1       LYS 107 -31.374  38.474 -24.730
  798   2HZ   LYS 107          HZ2       LYS 107 -31.136  36.921 -24.301
  799   3HZ   LYS 107          HZ3       LYS 107 -32.550  37.670 -23.940
  Start of MODEL    2
    1   1H    GLY   1          H1        GLY   1  -7.235   5.424  10.032
    2   2H    GLY   1          H2        GLY   1  -6.257   6.757  10.036
    3   3H    GLY   1          H3        GLY   1  -7.660   6.736   9.163
    4   1HA   GLY   1          HA2       GLY   1  -6.802   5.034   7.706
    5   2HA   GLY   1          HA3       GLY   1  -5.798   6.493   7.663
    6    H    LYS   2           H        LYS   2  -4.962   4.000   6.855
    7    HA   LYS   2           HA       LYS   2  -2.421   3.774   8.260
    8   1HB   LYS   2          HB2       LYS   2  -3.886   2.334   9.640
    9   2HB   LYS   2          HB3       LYS   2  -4.333   1.420   8.175
   10   1HG   LYS   2          HG2       LYS   2  -1.964   0.639   8.007
   11   2HG   LYS   2          HG3       LYS   2  -1.529   1.651   9.392
   12   1HD   LYS   2          HD2       LYS   2  -3.059   0.345  10.821
   13   2HD   LYS   2          HD3       LYS   2  -3.520  -0.676   9.431
   14   1HE   LYS   2          HE2       LYS   2  -1.084  -1.305   9.168
   15   2HE   LYS   2          HE3       LYS   2  -0.708  -0.374  10.619
   16   1HZ   LYS   2          HZ1       LYS   2  -2.521  -2.731  10.581
   17   2HZ   LYS   2          HZ2       LYS   2  -0.983  -2.724  11.136
   18   3HZ   LYS   2          HZ3       LYS   2  -2.116  -1.874  11.899
   19    H    ASP   3           H        ASP   3  -0.816   2.838   6.961
   20    HA   ASP   3           HA       ASP   3  -1.441   2.440   4.091
   21   1HB   ASP   3          HB2       ASP   3   0.974   2.281   3.820
   22   2HB   ASP   3          HB3       ASP   3   0.537   3.738   4.708
   23    H    ILE   4           H        ILE   4  -1.915   0.485   3.270
   24    HA   ILE   4           HA       ILE   4  -1.710  -1.940   4.987
   25    HB   ILE   4           HB       ILE   4  -3.300  -1.439   2.471
   26   1HG1  ILE   4          2HG1      ILE   4  -4.091   0.122   4.124
   27   2HG1  ILE   4          3HG1      ILE   4  -5.250  -1.196   3.950
   28   1HG2  ILE   4          1HG2      ILE   4  -3.091  -3.823   2.782
   29   2HG2  ILE   4          2HG2      ILE   4  -3.389  -3.697   4.514
   30   3HG2  ILE   4          3HG2      ILE   4  -4.685  -3.375   3.358
   31   1HD1  ILE   4          1HD1      ILE   4  -5.048  -0.563   6.260
   32   2HD1  ILE   4          2HD1      ILE   4  -4.397  -2.213   6.078
   33   3HD1  ILE   4          3HD1      ILE   4  -3.304  -0.832   6.297
   34    H    GLN   5           H        GLN   5  -0.060  -0.570   2.315
   35    HA   GLN   5           HA       GLN   5   1.610  -2.905   1.746
   36   1HB   GLN   5          HB2       GLN   5  -0.720  -3.042   0.431
   37   2HB   GLN   5          HB3       GLN   5   0.089  -1.851  -0.630
   38   1HG   GLN   5          HG2       GLN   5   1.949  -3.533  -0.944
   39   2HG   GLN   5          HG3       GLN   5   1.133  -4.639   0.152
   40   1HE2  GLN   5          1HE2      GLN   5  -0.945  -5.888  -2.470
   41   2HE2  GLN   5          2HE2      GLN   5  -0.442  -6.052  -0.776
   42    H    VAL   6           H        VAL   6   2.545  -1.880  -0.711
   43    HA   VAL   6           HA       VAL   6   4.019   0.544  -0.043
   44    HB   VAL   6           HB       VAL   6   3.987  -0.857  -2.730
   45   1HG1  VAL   6          1HG1      VAL   6   6.262   0.099  -2.861
   46   2HG1  VAL   6          2HG1      VAL   6   5.080   1.402  -2.637
   47   3HG1  VAL   6          3HG1      VAL   6   6.079   0.841  -1.272
   48   1HG2  VAL   6          1HG2      VAL   6   5.986  -2.089  -1.924
   49   2HG2  VAL   6          2HG2      VAL   6   5.677  -1.484  -0.277
   50   3HG2  VAL   6          3HG2      VAL   6   4.526  -2.584  -1.100
   51    H    ILE   7           H        ILE   7   1.621   1.280   0.342
   52    HA   ILE   7           HA       ILE   7   0.621   3.091  -1.787
   53    HB   ILE   7           HB       ILE   7  -0.985   0.888  -0.416
   54   1HG1  ILE   7          2HG1      ILE   7  -0.451   1.337  -3.396
   55   2HG1  ILE   7          3HG1      ILE   7   0.207   0.030  -2.393
   56   1HG2  ILE   7          1HG2      ILE   7  -2.979   1.795  -1.478
   57   2HG2  ILE   7          2HG2      ILE   7  -2.281   3.040  -0.541
   58   3HG2  ILE   7          3HG2      ILE   7  -2.041   3.064  -2.294
   59   1HD1  ILE   7          1HD1      ILE   7  -2.686   0.365  -3.242
   60   2HD1  ILE   7          2HD1      ILE   7  -1.543  -0.872  -3.745
   61   3HD1  ILE   7          3HD1      ILE   7  -2.107  -0.835  -2.055
   62    H    VAL   8           H        VAL   8   0.711   4.938  -0.689
   63    HA   VAL   8           HA       VAL   8   0.576   5.022   2.273
   64    HB   VAL   8           HB       VAL   8   1.133   7.183   0.149
   65   1HG1  VAL   8          1HG1      VAL   8   1.534   7.296   3.194
   66   2HG1  VAL   8          2HG1      VAL   8   2.087   8.515   1.990
   67   3HG1  VAL   8          3HG1      VAL   8   0.365   8.232   2.259
   68   1HG2  VAL   8          1HG2      VAL   8   2.907   5.475   0.159
   69   2HG2  VAL   8          2HG2      VAL   8   3.507   6.924   0.958
   70   3HG2  VAL   8          3HG2      VAL   8   2.985   5.551   1.934
   71    H    ASN   9           H        ASN   9  -0.983   6.108   3.463
   72    HA   ASN   9           HA       ASN   9  -3.523   6.570   2.098
   73   1HB   ASN   9          HB2       ASN   9  -4.677   6.170   4.065
   74   2HB   ASN   9          HB3       ASN   9  -3.430   4.939   4.035
   75   1HD2  ASN   9          1HD2      ASN   9  -1.655   6.328   6.854
   76   2HD2  ASN   9          2HD2      ASN   9  -1.409   5.400   5.389
   77    H    VAL  10           H        VAL  10  -3.634   8.413   1.226
   78    HA   VAL  10           HA       VAL  10  -2.527  10.892   2.446
   79    HB   VAL  10           HB       VAL  10  -3.496  10.322  -0.381
   80   1HG1  VAL  10          1HG1      VAL  10  -3.684  12.693   0.084
   81   2HG1  VAL  10          2HG1      VAL  10  -2.051  12.708   0.811
   82   3HG1  VAL  10          3HG1      VAL  10  -2.286  12.402  -0.947
   83   1HG2  VAL  10          1HG2      VAL  10  -1.466   9.038   0.048
   84   2HG2  VAL  10          2HG2      VAL  10  -1.059  10.418  -0.951
   85   3HG2  VAL  10          3HG2      VAL  10  -0.682  10.448   0.783
   86    HA   PRO  11           HA       PRO  11  -6.820  12.002   3.547
   87   1HB   PRO  11          HB2       PRO  11  -5.532  14.725   3.703
   88   2HB   PRO  11          HB3       PRO  11  -6.695  13.958   4.837
   89   1HG   PRO  11          HG2       PRO  11  -4.057  14.018   5.417
   90   2HG   PRO  11          HG3       PRO  11  -4.966  12.510   5.684
   91   1HD   PRO  11          HD2       PRO  11  -3.168  13.182   3.337
   92   2HD   PRO  11          HD3       PRO  11  -3.294  11.667   4.292
   93    HA   PRO  12           HA       PRO  12  -8.398  13.830  -0.193
   94   1HB   PRO  12          HB2       PRO  12 -10.493  15.354   1.282
   95   2HB   PRO  12          HB3       PRO  12 -10.673  14.084   0.052
   96   1HG   PRO  12          HG2       PRO  12 -11.184  13.567   2.672
   97   2HG   PRO  12          HG3       PRO  12 -10.426  12.348   1.613
   98   1HD   PRO  12          HD2       PRO  12  -9.027  14.294   3.512
   99   2HD   PRO  12          HD3       PRO  12  -8.827  12.514   3.389
  100    H    SER  13           H        SER  13  -8.285  15.639  -1.408
  101    HA   SER  13           HA       SER  13  -7.300  18.191  -0.248
  102   1HB   SER  13          HB2       SER  13  -5.503  16.548  -1.027
  103   2HB   SER  13          HB3       SER  13  -6.187  16.680  -2.644
  104    HG   SER  13           HG       SER  13  -4.434  18.114  -2.323
  105    H    VAL  14           H        VAL  14  -9.673  18.550  -0.538
  106    HA   VAL  14           HA       VAL  14 -10.468  19.034  -3.318
  107    HB   VAL  14           HB       VAL  14 -11.993  17.894  -1.721
  108   1HG1  VAL  14          1HG1      VAL  14 -11.733  19.608   0.186
  109   2HG1  VAL  14          2HG1      VAL  14 -12.822  20.642  -0.743
  110   3HG1  VAL  14          3HG1      VAL  14 -13.367  19.042  -0.189
  111   1HG2  VAL  14          1HG2      VAL  14 -14.004  18.873  -2.640
  112   2HG2  VAL  14          2HG2      VAL  14 -13.106  20.336  -3.098
  113   3HG2  VAL  14          3HG2      VAL  14 -12.742  18.789  -3.867
  114    H    ARG  15           H        ARG  15 -10.736  20.988  -4.269
  115    HA   ARG  15           HA       ARG  15 -10.375  23.531  -2.715
  116   1HB   ARG  15          HB2       ARG  15  -8.802  22.557  -5.176
  117   2HB   ARG  15          HB3       ARG  15  -8.880  24.231  -4.646
  118   1HG   ARG  15          HG2       ARG  15  -7.047  23.716  -3.475
  119   2HG   ARG  15          HG3       ARG  15  -8.234  23.188  -2.291
  120   1HD   ARG  15          HD2       ARG  15  -7.946  20.843  -3.110
  121   2HD   ARG  15          HD3       ARG  15  -6.781  21.409  -4.293
  122    HE   ARG  15           HE       ARG  15  -5.176  21.386  -2.677
  123   1HH1  ARG  15          1HH1      ARG  15  -8.199  21.485  -0.852
  124   2HH1  ARG  15          2HH1      ARG  15  -7.366  21.296   0.661
  125   1HH2  ARG  15          1HH2      ARG  15  -4.229  21.097  -0.717
  126   2HH2  ARG  15          2HH2      ARG  15  -5.214  21.058   0.732
  127    H    ALA  16           H        ALA  16 -10.798  25.404  -4.059
  128    HA   ALA  16           HA       ALA  16 -13.203  25.123  -5.788
  129   1HB   ALA  16          HB1       ALA  16 -11.745  27.547  -4.673
  130   2HB   ALA  16          HB2       ALA  16 -13.227  27.567  -5.639
  131   3HB   ALA  16          HB3       ALA  16 -13.241  26.808  -4.054
  132    H    ARG  17           H        ARG  17 -13.052  25.089  -7.900
  133    HA   ARG  17           HA       ARG  17 -10.523  25.476  -9.318
  134   1HB   ARG  17          HB2       ARG  17 -12.181  23.690  -9.805
  135   2HB   ARG  17          HB3       ARG  17 -13.333  24.899 -10.361
  136   1HG   ARG  17          HG2       ARG  17 -12.419  23.881 -12.302
  137   2HG   ARG  17          HG3       ARG  17 -11.663  25.475 -12.226
  138   1HD   ARG  17          HD2       ARG  17  -9.865  24.124 -12.744
  139   2HD   ARG  17          HD3       ARG  17  -9.706  24.265 -10.991
  140    HE   ARG  17           HE       ARG  17 -11.231  21.877 -11.865
  141   1HH1  ARG  17          1HH1      ARG  17  -7.982  23.068 -11.202
  142   2HH1  ARG  17          2HH1      ARG  17  -7.387  21.444 -10.971
  143   1HH2  ARG  17          1HH2      ARG  17 -10.400  19.954 -11.666
  144   2HH2  ARG  17          2HH2      ARG  17  -8.692  19.670 -11.335
  145    H    GLN  18           H        GLN  18 -13.085  27.530  -8.509
  146    HA   GLN  18           HA       GLN  18 -11.854  29.870  -9.549
  147   1HB   GLN  18          HB2       GLN  18 -13.479  28.739 -11.443
  148   2HB   GLN  18          HB3       GLN  18 -14.650  29.725 -10.591
  149   1HG   GLN  18          HG2       GLN  18 -12.032  30.990 -11.497
  150   2HG   GLN  18          HG3       GLN  18 -13.281  30.616 -12.681
  151   1HE2  GLN  18          1HE2      GLN  18 -15.349  33.304 -11.776
  152   2HE2  GLN  18          2HE2      GLN  18 -15.164  31.849 -12.753
  153    H    SER  19           H        SER  19 -12.986  31.848  -8.657
  154    HA   SER  19           HA       SER  19 -14.197  31.170  -6.014
  155   1HB   SER  19          HB2       SER  19 -13.010  33.778  -7.058
  156   2HB   SER  19          HB3       SER  19 -13.585  33.480  -5.422
  157    HG   SER  19           HG       SER  19 -11.337  33.197  -5.564
  158    H    THR  20           H        THR  20 -14.934  33.058  -8.931
  159    HA   THR  20           HA       THR  20 -17.788  33.230  -8.095
  160    HB   THR  20           HB       THR  20 -16.246  35.729  -8.876
  161    HG1  THR  20           HG1      THR  20 -15.794  35.101  -6.750
  162   1HG2  THR  20          1HG2      THR  20 -18.353  36.886  -8.219
  163   2HG2  THR  20          2HG2      THR  20 -18.618  35.815  -9.592
  164   3HG2  THR  20          3HG2      THR  20 -19.130  35.302  -7.976
  165    H    MET  21           H        MET  21 -18.330  31.893  -9.713
  166    HA   MET  21           HA       MET  21 -17.728  32.448 -12.565
  167   1HB   MET  21          HB2       MET  21 -19.608  30.494 -11.160
  168   2HB   MET  21          HB3       MET  21 -19.427  30.616 -12.912
  169   1HG   MET  21          HG2       MET  21 -17.165  29.933 -10.987
  170   2HG   MET  21          HG3       MET  21 -18.103  28.769 -11.905
  171   1HE   MET  21          HE1       MET  21 -16.899  29.424 -15.594
  172   2HE   MET  21          HE2       MET  21 -17.991  28.511 -14.546
  173   3HE   MET  21          HE3       MET  21 -18.331  30.213 -14.896
  174    H    ASN  22           H        ASN  22 -19.461  32.887 -14.127
  175    HA   ASN  22           HA       ASN  22 -21.984  33.942 -13.239
  176   1HB   ASN  22          HB2       ASN  22 -21.711  36.221 -13.917
  177   2HB   ASN  22          HB3       ASN  22 -20.470  35.865 -12.713
  178   1HD2  ASN  22          1HD2      ASN  22 -17.756  36.351 -14.983
  179   2HD2  ASN  22          2HD2      ASN  22 -18.221  35.713 -13.415
  180    H    ALA  23           H        ALA  23 -23.440  34.504 -15.061
  181    HA   ALA  23           HA       ALA  23 -22.605  33.935 -17.779
  182   1HB   ALA  23          HB1       ALA  23 -24.190  31.815 -16.245
  183   2HB   ALA  23          HB2       ALA  23 -23.907  31.855 -18.009
  184   3HB   ALA  23          HB3       ALA  23 -22.540  31.667 -16.890
  185    H    THR  24           H        THR  24 -24.288  34.129 -19.312
  186    HA   THR  24           HA       THR  24 -26.653  35.674 -18.452
  187    HB   THR  24           HB       THR  24 -25.898  34.918 -21.284
  188    HG1  THR  24           HG1      THR  24 -24.869  36.877 -21.391
  189   1HG2  THR  24          1HG2      THR  24 -27.143  37.015 -21.813
  190   2HG2  THR  24          2HG2      THR  24 -28.181  35.835 -21.005
  191   3HG2  THR  24          3HG2      THR  24 -27.549  37.181 -20.068
  192    H    ALA  25           H        ALA  25 -28.574  34.739 -18.108
  193    HA   ALA  25           HA       ALA  25 -29.136  31.940 -18.618
  194   1HB   ALA  25          HB1       ALA  25 -31.408  32.591 -17.752
  195   2HB   ALA  25          HB2       ALA  25 -30.090  33.130 -16.701
  196   3HB   ALA  25          HB3       ALA  25 -30.917  34.284 -17.758
  197    H    ASN  26           H        ASN  26 -30.753  31.076 -19.898
  198    HA   ASN  26           HA       ASN  26 -32.213  30.718 -21.537
  199   1HB   ASN  26          HB2       ASN  26 -32.475  33.733 -21.881
  200   2HB   ASN  26          HB3       ASN  26 -33.583  32.513 -22.485
  201   1HD2  ASN  26          1HD2      ASN  26 -34.167  33.793 -18.760
  202   2HD2  ASN  26          2HD2      ASN  26 -33.014  34.559 -19.854
  203    H    LEU  27           H        LEU  27 -29.207  31.503 -22.215
  204    HA   LEU  27           HA       LEU  27 -29.490  31.883 -25.148
  205   1HB   LEU  27          HB2       LEU  27 -26.952  31.684 -23.472
  206   2HB   LEU  27          HB3       LEU  27 -27.075  32.142 -25.151
  207    HG   LEU  27           HG       LEU  27 -28.049  33.767 -22.770
  208   1HD1  LEU  27          1HD1      LEU  27 -26.382  35.363 -23.600
  209   2HD1  LEU  27          2HD1      LEU  27 -25.612  33.780 -23.299
  210   3HD1  LEU  27          3HD1      LEU  27 -25.986  34.295 -24.956
  211   1HD2  LEU  27          1HD2      LEU  27 -28.389  34.347 -25.745
  212   2HD2  LEU  27          2HD2      LEU  27 -29.689  34.151 -24.556
  213   3HD2  LEU  27          3HD2      LEU  27 -28.587  35.530 -24.446
  214    H    SER  28           H        SER  28 -29.598  29.215 -23.241
  215    HA   SER  28           HA       SER  28 -29.458  26.984 -23.605
  216   1HB   SER  28          HB2       SER  28 -29.594  27.741 -26.543
  217   2HB   SER  28          HB3       SER  28 -29.935  26.155 -25.863
  218    HG   SER  28           HG       SER  28 -31.829  27.472 -26.174
  219    H    GLN  29           H        GLN  29 -26.928  28.357 -23.341
  220    HA   GLN  29           HA       GLN  29 -24.989  26.890 -24.964
  221   1HB   GLN  29          HB2       GLN  29 -23.399  28.368 -24.207
  222   2HB   GLN  29          HB3       GLN  29 -24.811  29.376 -24.417
  223   1HG   GLN  29          HG2       GLN  29 -23.948  28.318 -21.687
  224   2HG   GLN  29          HG3       GLN  29 -23.362  29.793 -22.404
  225   1HE2  GLN  29          1HE2      GLN  29 -25.961  31.542 -20.804
  226   2HE2  GLN  29          2HE2      GLN  29 -24.237  31.399 -21.095
  227    H    SER  30           H        SER  30 -22.891  26.281 -23.488
  228    HA   SER  30           HA       SER  30 -23.767  24.806 -21.093
  229   1HB   SER  30          HB2       SER  30 -22.122  23.044 -21.571
  230   2HB   SER  30          HB3       SER  30 -23.453  23.079 -22.719
  231    HG   SER  30           HG       SER  30 -22.114  24.029 -24.240
  232    H    VAL  31           H        VAL  31 -22.445  24.763 -19.401
  233    HA   VAL  31           HA       VAL  31 -20.021  26.534 -19.403
  234    HB   VAL  31           HB       VAL  31 -22.400  26.783 -17.514
  235   1HG1  VAL  31          1HG1      VAL  31 -19.712  28.220 -17.465
  236   2HG1  VAL  31          2HG1      VAL  31 -21.130  28.722 -16.547
  237   3HG1  VAL  31          3HG1      VAL  31 -20.367  27.153 -16.199
  238   1HG2  VAL  31          1HG2      VAL  31 -21.215  28.707 -19.562
  239   2HG2  VAL  31          2HG2      VAL  31 -22.822  27.947 -19.629
  240   3HG2  VAL  31          3HG2      VAL  31 -22.454  29.127 -18.369
  241    H    THR  32           H        THR  32 -18.385  25.851 -18.017
  242    HA   THR  32           HA       THR  32 -18.956  23.492 -16.214
  243    HB   THR  32           HB       THR  32 -16.310  24.193 -17.550
  244    HG1  THR  32           HG1      THR  32 -16.814  22.625 -19.009
  245   1HG2  THR  32          1HG2      THR  32 -15.747  21.819 -17.001
  246   2HG2  THR  32          2HG2      THR  32 -15.918  22.815 -15.570
  247   3HG2  THR  32          3HG2      THR  32 -17.217  21.694 -16.026
  248    H    LEU  33           H        LEU  33 -18.133  23.448 -14.202
  249    HA   LEU  33           HA       LEU  33 -16.184  25.300 -13.124
  250   1HB   LEU  33          HB2       LEU  33 -17.592  26.361 -11.463
  251   2HB   LEU  33          HB3       LEU  33 -18.146  26.717 -13.088
  252    HG   LEU  33           HG       LEU  33 -19.820  24.609 -12.588
  253   1HD1  LEU  33          1HD1      LEU  33 -19.287  25.793  -9.824
  254   2HD1  LEU  33          2HD1      LEU  33 -20.569  24.628 -10.263
  255   3HD1  LEU  33          3HD1      LEU  33 -18.889  24.143 -10.332
  256   1HD2  LEU  33          1HD2      LEU  33 -20.481  26.903 -13.162
  257   2HD2  LEU  33          2HD2      LEU  33 -21.500  26.223 -11.861
  258   3HD2  LEU  33          3HD2      LEU  33 -20.232  27.410 -11.492
  259    H    ALA  34           H        ALA  34 -15.815  24.723 -10.686
  260    HA   ALA  34           HA       ALA  34 -16.609  21.980 -10.014
  261   1HB   ALA  34          HB1       ALA  34 -13.687  22.394 -10.562
  262   2HB   ALA  34          HB2       ALA  34 -14.618  20.896 -10.482
  263   3HB   ALA  34          HB3       ALA  34 -14.770  21.968 -11.878
  264    H    CYS  35           H        CYS  35 -16.046  21.234  -8.131
  265    HA   CYS  35           HA       CYS  35 -14.467  22.885  -6.182
  266   1HB   CYS  35          HB2       CYS  35 -17.066  22.528  -5.946
  267   2HB   CYS  35          HB3       CYS  35 -16.609  20.968  -5.298
  268    H    ASP  36           H        ASP  36 -12.679  21.777  -7.312
  269    HA   ASP  36           HA       ASP  36 -12.669  19.026  -8.030
  270   1HB   ASP  36          HB2       ASP  36 -10.573  19.369  -8.935
  271   2HB   ASP  36          HB3       ASP  36 -11.625  20.669  -9.379
  272    H    ALA  37           H        ALA  37 -12.478  17.359  -6.841
  273    HA   ALA  37           HA       ALA  37 -10.776  17.391  -4.411
  274   1HB   ALA  37          HB1       ALA  37 -13.109  16.589  -4.259
  275   2HB   ALA  37          HB2       ALA  37 -12.735  15.319  -5.449
  276   3HB   ALA  37          HB3       ALA  37 -11.959  15.304  -3.841
  277    H    ASP  38           H        ASP  38  -9.366  15.710  -3.886
  278    HA   ASP  38           HA       ASP  38  -8.474  13.684  -5.794
  279   1HB   ASP  38          HB2       ASP  38  -7.223  15.732  -6.525
  280   2HB   ASP  38          HB3       ASP  38  -6.638  15.934  -4.873
  281    H    GLY  39           H        GLY  39  -6.820  12.226  -4.641
  282   1HA   GLY  39          HA2       GLY  39  -5.957  12.288  -2.011
  283   2HA   GLY  39          HA3       GLY  39  -7.595  11.659  -1.898
  284    H    PHE  40           H        PHE  40  -5.646   9.921  -1.085
  285    HA   PHE  40           HA       PHE  40  -5.711   7.822  -3.137
  286   1HB   PHE  40          HB2       PHE  40  -3.706   9.190  -3.587
  287   2HB   PHE  40          HB3       PHE  40  -3.096   8.758  -2.005
  288    HD1  PHE  40           HD1      PHE  40  -4.615   7.069  -5.042
  289    HD2  PHE  40           HD2      PHE  40  -1.494   7.020  -2.062
  290    HE1  PHE  40           HE1      PHE  40  -3.669   5.054  -6.078
  291    HE2  PHE  40           HE2      PHE  40  -0.511   5.000  -3.143
  292    HZ   PHE  40           HZ       PHE  40  -1.586   4.016  -5.138
  293    HA   PRO  41           HA       PRO  41  -6.528   5.700  -3.038
  294   1HB   PRO  41          HB2       PRO  41  -8.728   4.963  -1.099
  295   2HB   PRO  41          HB3       PRO  41  -8.045   4.021  -2.468
  296   1HG   PRO  41          HG2       PRO  41  -7.322   3.448   0.062
  297   2HG   PRO  41          HG3       PRO  41  -6.087   3.450  -1.227
  298   1HD   PRO  41          HD2       PRO  41  -6.672   5.633   0.793
  299   2HD   PRO  41          HD3       PRO  41  -5.084   5.014   0.250
  300    H    GLU  42           H        GLU  42  -8.224   6.423  -4.309
  301    HA   GLU  42           HA       GLU  42  -8.887   9.038  -4.405
  302   1HB   GLU  42          HB2       GLU  42 -10.497   6.667  -5.422
  303   2HB   GLU  42          HB3       GLU  42 -10.759   8.335  -5.949
  304   1HG   GLU  42          HG2       GLU  42  -8.403   8.436  -6.787
  305   2HG   GLU  42          HG3       GLU  42  -8.165   6.759  -6.288
  306    HA   PRO  43           HA       PRO  43 -11.752   9.615  -1.180
  307   1HB   PRO  43          HB2       PRO  43 -12.417  12.247  -1.435
  308   2HB   PRO  43          HB3       PRO  43 -10.720  11.729  -1.112
  309   1HG   PRO  43          HG2       PRO  43 -12.039  12.297  -3.764
  310   2HG   PRO  43          HG3       PRO  43 -10.555  13.052  -3.134
  311   1HD   PRO  43          HD2       PRO  43 -10.407  10.924  -4.808
  312   2HD   PRO  43          HD3       PRO  43  -9.314  11.036  -3.368
  313    H    THR  44           H        THR  44 -13.866  10.228  -0.569
  314    HA   THR  44           HA       THR  44 -16.017   9.881  -2.684
  315    HB   THR  44           HB       THR  44 -16.131   9.487   0.342
  316    HG1  THR  44           HG1      THR  44 -15.051   7.863  -0.767
  317   1HG2  THR  44          1HG2      THR  44 -18.219   9.041  -1.832
  318   2HG2  THR  44          2HG2      THR  44 -18.390   8.483  -0.148
  319   3HG2  THR  44          3HG2      THR  44 -18.307  10.217  -0.484
  320    H    MET  45           H        MET  45 -17.462  11.620  -2.930
  321    HA   MET  45           HA       MET  45 -17.366  13.841  -1.005
  322   1HB   MET  45          HB2       MET  45 -16.590  15.473  -2.656
  323   2HB   MET  45          HB3       MET  45 -15.412  14.183  -2.443
  324   1HG   MET  45          HG2       MET  45 -15.387  14.314  -4.737
  325   2HG   MET  45          HG3       MET  45 -16.665  13.117  -4.533
  326   1HE   MET  45          HE1       MET  45 -15.408  16.398  -5.655
  327   2HE   MET  45          HE2       MET  45 -16.798  17.413  -6.082
  328   3HE   MET  45          HE3       MET  45 -16.384  17.135  -4.355
  329    H    THR  46           H        THR  46 -18.887  15.517  -1.347
  330    HA   THR  46           HA       THR  46 -20.962  15.316  -3.433
  331    HB   THR  46           HB       THR  46 -22.810  15.541  -1.704
  332    HG1  THR  46           HG1      THR  46 -21.499  15.858   0.179
  333   1HG2  THR  46          1HG2      THR  46 -22.377  13.454  -3.003
  334   2HG2  THR  46          2HG2      THR  46 -21.482  12.832  -1.601
  335   3HG2  THR  46          3HG2      THR  46 -23.201  13.197  -1.440
  336    H    TRP  47           H        TRP  47 -22.400  17.243  -3.320
  337    HA   TRP  47           HA       TRP  47 -21.561  19.474  -1.674
  338   1HB   TRP  47          HB2       TRP  47 -20.846  20.937  -3.566
  339   2HB   TRP  47          HB3       TRP  47 -19.790  19.609  -3.126
  340    HD1  TRP  47           HD1      TRP  47 -19.862  17.385  -4.783
  341    HE1  TRP  47           HE1      TRP  47 -19.173  17.552  -7.231
  342    HE3  TRP  47           HE3      TRP  47 -21.104  22.285  -5.624
  343    HZ2  TRP  47           HZ2      TRP  47 -18.966  19.619  -9.232
  344    HZ3  TRP  47           HZ3      TRP  47 -20.602  23.348  -7.815
  345    HH2  TRP  47           HH2      TRP  47 -19.531  22.017  -9.619
  346    H    THR  48           H        THR  48 -22.655  21.448  -1.969
  347    HA   THR  48           HA       THR  48 -25.476  21.060  -2.923
  348    HB   THR  48           HB       THR  48 -26.245  21.994  -0.867
  349    HG1  THR  48           HG1      THR  48 -24.712  22.737   0.701
  350   1HG2  THR  48          1HG2      THR  48 -25.442  20.546   0.890
  351   2HG2  THR  48          2HG2      THR  48 -25.346  19.604  -0.614
  352   3HG2  THR  48          3HG2      THR  48 -23.880  20.307   0.060
  353    H    LYS  49           H        LYS  49 -26.712  23.061  -3.153
  354    HA   LYS  49           HA       LYS  49 -25.145  25.563  -3.708
  355   1HB   LYS  49          HB2       LYS  49 -26.875  26.246  -5.255
  356   2HB   LYS  49          HB3       LYS  49 -25.982  24.835  -5.790
  357   1HG   LYS  49          HG2       LYS  49 -27.995  23.460  -4.931
  358   2HG   LYS  49          HG3       LYS  49 -28.849  24.984  -4.803
  359   1HD   LYS  49          HD2       LYS  49 -27.791  23.636  -7.290
  360   2HD   LYS  49          HD3       LYS  49 -29.464  23.997  -6.881
  361   1HE   LYS  49          HE2       LYS  49 -27.308  26.038  -7.552
  362   2HE   LYS  49          HE3       LYS  49 -28.580  25.505  -8.642
  363   1HZ   LYS  49          HZ1       LYS  49 -30.218  26.567  -7.303
  364   2HZ   LYS  49          HZ2       LYS  49 -29.153  26.891  -6.085
  365   3HZ   LYS  49          HZ3       LYS  49 -29.013  27.658  -7.505
  366    H    ASP  50           H        ASP  50 -25.255  26.626  -1.878
  367    HA   ASP  50           HA       ASP  50 -26.007  27.871  -0.172
  368   1HB   ASP  50          HB2       ASP  50 -28.768  27.682  -1.433
  369   2HB   ASP  50          HB3       ASP  50 -28.309  28.714  -0.098
  370    H    GLY  51           H        GLY  51 -27.870  24.923  -0.657
  371   1HA   GLY  51          HA2       GLY  51 -27.503  23.918   1.980
  372   2HA   GLY  51          HA3       GLY  51 -29.099  24.652   1.885
  373    H    GLU  52           H        GLU  52 -29.266  23.771  -1.137
  374    HA   GLU  52           HA       GLU  52 -30.237  21.037  -0.524
  375   1HB   GLU  52          HB2       GLU  52 -31.540  21.167  -2.510
  376   2HB   GLU  52          HB3       GLU  52 -31.824  22.550  -1.462
  377   1HG   GLU  52          HG2       GLU  52 -30.390  23.983  -2.933
  378   2HG   GLU  52          HG3       GLU  52 -30.091  22.611  -3.994
  379    HA   PRO  53           HA       PRO  53 -26.706  19.301  -2.502
  380   1HB   PRO  53          HB2       PRO  53 -27.329  16.688  -2.654
  381   2HB   PRO  53          HB3       PRO  53 -27.244  17.556  -1.089
  382   1HG   PRO  53          HG2       PRO  53 -29.741  16.964  -2.732
  383   2HG   PRO  53          HG3       PRO  53 -29.467  16.651  -0.988
  384   1HD   PRO  53          HD2       PRO  53 -30.738  18.896  -1.932
  385   2HD   PRO  53          HD3       PRO  53 -29.714  18.913  -0.458
  386    H    ILE  54           H        ILE  54 -25.710  18.780  -4.328
  387    HA   ILE  54           HA       ILE  54 -27.282  18.715  -6.817
  388    HB   ILE  54           HB       ILE  54 -24.338  19.451  -6.470
  389   1HG1  ILE  54          2HG1      ILE  54 -26.523  21.513  -6.917
  390   2HG1  ILE  54          3HG1      ILE  54 -26.131  21.021  -5.290
  391   1HG2  ILE  54          1HG2      ILE  54 -24.756  18.961  -8.819
  392   2HG2  ILE  54          2HG2      ILE  54 -26.296  19.845  -8.790
  393   3HG2  ILE  54          3HG2      ILE  54 -24.766  20.712  -8.690
  394   1HD1  ILE  54          1HD1      ILE  54 -24.882  23.026  -5.949
  395   2HD1  ILE  54          2HD1      ILE  54 -23.806  21.687  -5.500
  396   3HD1  ILE  54          3HD1      ILE  54 -24.031  22.131  -7.185
  397    H    GLU  55           H        GLU  55 -26.448  16.568  -4.980
  398    HA   GLU  55           HA       GLU  55 -24.665  14.647  -5.485
  399   1HB   GLU  55          HB2       GLU  55 -26.478  12.948  -5.045
  400   2HB   GLU  55          HB3       GLU  55 -26.157  14.198  -3.825
  401   1HG   GLU  55          HG2       GLU  55 -28.199  15.434  -4.637
  402   2HG   GLU  55          HG3       GLU  55 -28.475  14.105  -5.786
  403    H    GLN  56           H        GLN  56 -23.826  14.631  -7.567
  404    HA   GLN  56           HA       GLN  56 -25.229  14.304  -9.910
  405   1HB   GLN  56          HB2       GLN  56 -22.315  13.589  -9.313
  406   2HB   GLN  56          HB3       GLN  56 -23.025  13.877 -10.896
  407   1HG   GLN  56          HG2       GLN  56 -22.057  15.924 -10.436
  408   2HG   GLN  56          HG3       GLN  56 -23.756  16.166  -9.971
  409   1HE2  GLN  56          1HE2      GLN  56 -21.781  17.824  -7.370
  410   2HE2  GLN  56          2HE2      GLN  56 -22.373  18.114  -8.996
  411    H    GLU  57           H        GLU  57 -25.113  11.862  -7.702
  412    HA   GLU  57           HA       GLU  57 -25.060   9.624  -9.659
  413   1HB   GLU  57          HB2       GLU  57 -25.392   9.674  -6.628
  414   2HB   GLU  57          HB3       GLU  57 -25.301   8.212  -7.616
  415   1HG   GLU  57          HG2       GLU  57 -23.043   8.941  -8.414
  416   2HG   GLU  57          HG3       GLU  57 -23.105  10.267  -7.241
  417    H    ASP  58           H        ASP  58 -27.341  11.810  -8.572
  418    HA   ASP  58           HA       ASP  58 -29.546  10.219  -9.690
  419   1HB   ASP  58          HB2       ASP  58 -29.401   9.433  -7.286
  420   2HB   ASP  58          HB3       ASP  58 -29.683  11.077  -6.760
  421    H    ASN  59           H        ASN  59 -28.394  13.250  -8.280
  422    HA   ASN  59           HA       ASN  59 -30.654  14.718  -9.611
  423   1HB   ASN  59          HB2       ASN  59 -30.088  15.326  -7.239
  424   2HB   ASN  59          HB3       ASN  59 -28.463  15.795  -7.792
  425   1HD2  ASN  59          1HD2      ASN  59 -30.158  18.969  -7.864
  426   2HD2  ASN  59          2HD2      ASN  59 -29.409  17.912  -6.678
  427    H    GLU  60           H        GLU  60 -30.328  14.757 -11.687
  428    HA   GLU  60           HA       GLU  60 -27.701  15.663 -12.856
  429   1HB   GLU  60          HB2       GLU  60 -29.572  13.470 -13.788
  430   2HB   GLU  60          HB3       GLU  60 -28.128  14.031 -14.665
  431   1HG   GLU  60          HG2       GLU  60 -26.698  13.357 -12.763
  432   2HG   GLU  60          HG3       GLU  60 -28.118  12.688 -11.928
  433    H    GLU  61           H        GLU  61 -30.618  16.812 -12.437
  434    HA   GLU  61           HA       GLU  61 -32.322  17.224 -14.345
  435   1HB   GLU  61          HB2       GLU  61 -30.942  19.459 -12.848
  436   2HB   GLU  61          HB3       GLU  61 -32.357  19.744 -13.811
  437   1HG   GLU  61          HG2       GLU  61 -32.347  17.733 -11.514
  438   2HG   GLU  61          HG3       GLU  61 -32.843  19.411 -11.349
  439    H    LYS  62           H        LYS  62 -29.350  19.140 -14.693
  440    HA   LYS  62           HA       LYS  62 -29.300  18.662 -17.548
  441   1HB   LYS  62          HB2       LYS  62 -29.292  21.017 -18.318
  442   2HB   LYS  62          HB3       LYS  62 -30.826  20.500 -17.642
  443   1HG   LYS  62          HG2       LYS  62 -30.130  21.707 -15.446
  444   2HG   LYS  62          HG3       LYS  62 -28.780  22.377 -16.359
  445   1HD   LYS  62          HD2       LYS  62 -30.663  23.125 -18.077
  446   2HD   LYS  62          HD3       LYS  62 -31.781  22.784 -16.767
  447   1HE   LYS  62          HE2       LYS  62 -29.395  24.682 -16.642
  448   2HE   LYS  62          HE3       LYS  62 -31.050  25.184 -16.995
  449   1HZ   LYS  62          HZ1       LYS  62 -30.330  25.468 -14.685
  450   2HZ   LYS  62          HZ2       LYS  62 -31.710  24.526 -14.780
  451   3HZ   LYS  62          HZ3       LYS  62 -30.209  23.885 -14.468
  452    H    TYR  63           H        TYR  63 -27.647  17.722 -15.712
  453    HA   TYR  63           HA       TYR  63 -25.085  18.785 -16.458
  454   1HB   TYR  63          HB2       TYR  63 -24.440  19.326 -13.998
  455   2HB   TYR  63          HB3       TYR  63 -25.294  20.488 -14.913
  456    HD1  TYR  63           HD1      TYR  63 -25.834  17.815 -12.309
  457    HD2  TYR  63           HD2      TYR  63 -27.294  21.444 -14.118
  458    HE1  TYR  63           HE1      TYR  63 -27.521  18.056 -10.493
  459    HE2  TYR  63           HE2      TYR  63 -28.952  21.691 -12.280
  460    HH   TYR  63           HH       TYR  63 -29.739  20.884 -10.353
  461    H    SER  64           H        SER  64 -23.214  17.766 -15.669
  462    HA   SER  64           HA       SER  64 -23.188  15.592 -13.808
  463   1HB   SER  64          HB2       SER  64 -24.337  14.515 -15.829
  464   2HB   SER  64          HB3       SER  64 -22.794  14.699 -16.701
  465    HG   SER  64           HG       SER  64 -23.059  12.663 -15.609
  466    H    PHE  65           H        PHE  65 -20.992  14.535 -13.744
  467    HA   PHE  65           HA       PHE  65 -18.770  16.203 -14.750
  468   1HB   PHE  65          HB2       PHE  65 -18.094  16.558 -12.595
  469   2HB   PHE  65          HB3       PHE  65 -19.821  16.862 -12.600
  470    HD1  PHE  65           HD1      PHE  65 -18.429  16.782 -10.149
  471    HD2  PHE  65           HD2      PHE  65 -20.045  13.409 -12.336
  472    HE1  PHE  65           HE1      PHE  65 -18.610  15.481  -8.035
  473    HE2  PHE  65           HE2      PHE  65 -20.187  12.165 -10.239
  474    HZ   PHE  65           HZ       PHE  65 -19.535  13.175  -8.088
  475    H    ASN  66           H        ASN  66 -16.639  15.265 -13.664
  476    HA   ASN  66           HA       ASN  66 -16.397  12.388 -14.417
  477   1HB   ASN  66          HB2       ASN  66 -14.105  12.814 -14.837
  478   2HB   ASN  66          HB3       ASN  66 -15.037  14.073 -15.656
  479   1HD2  ASN  66          1HD2      ASN  66 -13.366  16.667 -13.866
  480   2HD2  ASN  66          2HD2      ASN  66 -14.440  16.222 -15.192
  481    H    TYR  67           H        TYR  67 -14.443  11.293 -13.195
  482    HA   TYR  67           HA       TYR  67 -15.264  11.337 -10.333
  483   1HB   TYR  67          HB2       TYR  67 -13.948   9.131 -11.888
  484   2HB   TYR  67          HB3       TYR  67 -14.573   9.042 -10.264
  485    HD1  TYR  67           HD1      TYR  67 -17.099   9.505  -9.891
  486    HD2  TYR  67           HD2      TYR  67 -15.374   8.591 -13.739
  487    HE1  TYR  67           HE1      TYR  67 -19.336   8.860 -10.736
  488    HE2  TYR  67           HE2      TYR  67 -17.618   7.928 -14.595
  489    HH   TYR  67           HH       TYR  67 -19.844   7.644 -14.090
  490    H    ASP  68           H        ASP  68 -12.368  11.688 -12.271
  491    HA   ASP  68           HA       ASP  68 -10.518  11.580  -9.927
  492   1HB   ASP  68          HB2       ASP  68  -8.750  11.490 -11.556
  493   2HB   ASP  68          HB3       ASP  68  -9.964  10.310 -12.019
  494    H    GLY  69           H        GLY  69 -12.507  13.633 -10.311
  495   1HA   GLY  69          HA2       GLY  69 -11.273  16.093  -9.578
  496   2HA   GLY  69          HA3       GLY  69 -11.658  16.097 -11.313
  497    H    SER  70           H        SER  70 -13.312  17.744 -10.804
  498    HA   SER  70           HA       SER  70 -15.900  16.634  -9.855
  499   1HB   SER  70          HB2       SER  70 -14.785  19.088  -8.524
  500   2HB   SER  70          HB3       SER  70 -16.203  18.112  -8.102
  501    HG   SER  70           HG       SER  70 -14.517  16.343  -7.892
  502    H    GLU  71           H        GLU  71 -14.572  18.085 -12.332
  503    HA   GLU  71           HA       GLU  71 -15.913  20.515 -12.788
  504   1HB   GLU  71          HB2       GLU  71 -14.828  18.447 -14.745
  505   2HB   GLU  71          HB3       GLU  71 -15.410  20.021 -15.201
  506   1HG   GLU  71          HG2       GLU  71 -13.010  20.080 -15.093
  507   2HG   GLU  71          HG3       GLU  71 -13.699  21.146 -13.866
  508    H    LEU  72           H        LEU  72 -17.947  20.595 -12.266
  509    HA   LEU  72           HA       LEU  72 -19.994  18.839 -13.406
  510   1HB   LEU  72          HB2       LEU  72 -20.134  19.844 -11.118
  511   2HB   LEU  72          HB3       LEU  72 -20.214  21.449 -11.855
  512    HG   LEU  72           HG       LEU  72 -22.360  20.751 -12.981
  513   1HD1  LEU  72          1HD1      LEU  72 -23.515  18.722 -11.915
  514   2HD1  LEU  72          2HD1      LEU  72 -22.148  18.313 -12.970
  515   3HD1  LEU  72          3HD1      LEU  72 -21.961  18.288 -11.190
  516   1HD2  LEU  72          1HD2      LEU  72 -22.341  20.507  -9.936
  517   2HD2  LEU  72          2HD2      LEU  72 -22.371  22.009 -10.896
  518   3HD2  LEU  72          3HD2      LEU  72 -23.740  20.894 -10.966
  519    H    ILE  73           H        ILE  73 -20.501  19.015 -15.463
  520    HA   ILE  73           HA       ILE  73 -20.331  21.633 -16.869
  521    HB   ILE  73           HB       ILE  73 -20.866  18.849 -17.969
  522   1HG1  ILE  73          2HG1      ILE  73 -18.217  20.243 -18.434
  523   2HG1  ILE  73          3HG1      ILE  73 -18.445  19.447 -16.890
  524   1HG2  ILE  73          1HG2      ILE  73 -21.738  20.615 -19.353
  525   2HG2  ILE  73          2HG2      ILE  73 -20.259  21.544 -19.268
  526   3HG2  ILE  73          3HG2      ILE  73 -20.273  19.986 -20.149
  527   1HD1  ILE  73          1HD1      ILE  73 -18.732  18.053 -19.567
  528   2HD1  ILE  73          2HD1      ILE  73 -17.368  17.954 -18.444
  529   3HD1  ILE  73          3HD1      ILE  73 -18.943  17.317 -17.960
  530    H    ILE  74           H        ILE  74 -22.065  22.780 -17.043
  531    HA   ILE  74           HA       ILE  74 -24.798  21.629 -16.592
  532    HB   ILE  74           HB       ILE  74 -23.768  24.464 -16.197
  533   1HG1  ILE  74          2HG1      ILE  74 -24.859  22.560 -14.086
  534   2HG1  ILE  74          3HG1      ILE  74 -23.137  22.640 -14.450
  535   1HG2  ILE  74          1HG2      ILE  74 -26.118  24.483 -16.968
  536   2HG2  ILE  74          2HG2      ILE  74 -26.535  23.272 -15.753
  537   3HG2  ILE  74          3HG2      ILE  74 -26.064  24.902 -15.258
  538   1HD1  ILE  74          1HD1      ILE  74 -23.627  23.983 -12.500
  539   2HD1  ILE  74          2HD1      ILE  74 -23.114  25.058 -13.820
  540   3HD1  ILE  74          3HD1      ILE  74 -24.826  24.923 -13.378
  541    H    LYS  75           H        LYS  75 -26.212  21.755 -18.265
  542    HA   LYS  75           HA       LYS  75 -25.534  23.536 -20.570
  543   1HB   LYS  75          HB2       LYS  75 -26.676  21.987 -22.052
  544   2HB   LYS  75          HB3       LYS  75 -25.381  21.171 -21.179
  545   1HG   LYS  75          HG2       LYS  75 -27.191  20.316 -19.545
  546   2HG   LYS  75          HG3       LYS  75 -28.385  20.941 -20.661
  547   1HD   LYS  75          HD2       LYS  75 -26.228  18.885 -21.227
  548   2HD   LYS  75          HD3       LYS  75 -27.951  18.532 -20.984
  549   1HE   LYS  75          HE2       LYS  75 -26.841  20.202 -23.281
  550   2HE   LYS  75          HE3       LYS  75 -27.108  18.470 -23.391
  551   1HZ   LYS  75          HZ1       LYS  75 -29.216  20.501 -22.840
  552   2HZ   LYS  75          HZ2       LYS  75 -29.033  19.692 -24.237
  553   3HZ   LYS  75          HZ3       LYS  75 -29.484  18.882 -22.906
  554    H    LYS  76           H        LYS  76 -27.114  24.608 -21.522
  555    HA   LYS  76           HA       LYS  76 -28.959  25.949 -21.729
  556   1HB   LYS  76          HB2       LYS  76 -29.992  23.681 -22.115
  557   2HB   LYS  76          HB3       LYS  76 -30.501  23.644 -20.416
  558   1HG   LYS  76          HG2       LYS  76 -32.018  25.471 -20.741
  559   2HG   LYS  76          HG3       LYS  76 -31.321  25.870 -22.321
  560   1HD   LYS  76          HD2       LYS  76 -32.157  23.707 -23.199
  561   2HD   LYS  76          HD3       LYS  76 -32.925  23.351 -21.627
  562   1HE   LYS  76          HE2       LYS  76 -33.496  25.756 -23.449
  563   2HE   LYS  76          HE3       LYS  76 -34.446  24.263 -23.419
  564   1HZ   LYS  76          HZ1       LYS  76 -35.508  25.884 -22.023
  565   2HZ   LYS  76          HZ2       LYS  76 -34.931  24.706 -21.041
  566   3HZ   LYS  76          HZ3       LYS  76 -34.158  26.143 -21.129
  567    H    VAL  77           H        VAL  77 -27.463  26.894 -19.898
  568    HA   VAL  77           HA       VAL  77 -28.195  27.095 -17.235
  569    HB   VAL  77           HB       VAL  77 -26.802  29.169 -18.960
  570   1HG1  VAL  77          1HG1      VAL  77 -26.866  28.826 -15.937
  571   2HG1  VAL  77          2HG1      VAL  77 -25.710  29.875 -16.829
  572   3HG1  VAL  77          3HG1      VAL  77 -27.426  30.242 -16.853
  573   1HG2  VAL  77          1HG2      VAL  77 -25.713  26.899 -17.242
  574   2HG2  VAL  77          2HG2      VAL  77 -25.647  27.013 -19.019
  575   3HG2  VAL  77          3HG2      VAL  77 -24.742  28.143 -18.048
  576    H    ASP  78           H        ASP  78 -29.499  28.230 -15.966
  577    HA   ASP  78           HA       ASP  78 -31.041  30.541 -16.970
  578   1HB   ASP  78          HB2       ASP  78 -32.243  28.115 -17.118
  579   2HB   ASP  78          HB3       ASP  78 -32.557  28.465 -15.414
  580    H    LYS  79           H        LYS  79 -32.477  31.313 -15.044
  581    HA   LYS  79           HA       LYS  79 -30.858  32.368 -12.952
  582   1HB   LYS  79          HB2       LYS  79 -33.884  32.068 -13.143
  583   2HB   LYS  79          HB3       LYS  79 -33.063  32.976 -11.876
  584   1HG   LYS  79          HG2       LYS  79 -31.997  34.409 -13.636
  585   2HG   LYS  79          HG3       LYS  79 -32.938  33.568 -14.880
  586   1HD   LYS  79          HD2       LYS  79 -35.055  34.232 -13.742
  587   2HD   LYS  79          HD3       LYS  79 -34.120  35.109 -12.509
  588   1HE   LYS  79          HE2       LYS  79 -33.180  36.581 -14.311
  589   2HE   LYS  79          HE3       LYS  79 -34.185  35.716 -15.500
  590   1HZ   LYS  79          HZ1       LYS  79 -35.202  37.306 -13.205
  591   2HZ   LYS  79          HZ2       LYS  79 -35.256  37.758 -14.756
  592   3HZ   LYS  79          HZ3       LYS  79 -36.149  36.476 -14.246
  593    H    SER  80           H        SER  80 -32.498  29.251 -12.996
  594    HA   SER  80           HA       SER  80 -32.411  28.772 -10.164
  595   1HB   SER  80          HB2       SER  80 -33.022  26.485 -10.881
  596   2HB   SER  80          HB3       SER  80 -34.038  27.737 -11.585
  597    HG   SER  80           HG       SER  80 -33.420  26.249 -13.191
  598    H    ASP  81           H        ASP  81 -29.938  28.670 -12.587
  599    HA   ASP  81           HA       ASP  81 -28.276  26.744 -11.107
  600   1HB   ASP  81          HB2       ASP  81 -27.640  28.489 -13.483
  601   2HB   ASP  81          HB3       ASP  81 -26.602  27.195 -12.831
  602    H    GLU  82           H        GLU  82 -28.907  30.088 -10.720
  603    HA   GLU  82           HA       GLU  82 -26.405  31.081  -9.752
  604   1HB   GLU  82          HB2       GLU  82 -28.561  32.404 -10.165
  605   2HB   GLU  82          HB3       GLU  82 -29.188  31.692  -8.653
  606   1HG   GLU  82          HG2       GLU  82 -27.212  32.695  -7.455
  607   2HG   GLU  82          HG3       GLU  82 -26.723  33.457  -8.975
  608    H    ALA  83           H        ALA  83 -25.266  30.749  -7.841
  609    HA   ALA  83           HA       ALA  83 -26.442  29.161  -5.657
  610   1HB   ALA  83          HB1       ALA  83 -24.311  27.985  -7.500
  611   2HB   ALA  83          HB2       ALA  83 -24.928  27.203  -6.049
  612   3HB   ALA  83          HB3       ALA  83 -25.983  27.481  -7.456
  613    H    GLU  84           H        GLU  84 -25.297  28.939  -3.853
  614    HA   GLU  84           HA       GLU  84 -22.518  30.038  -3.663
  615   1HB   GLU  84          HB2       GLU  84 -24.241  31.245  -2.273
  616   2HB   GLU  84          HB3       GLU  84 -24.583  29.716  -1.431
  617   1HG   GLU  84          HG2       GLU  84 -22.260  29.634  -0.626
  618   2HG   GLU  84          HG3       GLU  84 -21.872  31.077  -1.541
  619    H    TYR  85           H        TYR  85 -21.574  28.161  -4.441
  620    HA   TYR  85           HA       TYR  85 -22.533  25.538  -3.752
  621   1HB   TYR  85          HB2       TYR  85 -20.027  26.439  -5.155
  622   2HB   TYR  85          HB3       TYR  85 -20.493  24.765  -4.993
  623    HD1  TYR  85           HD1      TYR  85 -23.069  24.321  -5.794
  624    HD2  TYR  85           HD2      TYR  85 -20.451  27.395  -7.272
  625    HE1  TYR  85           HE1      TYR  85 -24.251  24.275  -8.023
  626    HE2  TYR  85           HE2      TYR  85 -21.592  27.310  -9.477
  627    HH   TYR  85           HH       TYR  85 -23.277  26.291 -10.733
  628    H    ILE  86           H        ILE  86 -21.805  24.152  -2.196
  629    HA   ILE  86           HA       ILE  86 -19.167  24.647  -0.878
  630    HB   ILE  86           HB       ILE  86 -21.691  23.964   0.679
  631   1HG1  ILE  86          2HG1      ILE  86 -20.135  26.598   0.623
  632   2HG1  ILE  86          3HG1      ILE  86 -21.745  26.325  -0.071
  633   1HG2  ILE  86          1HG2      ILE  86 -18.844  24.601   1.590
  634   2HG2  ILE  86          2HG2      ILE  86 -20.238  24.159   2.650
  635   3HG2  ILE  86          3HG2      ILE  86 -19.578  22.987   1.554
  636   1HD1  ILE  86          1HD1      ILE  86 -22.637  25.825   2.215
  637   2HD1  ILE  86          2HD1      ILE  86 -21.073  26.285   2.891
  638   3HD1  ILE  86          3HD1      ILE  86 -22.041  27.461   2.016
  639    H    CYS  87           H        CYS  87 -17.968  22.912  -0.952
  640    HA   CYS  87           HA       CYS  87 -19.236  20.252  -1.287
  641   1HB   CYS  87          HB2       CYS  87 -17.457  19.526  -2.639
  642   2HB   CYS  87          HB3       CYS  87 -18.055  21.012  -3.344
  643    H    ILE  88           H        ILE  88 -18.397  18.480  -0.442
  644    HA   ILE  88           HA       ILE  88 -16.382  18.679   1.751
  645    HB   ILE  88           HB       ILE  88 -18.963  17.046   1.849
  646   1HG1  ILE  88          2HG1      ILE  88 -19.304  18.692   3.951
  647   2HG1  ILE  88          3HG1      ILE  88 -18.332  19.800   3.004
  648   1HG2  ILE  88          1HG2      ILE  88 -16.774  17.633   3.909
  649   2HG2  ILE  88          2HG2      ILE  88 -18.248  16.688   4.225
  650   3HG2  ILE  88          3HG2      ILE  88 -17.049  16.080   3.080
  651   1HD1  ILE  88          1HD1      ILE  88 -20.932  18.482   2.064
  652   2HD1  ILE  88          2HD1      ILE  88 -20.793  20.097   2.748
  653   3HD1  ILE  88          3HD1      ILE  88 -20.032  19.735   1.184
  654    H    ALA  89           H        ALA  89 -14.779  17.271   1.440
  655    HA   ALA  89           HA       ALA  89 -15.314  14.724  -0.039
  656   1HB   ALA  89          HB1       ALA  89 -13.941  16.179  -1.359
  657   2HB   ALA  89          HB2       ALA  89 -12.783  16.381  -0.024
  658   3HB   ALA  89          HB3       ALA  89 -12.968  14.793  -0.772
  659    H    GLU  90           H        GLU  90 -14.515  12.855   0.826
  660    HA   GLU  90           HA       GLU  90 -13.081  12.899   3.431
  661   1HB   GLU  90          HB2       GLU  90 -15.550  13.012   3.860
  662   2HB   GLU  90          HB3       GLU  90 -15.746  11.536   2.904
  663   1HG   GLU  90          HG2       GLU  90 -14.343  10.282   4.509
  664   2HG   GLU  90          HG3       GLU  90 -14.104  11.748   5.446
  665    H    ASN  91           H        ASN  91 -11.890  11.003   3.827
  666    HA   ASN  91           HA       ASN  91 -12.482   8.577   2.367
  667   1HB   ASN  91          HB2       ASN  91 -10.578   8.233   1.098
  668   2HB   ASN  91          HB3       ASN  91 -10.958   9.885   0.806
  669   1HD2  ASN  91          1HD2      ASN  91  -7.316   9.814   1.202
  670   2HD2  ASN  91          2HD2      ASN  91  -8.480   9.062   0.109
  671    H    LYS  92           H        LYS  92 -10.473   6.952   3.022
  672    HA   LYS  92           HA       LYS  92 -10.754   6.503   5.846
  673   1HB   LYS  92          HB2       LYS  92  -8.888   4.827   5.442
  674   2HB   LYS  92          HB3       LYS  92 -10.427   4.556   4.643
  675   1HG   LYS  92          HG2       LYS  92  -8.177   5.959   3.183
  676   2HG   LYS  92          HG3       LYS  92  -8.097   4.225   3.431
  677   1HD   LYS  92          HD2       LYS  92 -10.369   5.591   1.958
  678   2HD   LYS  92          HD3       LYS  92  -8.940   4.917   1.230
  679   1HE   LYS  92          HE2       LYS  92 -10.363   3.168   0.901
  680   2HE   LYS  92          HE3       LYS  92  -9.629   2.695   2.434
  681   1HZ   LYS  92          HZ1       LYS  92 -12.052   2.476   2.410
  682   2HZ   LYS  92          HZ2       LYS  92 -11.614   3.513   3.585
  683   3HZ   LYS  92          HZ3       LYS  92 -12.260   4.072   2.182
  684    H    ALA  93           H        ALA  93  -8.474   8.451   4.244
  685    HA   ALA  93           HA       ALA  93  -6.631   8.551   6.576
  686   1HB   ALA  93          HB1       ALA  93  -5.722   8.240   4.315
  687   2HB   ALA  93          HB2       ALA  93  -6.429   9.784   3.834
  688   3HB   ALA  93          HB3       ALA  93  -5.149   9.744   5.067
  689    H    GLY  94           H        GLY  94  -9.227  10.555   5.195
  690   1HA   GLY  94          HA2       GLY  94  -9.270  12.286   7.469
  691   2HA   GLY  94          HA3       GLY  94  -8.285  13.035   6.221
  692    H    GLU  95           H        GLU  95  -9.834  14.785   6.374
  693    HA   GLU  95           HA       GLU  95 -12.198  14.482   4.630
  694   1HB   GLU  95          HB2       GLU  95 -12.847  14.055   7.032
  695   2HB   GLU  95          HB3       GLU  95 -12.340  15.690   7.418
  696   1HG   GLU  95          HG2       GLU  95 -14.074  16.492   5.672
  697   2HG   GLU  95          HG3       GLU  95 -14.630  14.816   5.596
  698    H    GLN  96           H        GLN  96 -12.800  16.523   3.679
  699    HA   GLN  96           HA       GLN  96 -11.282  18.984   4.279
  700   1HB   GLN  96          HB2       GLN  96  -9.977  17.250   2.703
  701   2HB   GLN  96          HB3       GLN  96 -11.042  17.948   1.482
  702   1HG   GLN  96          HG2       GLN  96  -8.991  19.140   1.393
  703   2HG   GLN  96          HG3       GLN  96 -10.135  20.231   2.187
  704   1HE2  GLN  96          1HE2      GLN  96  -7.108  18.513   4.421
  705   2HE2  GLN  96          2HE2      GLN  96  -7.616  17.740   2.940
  706    H    ASP  97           H        ASP  97 -11.945  20.860   2.858
  707    HA   ASP  97           HA       ASP  97 -14.467  20.596   1.402
  708   1HB   ASP  97          HB2       ASP  97 -15.711  22.128   2.795
  709   2HB   ASP  97          HB3       ASP  97 -15.143  20.831   3.803
  710    H    ALA  98           H        ALA  98 -15.113  22.414   0.210
  711    HA   ALA  98           HA       ALA  98 -13.621  24.908   0.225
  712   1HB   ALA  98          HB1       ALA  98 -13.539  23.171  -2.288
  713   2HB   ALA  98          HB2       ALA  98 -12.915  24.835  -2.162
  714   3HB   ALA  98          HB3       ALA  98 -12.195  23.530  -1.204
  715    H    THR  99           H        THR  99 -14.516  26.430  -1.620
  716    HA   THR  99           HA       THR  99 -17.467  26.254  -1.832
  717    HB   THR  99           HB       THR  99 -15.895  28.448  -0.427
  718    HG1  THR  99           HG1      THR  99 -16.278  26.686   0.892
  719   1HG2  THR  99          1HG2      THR  99 -17.793  29.520  -1.573
  720   2HG2  THR  99          2HG2      THR  99 -18.896  28.353  -0.808
  721   3HG2  THR  99          3HG2      THR  99 -17.978  29.525   0.176
  722    H    ILE 100           H        ILE 100 -18.366  27.499  -3.525
  723    HA   ILE 100           HA       ILE 100 -16.702  29.409  -5.122
  724    HB   ILE 100           HB       ILE 100 -18.352  27.171  -6.349
  725   1HG1  ILE 100          2HG1      ILE 100 -15.803  26.811  -7.336
  726   2HG1  ILE 100          3HG1      ILE 100 -15.470  27.262  -5.679
  727   1HG2  ILE 100          1HG2      ILE 100 -17.269  27.949  -8.477
  728   2HG2  ILE 100          2HG2      ILE 100 -18.503  28.995  -7.816
  729   3HG2  ILE 100          3HG2      ILE 100 -16.804  29.421  -7.613
  730   1HD1  ILE 100          1HD1      ILE 100 -17.295  25.003  -6.640
  731   2HD1  ILE 100          2HD1      ILE 100 -15.705  24.833  -5.872
  732   3HD1  ILE 100          3HD1      ILE 100 -17.068  25.459  -4.942
  733    H    HIS 101           H        HIS 101 -17.961  31.077  -6.094
  734    HA   HIS 101           HA       HIS 101 -20.915  31.068  -5.509
  735   1HB   HIS 101          HB2       HIS 101 -19.253  33.433  -6.347
  736   2HB   HIS 101          HB3       HIS 101 -20.880  33.426  -5.690
  737    HD1  HIS 101           HD1      HIS 101 -17.216  33.119  -4.628
  738    HD2  HIS 101           HD2      HIS 101 -21.110  33.121  -2.987
  739    HE1  HIS 101           HE1      HIS 101 -16.956  33.389  -2.081
  740    H    LEU 102           H        LEU 102 -22.392  31.349  -7.205
  741    HA   LEU 102           HA       LEU 102 -21.356  31.956  -9.920
  742   1HB   LEU 102          HB2       LEU 102 -21.623  29.628 -10.032
  743   2HB   LEU 102          HB3       LEU 102 -23.131  29.643  -9.136
  744    HG   LEU 102           HG       LEU 102 -24.330  30.625 -10.999
  745   1HD1  LEU 102          1HD1      LEU 102 -22.591  32.061 -12.017
  746   2HD1  LEU 102          2HD1      LEU 102 -21.685  30.628 -12.515
  747   3HD1  LEU 102          3HD1      LEU 102 -23.295  30.951 -13.218
  748   1HD2  LEU 102          1HD2      LEU 102 -22.543  28.372 -11.970
  749   2HD2  LEU 102          2HD2      LEU 102 -23.956  28.189 -10.917
  750   3HD2  LEU 102          3HD2      LEU 102 -24.162  28.766 -12.583
  751    H    LYS 103           H        LYS 103 -22.210  33.826 -10.422
  752    HA   LYS 103           HA       LYS 103 -24.991  34.601  -9.601
  753   1HB   LYS 103          HB2       LYS 103 -22.656  36.293 -10.590
  754   2HB   LYS 103          HB3       LYS 103 -24.258  36.900 -10.165
  755   1HG   LYS 103          HG2       LYS 103 -22.327  35.612  -8.189
  756   2HG   LYS 103          HG3       LYS 103 -22.562  37.337  -8.461
  757   1HD   LYS 103          HD2       LYS 103 -23.905  37.054  -6.634
  758   2HD   LYS 103          HD3       LYS 103 -25.109  36.769  -7.902
  759   1HE   LYS 103          HE2       LYS 103 -24.716  34.288  -7.625
  760   2HE   LYS 103          HE3       LYS 103 -23.538  34.660  -6.336
  761   1HZ   LYS 103          HZ1       LYS 103 -25.410  35.734  -5.116
  762   2HZ   LYS 103          HZ2       LYS 103 -26.437  35.228  -6.304
  763   3HZ   LYS 103          HZ3       LYS 103 -25.677  34.150  -5.360
  764    H    VAL 104           H        VAL 104 -26.419  33.832 -11.121
  765    HA   VAL 104           HA       VAL 104 -25.782  34.178 -14.022
  766    HB   VAL 104           HB       VAL 104 -28.100  32.782 -12.635
  767   1HG1  VAL 104          1HG1      VAL 104 -28.528  31.856 -14.942
  768   2HG1  VAL 104          2HG1      VAL 104 -28.881  33.565 -14.769
  769   3HG1  VAL 104          3HG1      VAL 104 -27.389  33.039 -15.591
  770   1HG2  VAL 104          1HG2      VAL 104 -25.975  31.571 -12.374
  771   2HG2  VAL 104          2HG2      VAL 104 -27.015  30.728 -13.537
  772   3HG2  VAL 104          3HG2      VAL 104 -25.648  31.691 -14.120
  773    H    PHE 105           H        PHE 105 -26.814  35.692 -15.297
  774    HA   PHE 105           HA       PHE 105 -29.092  37.244 -14.155
  775   1HB   PHE 105          HB2       PHE 105 -27.968  39.143 -15.482
  776   2HB   PHE 105          HB3       PHE 105 -27.392  38.738 -13.871
  777    HD1  PHE 105           HD1      PHE 105 -25.135  38.289 -13.516
  778    HD2  PHE 105           HD2      PHE 105 -26.653  38.237 -17.550
  779    HE1  PHE 105           HE1      PHE 105 -22.820  38.132 -14.394
  780    HE2  PHE 105           HE2      PHE 105 -24.352  38.102 -18.423
  781    HZ   PHE 105           HZ       PHE 105 -22.414  38.015 -16.863
  782    H    ALA 106           H        ALA 106 -30.523  38.208 -15.669
  783    HA   ALA 106           HA       ALA 106 -30.672  36.818 -18.307
  784   1HB   ALA 106          HB1       ALA 106 -32.875  37.993 -16.590
  785   2HB   ALA 106          HB2       ALA 106 -33.074  37.139 -18.140
  786   3HB   ALA 106          HB3       ALA 106 -32.436  36.262 -16.749
  787    H    LYS 107           H        LYS 107 -28.907  38.740 -18.453
  788    HA   LYS 107           HA       LYS 107 -28.192  40.741 -19.268
  789   1HB   LYS 107          HB2       LYS 107 -30.740  40.585 -20.924
  790   2HB   LYS 107          HB3       LYS 107 -29.385  41.649 -21.248
  791   1HG   LYS 107          HG2       LYS 107 -27.913  39.683 -21.591
  792   2HG   LYS 107          HG3       LYS 107 -29.299  38.597 -21.317
  793   1HD   LYS 107          HD2       LYS 107 -30.510  39.630 -23.232
  794   2HD   LYS 107          HD3       LYS 107 -29.106  40.676 -23.528
  795   1HE   LYS 107          HE2       LYS 107 -27.666  38.696 -23.883
  796   2HE   LYS 107          HE3       LYS 107 -29.052  37.632 -23.576
  797   1HZ   LYS 107          HZ1       LYS 107 -30.151  38.562 -25.535
  798   2HZ   LYS 107          HZ2       LYS 107 -28.926  39.589 -25.826
  799   3HZ   LYS 107          HZ3       LYS 107 -28.685  37.976 -25.967
  Start of MODEL    3
    1   1H    GLY   1          H1        GLY   1  -2.426  -3.420   7.052
    2   2H    GLY   1          H2        GLY   1  -3.289  -2.827   5.785
    3   3H    GLY   1          H3        GLY   1  -1.770  -3.412   5.533
    4   1HA   GLY   1          HA2       GLY   1  -0.790  -1.676   6.887
    5   2HA   GLY   1          HA3       GLY   1  -1.706  -1.012   5.502
    6    H    LYS   2           H        LYS   2  -1.744   0.962   6.808
    7    HA   LYS   2           HA       LYS   2  -4.184   1.220   8.407
    8   1HB   LYS   2          HB2       LYS   2  -2.195   0.433   9.949
    9   2HB   LYS   2          HB3       LYS   2  -1.568   2.063   9.695
   10   1HG   LYS   2          HG2       LYS   2  -3.778   2.936  10.624
   11   2HG   LYS   2          HG3       LYS   2  -4.223   1.256  10.955
   12   1HD   LYS   2          HD2       LYS   2  -2.177   1.033  12.373
   13   2HD   LYS   2          HD3       LYS   2  -1.825   2.745  12.078
   14   1HE   LYS   2          HE2       LYS   2  -3.928   3.372  13.165
   15   2HE   LYS   2          HE3       LYS   2  -4.328   1.684  13.435
   16   1HZ   LYS   2          HZ1       LYS   2  -3.260   2.772  15.386
   17   2HZ   LYS   2          HZ2       LYS   2  -2.407   1.487  14.876
   18   3HZ   LYS   2          HZ3       LYS   2  -1.879   2.982  14.509
   19    H    ASP   3           H        ASP   3  -4.803   3.416   8.639
   20    HA   ASP   3           HA       ASP   3  -3.779   5.247   6.588
   21   1HB   ASP   3          HB2       ASP   3  -6.026   5.479   8.643
   22   2HB   ASP   3          HB3       ASP   3  -5.727   6.602   7.336
   23    H    ILE   4           H        ILE   4  -3.007   4.745   9.830
   24    HA   ILE   4           HA       ILE   4  -2.530   7.605  10.489
   25    HB   ILE   4           HB       ILE   4  -2.381   5.146  12.258
   26   1HG1  ILE   4          2HG1      ILE   4  -4.630   5.228  11.455
   27   2HG1  ILE   4          3HG1      ILE   4  -4.590   5.753  13.117
   28   1HG2  ILE   4          1HG2      ILE   4  -2.530   8.095  12.970
   29   2HG2  ILE   4          2HG2      ILE   4  -2.785   6.751  14.123
   30   3HG2  ILE   4          3HG2      ILE   4  -1.227   6.953  13.344
   31   1HD1  ILE   4          1HD1      ILE   4  -4.900   7.588  10.702
   32   2HD1  ILE   4          2HD1      ILE   4  -6.157   7.097  11.837
   33   3HD1  ILE   4          3HD1      ILE   4  -4.833   8.121  12.400
   34    H    GLN   5           H        GLN   5  -0.594   4.748   9.744
   35    HA   GLN   5           HA       GLN   5   1.892   6.264  10.123
   36   1HB   GLN   5          HB2       GLN   5   2.828   4.892  11.880
   37   2HB   GLN   5          HB3       GLN   5   1.284   5.511  12.421
   38   1HG   GLN   5          HG2       GLN   5   0.355   3.169  11.492
   39   2HG   GLN   5          HG3       GLN   5   2.030   2.698  11.652
   40   1HE2  GLN   5          1HE2      GLN   5   1.901   2.692  15.248
   41   2HE2  GLN   5          2HE2      GLN   5   2.976   2.678  13.858
   42    H    VAL   6           H        VAL   6   0.727   5.040   7.861
   43    HA   VAL   6           HA       VAL   6   3.042   3.412   6.941
   44    HB   VAL   6           HB       VAL   6   0.188   2.680   6.186
   45   1HG1  VAL   6          1HG1      VAL   6   1.242   0.719   5.162
   46   2HG1  VAL   6          2HG1      VAL   6   1.855   2.213   4.420
   47   3HG1  VAL   6          3HG1      VAL   6   2.845   1.329   5.603
   48   1HG2  VAL   6          1HG2      VAL   6   0.653   0.525   7.429
   49   2HG2  VAL   6          2HG2      VAL   6   2.134   1.290   8.076
   50   3HG2  VAL   6          3HG2      VAL   6   0.545   1.922   8.515
   51    H    ILE   7           H        ILE   7   3.896   4.312   5.162
   52    HA   ILE   7           HA       ILE   7   2.553   6.659   4.083
   53    HB   ILE   7           HB       ILE   7   5.319   5.694   3.340
   54   1HG1  ILE   7          2HG1      ILE   7   5.310   5.955   5.781
   55   2HG1  ILE   7          3HG1      ILE   7   6.180   7.257   5.009
   56   1HG2  ILE   7          1HG2      ILE   7   3.796   8.344   3.165
   57   2HG2  ILE   7          2HG2      ILE   7   5.555   8.209   2.897
   58   3HG2  ILE   7          3HG2      ILE   7   4.424   7.371   1.818
   59   1HD1  ILE   7          1HD1      ILE   7   3.330   7.444   6.159
   60   2HD1  ILE   7          2HD1      ILE   7   4.832   8.050   6.903
   61   3HD1  ILE   7          3HD1      ILE   7   4.231   8.770   5.404
   62    H    VAL   8           H        VAL   8   0.889   5.692   3.161
   63    HA   VAL   8           HA       VAL   8   1.083   5.150   0.276
   64    HB   VAL   8           HB       VAL   8  -0.292   3.146   2.104
   65   1HG1  VAL   8          1HG1      VAL   8  -0.800   1.937  -0.020
   66   2HG1  VAL   8          2HG1      VAL   8  -1.574   3.505   0.021
   67   3HG1  VAL   8          3HG1      VAL   8  -0.104   3.269  -0.935
   68   1HG2  VAL   8          1HG2      VAL   8   1.230   1.457   1.033
   69   2HG2  VAL   8          2HG2      VAL   8   2.148   2.808   0.313
   70   3HG2  VAL   8          3HG2      VAL   8   2.077   2.601   2.084
   71    H    ASN   9           H        ASN   9  -1.015   5.219   3.113
   72    HA   ASN   9           HA       ASN   9  -3.245   6.430   1.728
   73   1HB   ASN   9          HB2       ASN   9  -2.766   5.962   4.690
   74   2HB   ASN   9          HB3       ASN   9  -4.301   6.394   3.928
   75   1HD2  ASN   9          1HD2      ASN   9  -3.241   2.536   3.917
   76   2HD2  ASN   9          2HD2      ASN   9  -2.609   3.707   5.060
   77    H    VAL  10           H        VAL  10  -4.086   8.496   1.942
   78    HA   VAL  10           HA       VAL  10  -2.486  10.683   3.130
   79    HB   VAL  10           HB       VAL  10  -3.198  10.509   0.181
   80   1HG1  VAL  10          1HG1      VAL  10  -3.389  12.797   0.848
   81   2HG1  VAL  10          2HG1      VAL  10  -1.879  12.716   1.778
   82   3HG1  VAL  10          3HG1      VAL  10  -1.861  12.597  -0.012
   83   1HG2  VAL  10          1HG2      VAL  10  -0.474  10.485   1.511
   84   2HG2  VAL  10          2HG2      VAL  10  -1.211   9.137   0.621
   85   3HG2  VAL  10          3HG2      VAL  10  -0.772  10.608  -0.236
   86    HA   PRO  11           HA       PRO  11  -6.772  11.909   3.979
   87   1HB   PRO  11          HB2       PRO  11  -5.292  14.485   4.568
   88   2HB   PRO  11          HB3       PRO  11  -6.647  13.712   5.478
   89   1HG   PRO  11          HG2       PRO  11  -4.114  13.447   6.360
   90   2HG   PRO  11          HG3       PRO  11  -5.191  12.013   6.319
   91   1HD   PRO  11          HD2       PRO  11  -3.065  12.799   4.341
   92   2HD   PRO  11          HD3       PRO  11  -3.401  11.193   5.041
   93    HA   PRO  12           HA       PRO  12  -7.530  13.820   0.139
   94   1HB   PRO  12          HB2       PRO  12 -10.167  14.539   0.249
   95   2HB   PRO  12          HB3       PRO  12  -9.659  12.852   0.446
   96   1HG   PRO  12          HG2       PRO  12 -10.267  14.857   2.639
   97   2HG   PRO  12          HG3       PRO  12 -10.867  13.173   2.460
   98   1HD   PRO  12          HD2       PRO  12  -8.691  13.839   4.014
   99   2HD   PRO  12          HD3       PRO  12  -8.872  12.260   3.160
  100    H    SER  13           H        SER  13  -8.190  15.853  -1.005
  101    HA   SER  13           HA       SER  13  -8.238  18.356   0.562
  102   1HB   SER  13          HB2       SER  13  -5.847  17.703   0.383
  103   2HB   SER  13          HB3       SER  13  -5.951  17.912  -1.378
  104    HG   SER  13           HG       SER  13  -6.600  19.893   0.570
  105    H    VAL  14           H        VAL  14 -10.349  18.348  -0.368
  106    HA   VAL  14           HA       VAL  14 -10.632  18.825  -3.235
  107    HB   VAL  14           HB       VAL  14 -12.335  17.690  -1.836
  108   1HG1  VAL  14          1HG1      VAL  14 -12.302  19.290   0.104
  109   2HG1  VAL  14          2HG1      VAL  14 -13.115  20.487  -0.907
  110   3HG1  VAL  14          3HG1      VAL  14 -13.931  18.959  -0.533
  111   1HG2  VAL  14          1HG2      VAL  14 -12.886  18.525  -4.045
  112   2HG2  VAL  14          2HG2      VAL  14 -14.277  18.687  -2.977
  113   3HG2  VAL  14          3HG2      VAL  14 -13.276  20.104  -3.378
  114    H    ARG  15           H        ARG  15 -10.782  20.690  -4.295
  115    HA   ARG  15           HA       ARG  15 -10.370  23.246  -2.750
  116   1HB   ARG  15          HB2       ARG  15  -8.614  22.078  -4.969
  117   2HB   ARG  15          HB3       ARG  15  -8.529  23.771  -4.427
  118   1HG   ARG  15          HG2       ARG  15  -8.005  23.117  -2.161
  119   2HG   ARG  15          HG3       ARG  15  -8.129  21.393  -2.564
  120   1HD   ARG  15          HD2       ARG  15  -6.294  21.804  -4.305
  121   2HD   ARG  15          HD3       ARG  15  -6.041  23.377  -3.524
  122    HE   ARG  15           HE       ARG  15  -6.079  21.031  -1.694
  123   1HH1  ARG  15          1HH1      ARG  15  -4.393  20.369  -0.678
  124   2HH1  ARG  15          2HH1      ARG  15  -2.768  20.886  -1.136
  125   1HH2  ARG  15          1HH2      ARG  15  -2.477  22.317  -2.816
  126   2HH2  ARG  15          2HH2      ARG  15  -3.863  22.926  -3.672
  127    H    ALA  16           H        ALA  16 -10.589  25.164  -3.924
  128    HA   ALA  16           HA       ALA  16 -12.887  25.063  -5.799
  129   1HB   ALA  16          HB1       ALA  16 -11.447  27.357  -4.436
  130   2HB   ALA  16          HB2       ALA  16 -12.853  27.540  -5.472
  131   3HB   ALA  16          HB3       ALA  16 -13.015  26.632  -3.963
  132    H    ARG  17           H        ARG  17 -12.411  24.685  -7.879
  133    HA   ARG  17           HA       ARG  17  -9.854  25.446  -9.099
  134   1HB   ARG  17          HB2       ARG  17 -11.324  23.419  -9.728
  135   2HB   ARG  17          HB3       ARG  17 -12.325  24.574 -10.623
  136   1HG   ARG  17          HG2       ARG  17 -10.293  25.260 -11.935
  137   2HG   ARG  17          HG3       ARG  17  -9.350  24.038 -11.086
  138   1HD   ARG  17          HD2       ARG  17 -11.827  23.454 -12.785
  139   2HD   ARG  17          HD3       ARG  17 -10.206  23.459 -13.436
  140    HE   ARG  17           HE       ARG  17 -11.422  21.294 -12.031
  141   1HH1  ARG  17          1HH1      ARG  17 -10.433  19.461 -11.887
  142   2HH1  ARG  17          2HH1      ARG  17  -8.677  19.336 -11.845
  143   1HH2  ARG  17          1HH2      ARG  17  -8.213  22.708 -12.405
  144   2HH2  ARG  17          2HH2      ARG  17  -7.465  21.144 -12.224
  145    H    GLN  18           H        GLN  18 -12.868  27.055  -8.705
  146    HA   GLN  18           HA       GLN  18 -11.730  29.533  -9.827
  147   1HB   GLN  18          HB2       GLN  18 -14.591  28.683 -10.497
  148   2HB   GLN  18          HB3       GLN  18 -13.779  30.159 -10.942
  149   1HG   GLN  18          HG2       GLN  18 -13.655  29.013 -12.904
  150   2HG   GLN  18          HG3       GLN  18 -12.085  28.636 -12.232
  151   1HE2  GLN  18          1HE2      GLN  18 -13.174  25.390 -13.457
  152   2HE2  GLN  18          2HE2      GLN  18 -12.304  26.861 -13.910
  153    H    SER  19           H        SER  19 -12.528  31.411  -8.695
  154    HA   SER  19           HA       SER  19 -13.834  30.847  -6.098
  155   1HB   SER  19          HB2       SER  19 -12.586  33.396  -7.164
  156   2HB   SER  19          HB3       SER  19 -13.103  33.082  -5.510
  157    HG   SER  19           HG       SER  19 -10.844  32.732  -5.817
  158    H    THR  20           H        THR  20 -14.727  32.150  -9.141
  159    HA   THR  20           HA       THR  20 -17.508  32.552  -8.433
  160    HB   THR  20           HB       THR  20 -15.740  34.985  -8.778
  161    HG1  THR  20           HG1      THR  20 -16.670  34.163  -6.765
  162   1HG2  THR  20          1HG2      THR  20 -17.763  36.376  -9.194
  163   2HG2  THR  20          2HG2      THR  20 -17.355  35.380 -10.573
  164   3HG2  THR  20          3HG2      THR  20 -18.702  34.882  -9.513
  165    H    MET  21           H        MET  21 -18.725  32.281 -10.146
  166    HA   MET  21           HA       MET  21 -17.615  32.419 -12.937
  167   1HB   MET  21          HB2       MET  21 -19.496  30.407 -11.614
  168   2HB   MET  21          HB3       MET  21 -19.209  30.454 -13.338
  169   1HG   MET  21          HG2       MET  21 -17.122  30.000 -11.192
  170   2HG   MET  21          HG3       MET  21 -17.887  28.753 -12.145
  171   1HE   MET  21          HE1       MET  21 -16.406  29.167 -15.681
  172   2HE   MET  21          HE2       MET  21 -17.639  28.414 -14.648
  173   3HE   MET  21          HE3       MET  21 -17.840  30.111 -15.182
  174    H    ASN  22           H        ASN  22 -19.323  32.667 -14.557
  175    HA   ASN  22           HA       ASN  22 -21.898  33.757 -13.831
  176   1HB   ASN  22          HB2       ASN  22 -21.618  35.968 -14.738
  177   2HB   ASN  22          HB3       ASN  22 -20.512  35.736 -13.402
  178   1HD2  ASN  22          1HD2      ASN  22 -17.634  36.227 -15.473
  179   2HD2  ASN  22          2HD2      ASN  22 -18.237  35.825 -13.870
  180    H    ALA  23           H        ALA  23 -23.288  34.171 -15.613
  181    HA   ALA  23           HA       ALA  23 -22.658  33.523 -18.355
  182   1HB   ALA  23          HB1       ALA  23 -23.991  31.432 -18.427
  183   2HB   ALA  23          HB2       ALA  23 -22.538  31.258 -17.431
  184   3HB   ALA  23          HB3       ALA  23 -24.115  31.485 -16.651
  185    H    THR  24           H        THR  24 -24.696  33.543 -19.695
  186    HA   THR  24           HA       THR  24 -26.586  35.524 -18.594
  187    HB   THR  24           HB       THR  24 -26.659  34.443 -21.429
  188    HG1  THR  24           HG1      THR  24 -24.848  36.320 -20.327
  189   1HG2  THR  24          1HG2      THR  24 -28.430  35.993 -20.718
  190   2HG2  THR  24          2HG2      THR  24 -27.238  37.168 -20.160
  191   3HG2  THR  24          3HG2      THR  24 -27.349  36.786 -21.905
  192    H    ALA  25           H        ALA  25 -28.612  35.013 -17.988
  193    HA   ALA  25           HA       ALA  25 -29.600  32.285 -18.143
  194   1HB   ALA  25          HB1       ALA  25 -30.145  33.482 -16.186
  195   2HB   ALA  25          HB2       ALA  25 -30.739  34.897 -17.080
  196   3HB   ALA  25          HB3       ALA  25 -31.662  33.386 -17.087
  197    H    ASN  26           H        ASN  26 -31.347  31.503 -19.169
  198    HA   ASN  26           HA       ASN  26 -33.052  31.178 -20.574
  199   1HB   ASN  26          HB2       ASN  26 -33.716  33.443 -19.394
  200   2HB   ASN  26          HB3       ASN  26 -33.448  34.138 -20.993
  201   1HD2  ASN  26          1HD2      ASN  26 -36.545  31.498 -20.395
  202   2HD2  ASN  26          2HD2      ASN  26 -35.120  31.428 -19.363
  203    H    LEU  27           H        LEU  27 -30.238  32.366 -21.721
  204    HA   LEU  27           HA       LEU  27 -30.991  32.294 -24.593
  205   1HB   LEU  27          HB2       LEU  27 -28.276  32.756 -23.302
  206   2HB   LEU  27          HB3       LEU  27 -28.656  32.834 -25.006
  207    HG   LEU  27           HG       LEU  27 -29.631  34.746 -22.868
  208   1HD1  LEU  27          1HD1      LEU  27 -28.355  36.375 -24.229
  209   2HD1  LEU  27          2HD1      LEU  27 -27.307  35.053 -23.708
  210   3HD1  LEU  27          3HD1      LEU  27 -27.916  35.077 -25.377
  211   1HD2  LEU  27          1HD2      LEU  27 -30.398  34.608 -25.802
  212   2HD2  LEU  27          2HD2      LEU  27 -31.495  34.502 -24.431
  213   3HD2  LEU  27          3HD2      LEU  27 -30.668  36.014 -24.773
  214    H    SER  28           H        SER  28 -30.574  29.922 -22.397
  215    HA   SER  28           HA       SER  28 -30.293  27.752 -22.454
  216   1HB   SER  28          HB2       SER  28 -30.659  26.473 -24.354
  217   2HB   SER  28          HB3       SER  28 -31.568  27.968 -24.587
  218    HG   SER  28           HG       SER  28 -29.643  28.677 -25.816
  219    H    GLN  29           H        GLN  29 -27.912  29.580 -22.460
  220    HA   GLN  29           HA       GLN  29 -25.635  28.398 -23.520
  221   1HB   GLN  29          HB2       GLN  29 -26.107  30.068 -21.029
  222   2HB   GLN  29          HB3       GLN  29 -24.486  29.563 -21.504
  223   1HG   GLN  29          HG2       GLN  29 -24.717  30.650 -23.702
  224   2HG   GLN  29          HG3       GLN  29 -26.337  31.204 -23.268
  225   1HE2  GLN  29          1HE2      GLN  29 -25.099  33.301 -23.908
  226   2HE2  GLN  29          2HE2      GLN  29 -24.507  34.171 -22.486
  227    H    SER  30           H        SER  30 -23.901  27.213 -22.722
  228    HA   SER  30           HA       SER  30 -24.442  25.319 -20.477
  229   1HB   SER  30          HB2       SER  30 -22.877  24.849 -23.040
  230   2HB   SER  30          HB3       SER  30 -22.893  23.765 -21.630
  231    HG   SER  30           HG       SER  30 -24.473  23.213 -23.293
  232    H    VAL  31           H        VAL  31 -22.882  25.047 -19.005
  233    HA   VAL  31           HA       VAL  31 -20.460  26.856 -19.039
  234    HB   VAL  31           HB       VAL  31 -22.567  26.569 -16.869
  235   1HG1  VAL  31          1HG1      VAL  31 -21.313  28.432 -15.738
  236   2HG1  VAL  31          2HG1      VAL  31 -20.417  26.931 -15.782
  237   3HG1  VAL  31          3HG1      VAL  31 -20.009  28.229 -16.940
  238   1HG2  VAL  31          1HG2      VAL  31 -21.792  28.997 -18.547
  239   2HG2  VAL  31          2HG2      VAL  31 -23.281  28.062 -18.750
  240   3HG2  VAL  31          3HG2      VAL  31 -23.009  28.974 -17.256
  241    H    THR  32           H        THR  32 -18.693  26.063 -17.813
  242    HA   THR  32           HA       THR  32 -19.078  23.553 -16.225
  243    HB   THR  32           HB       THR  32 -16.566  24.312 -17.716
  244    HG1  THR  32           HG1      THR  32 -18.097  23.679 -19.192
  245   1HG2  THR  32          1HG2      THR  32 -17.378  21.784 -16.227
  246   2HG2  THR  32          2HG2      THR  32 -15.979  21.889 -17.309
  247   3HG2  THR  32          3HG2      THR  32 -16.014  22.872 -15.835
  248    H    LEU  33           H        LEU  33 -18.115  23.490 -14.240
  249    HA   LEU  33           HA       LEU  33 -16.007  25.287 -13.420
  250   1HB   LEU  33          HB2       LEU  33 -17.162  26.355 -11.548
  251   2HB   LEU  33          HB3       LEU  33 -17.829  26.805 -13.098
  252    HG   LEU  33           HG       LEU  33 -19.714  25.127 -12.649
  253   1HD1  LEU  33          1HD1      LEU  33 -18.849  23.796 -10.785
  254   2HD1  LEU  33          2HD1      LEU  33 -18.613  25.255  -9.819
  255   3HD1  LEU  33          3HD1      LEU  33 -20.237  24.727 -10.274
  256   1HD2  LEU  33          1HD2      LEU  33 -19.932  27.554 -12.505
  257   2HD2  LEU  33          2HD2      LEU  33 -20.946  26.744 -11.325
  258   3HD2  LEU  33          3HD2      LEU  33 -19.437  27.525 -10.789
  259    H    ALA  34           H        ALA  34 -15.299  24.697 -11.040
  260    HA   ALA  34           HA       ALA  34 -16.120  21.911 -10.398
  261   1HB   ALA  34          HB1       ALA  34 -13.246  22.435 -11.173
  262   2HB   ALA  34          HB2       ALA  34 -14.080  20.914 -10.893
  263   3HB   ALA  34          HB3       ALA  34 -14.439  21.919 -12.338
  264    H    CYS  35           H        CYS  35 -15.700  21.189  -8.511
  265    HA   CYS  35           HA       CYS  35 -13.840  22.624  -6.655
  266   1HB   CYS  35          HB2       CYS  35 -16.250  22.779  -5.967
  267   2HB   CYS  35          HB3       CYS  35 -16.274  21.025  -5.775
  268    H    ASP  36           H        ASP  36 -12.100  21.452  -7.541
  269    HA   ASP  36           HA       ASP  36 -12.292  18.677  -8.258
  270   1HB   ASP  36          HB2       ASP  36 -10.120  18.853  -9.060
  271   2HB   ASP  36          HB3       ASP  36 -10.995  20.293  -9.504
  272    H    ALA  37           H        ALA  37 -12.043  16.932  -7.040
  273    HA   ALA  37           HA       ALA  37 -10.878  17.126  -4.321
  274   1HB   ALA  37          HB1       ALA  37 -12.409  14.845  -5.669
  275   2HB   ALA  37          HB2       ALA  37 -11.912  14.954  -3.962
  276   3HB   ALA  37          HB3       ALA  37 -13.105  16.082  -4.613
  277    H    ASP  38           H        ASP  38  -9.409  15.522  -3.536
  278    HA   ASP  38           HA       ASP  38  -7.825  13.824  -5.306
  279   1HB   ASP  38          HB2       ASP  38  -6.803  16.078  -5.692
  280   2HB   ASP  38          HB3       ASP  38  -6.653  16.284  -3.940
  281    H    GLY  39           H        GLY  39  -6.274  12.509  -3.976
  282   1HA   GLY  39          HA2       GLY  39  -5.631  12.438  -1.394
  283   2HA   GLY  39          HA3       GLY  39  -7.306  11.902  -1.308
  284    H    PHE  40           H        PHE  40  -5.441  10.132  -0.380
  285    HA   PHE  40           HA       PHE  40  -5.657   7.969  -2.420
  286   1HB   PHE  40          HB2       PHE  40  -3.139   8.507  -0.840
  287   2HB   PHE  40          HB3       PHE  40  -3.485   7.067  -1.740
  288    HD1  PHE  40           HD1      PHE  40  -2.673  10.695  -2.101
  289    HD2  PHE  40           HD2      PHE  40  -3.381   6.966  -4.119
  290    HE1  PHE  40           HE1      PHE  40  -1.732  11.652  -4.180
  291    HE2  PHE  40           HE2      PHE  40  -2.423   7.904  -6.189
  292    HZ   PHE  40           HZ       PHE  40  -1.602  10.241  -6.236
  293    HA   PRO  41           HA       PRO  41  -6.548   5.994  -2.552
  294   1HB   PRO  41          HB2       PRO  41  -9.027   4.916  -2.097
  295   2HB   PRO  41          HB3       PRO  41  -7.506   4.062  -1.699
  296   1HG   PRO  41          HG2       PRO  41  -9.313   5.703   0.111
  297   2HG   PRO  41          HG3       PRO  41  -8.630   4.075   0.432
  298   1HD   PRO  41          HD2       PRO  41  -7.475   6.348   1.430
  299   2HD   PRO  41          HD3       PRO  41  -6.457   4.979   0.847
  300    H    GLU  42           H        GLU  42  -8.154   6.563  -4.164
  301    HA   GLU  42           HA       GLU  42  -8.942   9.179  -4.443
  302   1HB   GLU  42          HB2       GLU  42 -10.482   6.758  -5.505
  303   2HB   GLU  42          HB3       GLU  42 -10.573   8.428  -6.080
  304   1HG   GLU  42          HG2       GLU  42  -9.106   7.694  -7.630
  305   2HG   GLU  42          HG3       GLU  42  -7.926   8.123  -6.404
  306    HA   PRO  43           HA       PRO  43 -11.950   9.483  -1.213
  307   1HB   PRO  43          HB2       PRO  43 -12.492  12.143  -1.231
  308   2HB   PRO  43          HB3       PRO  43 -10.821  11.544  -0.988
  309   1HG   PRO  43          HG2       PRO  43 -12.083  12.422  -3.563
  310   2HG   PRO  43          HG3       PRO  43 -10.571  13.057  -2.804
  311   1HD   PRO  43          HD2       PRO  43 -10.443  11.071  -4.678
  312   2HD   PRO  43          HD3       PRO  43  -9.378  11.080  -3.241
  313    H    THR  44           H        THR  44 -14.012  10.329  -0.693
  314    HA   THR  44           HA       THR  44 -16.100  10.105  -2.873
  315    HB   THR  44           HB       THR  44 -16.409   9.656   0.135
  316    HG1  THR  44           HG1      THR  44 -15.359   8.033  -1.047
  317   1HG2  THR  44          1HG2      THR  44 -18.666   8.800  -0.468
  318   2HG2  THR  44          2HG2      THR  44 -18.530  10.513  -0.836
  319   3HG2  THR  44          3HG2      THR  44 -18.417   9.308  -2.148
  320    H    MET  45           H        MET  45 -17.706  11.908  -2.903
  321    HA   MET  45           HA       MET  45 -17.230  14.154  -1.081
  322   1HB   MET  45          HB2       MET  45 -16.491  15.680  -2.823
  323   2HB   MET  45          HB3       MET  45 -15.443  14.280  -2.789
  324   1HG   MET  45          HG2       MET  45 -15.730  14.414  -5.003
  325   2HG   MET  45          HG3       MET  45 -17.085  13.358  -4.673
  326   1HE   MET  45          HE1       MET  45 -17.003  17.764  -5.996
  327   2HE   MET  45          HE2       MET  45 -15.986  17.096  -4.708
  328   3HE   MET  45          HE3       MET  45 -15.840  16.453  -6.354
  329    H    THR  46           H        THR  46 -18.667  15.927  -1.323
  330    HA   THR  46           HA       THR  46 -21.010  15.711  -3.083
  331    HB   THR  46           HB       THR  46 -22.606  16.112  -1.184
  332    HG1  THR  46           HG1      THR  46 -21.935  15.539   0.890
  333   1HG2  THR  46          1HG2      THR  46 -22.908  13.821  -0.533
  334   2HG2  THR  46          2HG2      THR  46 -22.352  13.852  -2.214
  335   3HG2  THR  46          3HG2      THR  46 -21.207  13.444  -0.940
  336    H    TRP  47           H        TRP  47 -22.394  17.632  -2.936
  337    HA   TRP  47           HA       TRP  47 -21.451  20.024  -1.712
  338   1HB   TRP  47          HB2       TRP  47 -20.846  21.287  -3.756
  339   2HB   TRP  47          HB3       TRP  47 -19.739  20.079  -3.218
  340    HD1  TRP  47           HD1      TRP  47 -20.745  17.534  -4.907
  341    HE1  TRP  47           HE1      TRP  47 -19.891  17.430  -7.298
  342    HE3  TRP  47           HE3      TRP  47 -19.787  22.508  -5.631
  343    HZ2  TRP  47           HZ2      TRP  47 -18.673  19.243  -9.196
  344    HZ3  TRP  47           HZ3      TRP  47 -18.823  23.290  -7.798
  345    HH2  TRP  47           HH2      TRP  47 -18.270  21.659  -9.572
  346    H    THR  48           H        THR  48 -22.665  22.003  -2.325
  347    HA   THR  48           HA       THR  48 -25.496  21.226  -2.804
  348    HB   THR  48           HB       THR  48 -26.068  23.035  -1.251
  349    HG1  THR  48           HG1      THR  48 -24.375  23.951  -0.039
  350   1HG2  THR  48          1HG2      THR  48 -25.696  20.698  -0.422
  351   2HG2  THR  48          2HG2      THR  48 -23.995  21.153  -0.083
  352   3HG2  THR  48          3HG2      THR  48 -25.338  21.957   0.774
  353    H    LYS  49           H        LYS  49 -26.992  22.709  -3.676
  354    HA   LYS  49           HA       LYS  49 -25.922  24.873  -5.442
  355   1HB   LYS  49          HB2       LYS  49 -27.161  22.732  -6.339
  356   2HB   LYS  49          HB3       LYS  49 -28.641  23.506  -5.772
  357   1HG   LYS  49          HG2       LYS  49 -28.164  25.466  -7.204
  358   2HG   LYS  49          HG3       LYS  49 -26.594  24.763  -7.677
  359   1HD   LYS  49          HD2       LYS  49 -27.717  22.850  -8.749
  360   2HD   LYS  49          HD3       LYS  49 -29.314  23.502  -8.245
  361   1HE   LYS  49          HE2       LYS  49 -28.952  25.512  -9.618
  362   2HE   LYS  49          HE3       LYS  49 -27.310  25.001 -10.029
  363   1HZ   LYS  49          HZ1       LYS  49 -29.811  23.592 -10.783
  364   2HZ   LYS  49          HZ2       LYS  49 -28.883  24.491 -11.817
  365   3HZ   LYS  49          HZ3       LYS  49 -28.286  23.087 -11.198
  366    H    ASP  50           H        ASP  50 -26.027  25.730  -3.018
  367    HA   ASP  50           HA       ASP  50 -26.817  27.152  -1.450
  368   1HB   ASP  50          HB2       ASP  50 -26.748  28.574  -3.527
  369   2HB   ASP  50          HB3       ASP  50 -28.472  28.337  -3.725
  370    H    GLY  51           H        GLY  51 -28.472  24.652  -1.865
  371   1HA   GLY  51          HA2       GLY  51 -30.414  25.094   0.183
  372   2HA   GLY  51          HA3       GLY  51 -31.237  25.163  -1.353
  373    H    GLU  52           H        GLU  52 -29.401  22.989  -2.494
  374    HA   GLU  52           HA       GLU  52 -30.038  20.647  -0.855
  375   1HB   GLU  52          HB2       GLU  52 -31.435  19.580  -2.521
  376   2HB   GLU  52          HB3       GLU  52 -32.128  21.132  -2.117
  377   1HG   GLU  52          HG2       GLU  52 -31.060  22.105  -4.198
  378   2HG   GLU  52          HG3       GLU  52 -30.549  20.484  -4.625
  379    HA   PRO  53           HA       PRO  53 -26.393  19.082  -2.648
  380   1HB   PRO  53          HB2       PRO  53 -27.632  16.375  -2.994
  381   2HB   PRO  53          HB3       PRO  53 -26.139  16.815  -2.120
  382   1HG   PRO  53          HG2       PRO  53 -28.451  16.254  -0.739
  383   2HG   PRO  53          HG3       PRO  53 -27.440  17.658  -0.268
  384   1HD   PRO  53          HD2       PRO  53 -29.898  17.648  -2.090
  385   2HD   PRO  53          HD3       PRO  53 -29.566  18.647  -0.635
  386    H    ILE  54           H        ILE  54 -25.263  18.712  -4.450
  387    HA   ILE  54           HA       ILE  54 -26.639  18.444  -7.051
  388    HB   ILE  54           HB       ILE  54 -23.842  19.264  -6.209
  389   1HG1  ILE  54          2HG1      ILE  54 -25.961  20.922  -7.641
  390   2HG1  ILE  54          3HG1      ILE  54 -25.891  20.833  -5.881
  391   1HG2  ILE  54          1HG2      ILE  54 -23.478  18.277  -8.357
  392   2HG2  ILE  54          2HG2      ILE  54 -24.861  19.159  -9.075
  393   3HG2  ILE  54          3HG2      ILE  54 -23.411  19.985  -8.567
  394   1HD1  ILE  54          1HD1      ILE  54 -24.718  22.838  -6.631
  395   2HD1  ILE  54          2HD1      ILE  54 -23.559  21.690  -5.914
  396   3HD1  ILE  54          3HD1      ILE  54 -23.691  21.886  -7.691
  397    H    GLU  55           H        GLU  55 -25.944  16.390  -4.985
  398    HA   GLU  55           HA       GLU  55 -24.387  14.309  -5.257
  399   1HB   GLU  55          HB2       GLU  55 -26.250  12.754  -4.874
  400   2HB   GLU  55          HB3       GLU  55 -26.163  14.115  -3.763
  401   1HG   GLU  55          HG2       GLU  55 -28.014  15.212  -5.137
  402   2HG   GLU  55          HG3       GLU  55 -28.190  13.679  -6.002
  403    H    GLN  56           H        GLN  56 -23.278  14.145  -7.201
  404    HA   GLN  56           HA       GLN  56 -24.507  13.834  -9.677
  405   1HB   GLN  56          HB2       GLN  56 -21.714  13.175  -8.736
  406   2HB   GLN  56          HB3       GLN  56 -22.177  13.263 -10.434
  407   1HG   GLN  56          HG2       GLN  56 -22.553  15.638  -8.563
  408   2HG   GLN  56          HG3       GLN  56 -21.118  15.403  -9.506
  409   1HE2  GLN  56          1HE2      GLN  56 -24.390  16.847 -11.365
  410   2HE2  GLN  56          2HE2      GLN  56 -24.412  16.467  -9.649
  411    H    GLU  57           H        GLU  57 -24.609  11.458  -7.398
  412    HA   GLU  57           HA       GLU  57 -24.652   9.214  -9.315
  413   1HB   GLU  57          HB2       GLU  57 -24.854   7.763  -7.363
  414   2HB   GLU  57          HB3       GLU  57 -23.488   8.868  -7.161
  415   1HG   GLU  57          HG2       GLU  57 -24.899  10.294  -5.704
  416   2HG   GLU  57          HG3       GLU  57 -26.256   9.178  -5.892
  417    H    ASP  58           H        ASP  58 -26.860  11.521  -8.304
  418    HA   ASP  58           HA       ASP  58 -29.116   9.905  -9.294
  419   1HB   ASP  58          HB2       ASP  58 -28.947   9.395  -6.844
  420   2HB   ASP  58          HB3       ASP  58 -29.197  11.104  -6.502
  421    H    ASN  59           H        ASN  59 -27.881  13.047  -8.218
  422    HA   ASN  59           HA       ASN  59 -30.207  14.392  -9.542
  423   1HB   ASN  59          HB2       ASN  59 -29.656  15.146  -7.259
  424   2HB   ASN  59          HB3       ASN  59 -28.046  15.624  -7.798
  425   1HD2  ASN  59          1HD2      ASN  59 -29.662  18.797  -8.240
  426   2HD2  ASN  59          2HD2      ASN  59 -28.852  17.860  -6.965
  427    H    GLU  60           H        GLU  60 -29.958  14.458 -11.638
  428    HA   GLU  60           HA       GLU  60 -27.400  15.437 -12.891
  429   1HB   GLU  60          HB2       GLU  60 -29.126  13.047 -13.619
  430   2HB   GLU  60          HB3       GLU  60 -27.762  13.646 -14.587
  431   1HG   GLU  60          HG2       GLU  60 -26.225  13.177 -12.703
  432   2HG   GLU  60          HG3       GLU  60 -27.557  12.476 -11.777
  433    H    GLU  61           H        GLU  61 -30.400  16.386 -12.488
  434    HA   GLU  61           HA       GLU  61 -32.112  16.422 -14.508
  435   1HB   GLU  61          HB2       GLU  61 -31.270  18.826 -12.856
  436   2HB   GLU  61          HB3       GLU  61 -32.703  18.835 -13.874
  437   1HG   GLU  61          HG2       GLU  61 -32.262  16.906 -11.567
  438   2HG   GLU  61          HG3       GLU  61 -33.204  18.381 -11.487
  439    H    LYS  62           H        LYS  62 -29.353  18.645 -14.652
  440    HA   LYS  62           HA       LYS  62 -29.262  18.400 -17.550
  441   1HB   LYS  62          HB2       LYS  62 -29.442  20.809 -18.115
  442   2HB   LYS  62          HB3       LYS  62 -30.919  20.181 -17.434
  443   1HG   LYS  62          HG2       LYS  62 -30.182  21.185 -15.169
  444   2HG   LYS  62          HG3       LYS  62 -28.881  21.977 -16.066
  445   1HD   LYS  62          HD2       LYS  62 -30.698  22.899 -17.634
  446   2HD   LYS  62          HD3       LYS  62 -31.877  22.355 -16.409
  447   1HE   LYS  62          HE2       LYS  62 -30.713  23.691 -14.696
  448   2HE   LYS  62          HE3       LYS  62 -29.467  24.153 -15.854
  449   1HZ   LYS  62          HZ1       LYS  62 -32.320  24.966 -15.951
  450   2HZ   LYS  62          HZ2       LYS  62 -30.994  25.911 -15.628
  451   3HZ   LYS  62          HZ3       LYS  62 -31.217  25.326 -17.126
  452    H    TYR  63           H        TYR  63 -27.542  17.453 -15.708
  453    HA   TYR  63           HA       TYR  63 -25.047  18.776 -16.280
  454   1HB   TYR  63          HB2       TYR  63 -24.609  19.136 -13.698
  455   2HB   TYR  63          HB3       TYR  63 -25.404  20.351 -14.675
  456    HD1  TYR  63           HD1      TYR  63 -26.105  17.644 -12.166
  457    HD2  TYR  63           HD2      TYR  63 -27.545  21.150 -14.211
  458    HE1  TYR  63           HE1      TYR  63 -27.830  17.942 -10.431
  459    HE2  TYR  63           HE2      TYR  63 -29.348  21.387 -12.528
  460    HH   TYR  63           HH       TYR  63 -30.243  20.609 -10.552
  461    H    SER  64           H        SER  64 -23.190  17.870 -15.445
  462    HA   SER  64           HA       SER  64 -23.066  15.249 -14.148
  463   1HB   SER  64          HB2       SER  64 -22.848  15.496 -17.169
  464   2HB   SER  64          HB3       SER  64 -22.063  14.187 -16.275
  465    HG   SER  64           HG       SER  64 -24.798  14.732 -15.865
  466    H    PHE  65           H        PHE  65 -20.845  14.692 -13.678
  467    HA   PHE  65           HA       PHE  65 -18.680  16.312 -14.870
  468   1HB   PHE  65          HB2       PHE  65 -17.956  16.836 -12.788
  469   2HB   PHE  65          HB3       PHE  65 -19.682  17.042 -12.697
  470    HD1  PHE  65           HD1      PHE  65 -19.669  13.617 -12.248
  471    HD2  PHE  65           HD2      PHE  65 -18.170  17.179 -10.300
  472    HE1  PHE  65           HE1      PHE  65 -19.458  12.382 -10.132
  473    HE2  PHE  65           HE2      PHE  65 -17.969  15.927  -8.187
  474    HZ   PHE  65           HZ       PHE  65 -18.647  13.517  -8.088
  475    H    ASN  66           H        ASN  66 -16.584  15.313 -13.502
  476    HA   ASN  66           HA       ASN  66 -16.138  12.707 -14.864
  477   1HB   ASN  66          HB2       ASN  66 -14.143  14.681 -13.637
  478   2HB   ASN  66          HB3       ASN  66 -13.755  13.343 -14.732
  479   1HD2  ASN  66          1HD2      ASN  66 -14.304  16.845 -16.357
  480   2HD2  ASN  66          2HD2      ASN  66 -13.612  16.480 -14.783
  481    H    TYR  67           H        TYR  67 -14.217  11.481 -13.769
  482    HA   TYR  67           HA       TYR  67 -14.653  11.125 -10.824
  483   1HB   TYR  67          HB2       TYR  67 -15.388   9.140 -12.159
  484   2HB   TYR  67          HB3       TYR  67 -13.774   8.994 -12.827
  485    HD1  TYR  67           HD1      TYR  67 -11.968   7.979 -11.550
  486    HD2  TYR  67           HD2      TYR  67 -15.746   8.829  -9.651
  487    HE1  TYR  67           HE1      TYR  67 -11.270   6.678  -9.555
  488    HE2  TYR  67           HE2      TYR  67 -15.008   7.561  -7.640
  489    HH   TYR  67           HH       TYR  67 -13.364   6.365  -6.645
  490    H    ASP  68           H        ASP  68 -12.757  10.809  -9.575
  491    HA   ASP  68           HA       ASP  68 -10.781  11.673  -8.835
  492   1HB   ASP  68          HB2       ASP  68  -9.998   9.697 -10.189
  493   2HB   ASP  68          HB3       ASP  68  -9.648  10.806 -11.514
  494    H    GLY  69           H        GLY  69 -12.601  13.402 -10.056
  495   1HA   GLY  69          HA2       GLY  69 -11.311  15.944 -10.228
  496   2HA   GLY  69          HA3       GLY  69 -11.789  15.380 -11.847
  497    H    SER  70           H        SER  70 -13.123  17.606 -11.007
  498    HA   SER  70           HA       SER  70 -15.815  16.627 -10.137
  499   1HB   SER  70          HB2       SER  70 -14.457  19.047  -8.960
  500   2HB   SER  70          HB3       SER  70 -15.953  18.253  -8.413
  501    HG   SER  70           HG       SER  70 -14.186  17.771  -7.107
  502    H    GLU  71           H        GLU  71 -14.824  17.670 -12.842
  503    HA   GLU  71           HA       GLU  71 -15.719  20.421 -12.956
  504   1HB   GLU  71          HB2       GLU  71 -14.949  18.569 -15.232
  505   2HB   GLU  71          HB3       GLU  71 -15.195  20.305 -15.363
  506   1HG   GLU  71          HG2       GLU  71 -12.834  19.696 -15.318
  507   2HG   GLU  71          HG3       GLU  71 -13.269  20.772 -14.001
  508    H    LEU  72           H        LEU  72 -17.761  20.569 -12.324
  509    HA   LEU  72           HA       LEU  72 -19.991  19.030 -13.287
  510   1HB   LEU  72          HB2       LEU  72 -19.853  19.927 -11.028
  511   2HB   LEU  72          HB3       LEU  72 -19.698  21.576 -11.656
  512    HG   LEU  72           HG       LEU  72 -21.992  21.300 -12.685
  513   1HD1  LEU  72          1HD1      LEU  72 -22.022  18.853 -10.869
  514   2HD1  LEU  72          2HD1      LEU  72 -23.472  19.577 -11.635
  515   3HD1  LEU  72          3HD1      LEU  72 -22.189  18.841 -12.611
  516   1HD2  LEU  72          1HD2      LEU  72 -21.686  21.106  -9.673
  517   2HD2  LEU  72          2HD2      LEU  72 -21.589  22.594 -10.615
  518   3HD2  LEU  72          3HD2      LEU  72 -23.130  21.740 -10.504
  519    H    ILE  73           H        ILE  73 -20.520  19.209 -15.348
  520    HA   ILE  73           HA       ILE  73 -20.517  21.820 -16.748
  521    HB   ILE  73           HB       ILE  73 -21.218  19.061 -17.766
  522   1HG1  ILE  73          2HG1      ILE  73 -18.678  20.497 -18.575
  523   2HG1  ILE  73          3HG1      ILE  73 -18.670  19.624 -17.040
  524   1HG2  ILE  73          1HG2      ILE  73 -20.908  20.210 -20.013
  525   2HG2  ILE  73          2HG2      ILE  73 -22.266  20.801 -19.096
  526   3HG2  ILE  73          3HG2      ILE  73 -20.774  21.767 -19.181
  527   1HD1  ILE  73          1HD1      ILE  73 -19.386  18.338 -19.695
  528   2HD1  ILE  73          2HD1      ILE  73 -17.878  18.111 -18.767
  529   3HD1  ILE  73          3HD1      ILE  73 -19.418  17.563 -18.102
  530    H    ILE  74           H        ILE  74 -22.358  22.938 -16.878
  531    HA   ILE  74           HA       ILE  74 -25.013  21.662 -16.332
  532    HB   ILE  74           HB       ILE  74 -24.127  24.504 -15.764
  533   1HG1  ILE  74          2HG1      ILE  74 -24.967  22.399 -13.734
  534   2HG1  ILE  74          3HG1      ILE  74 -23.296  22.761 -14.114
  535   1HG2  ILE  74          1HG2      ILE  74 -26.393  24.881 -14.806
  536   2HG2  ILE  74          2HG2      ILE  74 -26.536  24.385 -16.487
  537   3HG2  ILE  74          3HG2      ILE  74 -26.829  23.201 -15.224
  538   1HD1  ILE  74          1HD1      ILE  74 -23.608  25.083 -13.342
  539   2HD1  ILE  74          2HD1      ILE  74 -25.286  24.644 -12.840
  540   3HD1  ILE  74          3HD1      ILE  74 -23.914  23.873 -12.070
  541    H    LYS  75           H        LYS  75 -26.253  21.625 -18.082
  542    HA   LYS  75           HA       LYS  75 -25.781  23.618 -20.266
  543   1HB   LYS  75          HB2       LYS  75 -26.910  22.100 -21.752
  544   2HB   LYS  75          HB3       LYS  75 -25.563  21.284 -20.970
  545   1HG   LYS  75          HG2       LYS  75 -27.202  20.277 -19.337
  546   2HG   LYS  75          HG3       LYS  75 -28.506  20.937 -20.305
  547   1HD   LYS  75          HD2       LYS  75 -27.620  19.669 -22.270
  548   2HD   LYS  75          HD3       LYS  75 -26.311  19.054 -21.196
  549   1HE   LYS  75          HE2       LYS  75 -28.006  17.983 -19.762
  550   2HE   LYS  75          HE3       LYS  75 -29.320  18.610 -20.787
  551   1HZ   LYS  75          HZ1       LYS  75 -28.478  17.299 -22.622
  552   2HZ   LYS  75          HZ2       LYS  75 -27.237  16.719 -21.742
  553   3HZ   LYS  75          HZ3       LYS  75 -28.758  16.305 -21.366
  554    H    LYS  76           H        LYS  76 -27.503  24.619 -21.210
  555    HA   LYS  76           HA       LYS  76 -29.451  25.792 -21.411
  556   1HB   LYS  76          HB2       LYS  76 -30.824  23.670 -19.733
  557   2HB   LYS  76          HB3       LYS  76 -31.565  24.784 -20.877
  558   1HG   LYS  76          HG2       LYS  76 -29.732  22.471 -21.555
  559   2HG   LYS  76          HG3       LYS  76 -31.462  22.510 -21.711
  560   1HD   LYS  76          HD2       LYS  76 -31.292  24.315 -23.416
  561   2HD   LYS  76          HD3       LYS  76 -29.532  24.324 -23.231
  562   1HE   LYS  76          HE2       LYS  76 -29.917  23.086 -25.192
  563   2HE   LYS  76          HE3       LYS  76 -29.463  21.931 -23.940
  564   1HZ   LYS  76          HZ1       LYS  76 -31.841  21.398 -23.673
  565   2HZ   LYS  76          HZ2       LYS  76 -32.236  22.481 -24.841
  566   3HZ   LYS  76          HZ3       LYS  76 -31.373  21.157 -25.222
  567    H    VAL  77           H        VAL  77 -27.811  26.890 -19.688
  568    HA   VAL  77           HA       VAL  77 -28.692  27.210 -17.036
  569    HB   VAL  77           HB       VAL  77 -26.860  28.840 -18.798
  570   1HG1  VAL  77          1HG1      VAL  77 -27.700  30.493 -17.176
  571   2HG1  VAL  77          2HG1      VAL  77 -27.408  29.355 -15.837
  572   3HG1  VAL  77          3HG1      VAL  77 -26.048  30.047 -16.769
  573   1HG2  VAL  77          1HG2      VAL  77 -26.072  26.615 -18.048
  574   2HG2  VAL  77          2HG2      VAL  77 -25.190  27.871 -17.176
  575   3HG2  VAL  77          3HG2      VAL  77 -26.510  27.023 -16.355
  576    H    ASP  78           H        ASP  78 -29.883  28.537 -15.897
  577    HA   ASP  78           HA       ASP  78 -31.001  31.021 -16.972
  578   1HB   ASP  78          HB2       ASP  78 -32.606  28.830 -17.172
  579   2HB   ASP  78          HB3       ASP  78 -32.941  29.298 -15.504
  580    H    LYS  79           H        LYS  79 -32.417  31.963 -14.921
  581    HA   LYS  79           HA       LYS  79 -30.464  32.485 -12.856
  582   1HB   LYS  79          HB2       LYS  79 -33.462  33.126 -13.084
  583   2HB   LYS  79          HB3       LYS  79 -32.503  33.661 -11.723
  584   1HG   LYS  79          HG2       LYS  79 -31.835  34.320 -14.623
  585   2HG   LYS  79          HG3       LYS  79 -32.826  35.332 -13.571
  586   1HD   LYS  79          HD2       LYS  79 -29.965  34.607 -12.827
  587   2HD   LYS  79          HD3       LYS  79 -30.379  35.998 -13.803
  588   1HE   LYS  79          HE2       LYS  79 -31.725  36.957 -12.053
  589   2HE   LYS  79          HE3       LYS  79 -31.583  35.513 -11.043
  590   1HZ   LYS  79          HZ1       LYS  79 -29.122  36.932 -11.832
  591   2HZ   LYS  79          HZ2       LYS  79 -30.035  37.502 -10.582
  592   3HZ   LYS  79          HZ3       LYS  79 -29.385  36.008 -10.520
  593    H    SER  80           H        SER  80 -32.582  29.833 -13.113
  594    HA   SER  80           HA       SER  80 -32.640  29.155 -10.283
  595   1HB   SER  80          HB2       SER  80 -33.424  26.937 -11.246
  596   2HB   SER  80          HB3       SER  80 -34.401  28.359 -11.630
  597    HG   SER  80           HG       SER  80 -33.993  27.002 -13.459
  598    H    ASP  81           H        ASP  81 -30.146  29.061 -12.637
  599    HA   ASP  81           HA       ASP  81 -28.659  26.920 -11.223
  600   1HB   ASP  81          HB2       ASP  81 -28.010  28.443 -13.765
  601   2HB   ASP  81          HB3       ASP  81 -27.059  27.125 -13.074
  602    H    GLU  82           H        GLU  82 -29.113  30.176 -10.720
  603    HA   GLU  82           HA       GLU  82 -26.440  31.022 -10.006
  604   1HB   GLU  82          HB2       GLU  82 -28.424  32.506 -10.371
  605   2HB   GLU  82          HB3       GLU  82 -29.130  31.888  -8.879
  606   1HG   GLU  82          HG2       GLU  82 -27.012  32.717  -7.683
  607   2HG   GLU  82          HG3       GLU  82 -26.570  33.497  -9.217
  608    H    ALA  83           H        ALA  83 -25.255  30.445  -8.218
  609    HA   ALA  83           HA       ALA  83 -26.479  29.117  -5.898
  610   1HB   ALA  83          HB1       ALA  83 -25.164  26.992  -6.343
  611   2HB   ALA  83          HB2       ALA  83 -26.398  27.310  -7.562
  612   3HB   ALA  83          HB3       ALA  83 -24.683  27.628  -7.919
  613    H    GLU  84           H        GLU  84 -25.198  28.759  -4.189
  614    HA   GLU  84           HA       GLU  84 -22.366  29.669  -4.122
  615   1HB   GLU  84          HB2       GLU  84 -23.830  31.187  -2.809
  616   2HB   GLU  84          HB3       GLU  84 -24.437  29.817  -1.885
  617   1HG   GLU  84          HG2       GLU  84 -22.129  29.346  -1.088
  618   2HG   GLU  84          HG3       GLU  84 -21.531  30.703  -2.042
  619    H    TYR  85           H        TYR  85 -21.239  27.882  -4.163
  620    HA   TYR  85           HA       TYR  85 -22.433  25.298  -3.416
  621   1HB   TYR  85          HB2       TYR  85 -19.825  25.949  -4.832
  622   2HB   TYR  85          HB3       TYR  85 -20.544  24.355  -4.645
  623    HD1  TYR  85           HD1      TYR  85 -22.083  23.513  -6.245
  624    HD2  TYR  85           HD2      TYR  85 -20.935  27.667  -6.368
  625    HE1  TYR  85           HE1      TYR  85 -23.059  23.730  -8.531
  626    HE2  TYR  85           HE2      TYR  85 -21.868  27.865  -8.649
  627    HH   TYR  85           HH       TYR  85 -23.502  25.097 -10.246
  628    H    ILE  86           H        ILE  86 -21.977  24.464  -1.459
  629    HA   ILE  86           HA       ILE  86 -19.251  24.965  -0.250
  630    HB   ILE  86           HB       ILE  86 -21.834  24.053   1.085
  631   1HG1  ILE  86          2HG1      ILE  86 -21.258  25.993   2.646
  632   2HG1  ILE  86          3HG1      ILE  86 -20.070  26.527   1.435
  633   1HG2  ILE  86          1HG2      ILE  86 -20.372  23.914   3.142
  634   2HG2  ILE  86          2HG2      ILE  86 -19.982  22.729   1.917
  635   3HG2  ILE  86          3HG2      ILE  86 -18.944  24.158   2.106
  636   1HD1  ILE  86          1HD1      ILE  86 -22.288  27.722   1.421
  637   2HD1  ILE  86          2HD1      ILE  86 -21.820  27.038  -0.137
  638   3HD1  ILE  86          3HD1      ILE  86 -23.041  26.211   0.848
  639    H    CYS  87           H        CYS  87 -17.888  23.341  -0.495
  640    HA   CYS  87           HA       CYS  87 -18.945  20.655  -1.351
  641   1HB   CYS  87          HB2       CYS  87 -16.917  20.560  -2.862
  642   2HB   CYS  87          HB3       CYS  87 -18.249  21.581  -3.377
  643    H    ILE  88           H        ILE  88 -18.080  18.871  -0.636
  644    HA   ILE  88           HA       ILE  88 -15.891  19.012   1.365
  645    HB   ILE  88           HB       ILE  88 -18.589  17.659   1.753
  646   1HG1  ILE  88          2HG1      ILE  88 -17.510  20.205   3.086
  647   2HG1  ILE  88          3HG1      ILE  88 -18.801  20.126   1.893
  648   1HG2  ILE  88          1HG2      ILE  88 -16.693  16.500   2.883
  649   2HG2  ILE  88          2HG2      ILE  88 -16.244  18.019   3.667
  650   3HG2  ILE  88          3HG2      ILE  88 -17.795  17.207   4.037
  651   1HD1  ILE  88          1HD1      ILE  88 -20.170  18.744   3.453
  652   2HD1  ILE  88          2HD1      ILE  88 -18.929  19.048   4.716
  653   3HD1  ILE  88          3HD1      ILE  88 -19.840  20.392   4.007
  654    H    ALA  89           H        ALA  89 -14.568  17.263   1.373
  655    HA   ALA  89           HA       ALA  89 -15.394  14.793  -0.071
  656   1HB   ALA  89          HB1       ALA  89 -13.911  16.080  -1.605
  657   2HB   ALA  89          HB2       ALA  89 -12.673  16.114  -0.310
  658   3HB   ALA  89          HB3       ALA  89 -13.163  14.571  -1.037
  659    H    GLU  90           H        GLU  90 -14.451  12.900   0.676
  660    HA   GLU  90           HA       GLU  90 -12.939  12.926   3.225
  661   1HB   GLU  90          HB2       GLU  90 -15.332  13.165   3.804
  662   2HB   GLU  90          HB3       GLU  90 -15.714  11.759   2.802
  663   1HG   GLU  90          HG2       GLU  90 -14.429  10.293   4.315
  664   2HG   GLU  90          HG3       GLU  90 -13.919  11.685   5.269
  665    H    ASN  91           H        ASN  91 -11.830  10.999   3.636
  666    HA   ASN  91           HA       ASN  91 -12.483   8.616   2.090
  667   1HB   ASN  91          HB2       ASN  91 -10.474   8.131   1.126
  668   2HB   ASN  91          HB3       ASN  91 -10.795   9.787   0.668
  669   1HD2  ASN  91          1HD2      ASN  91  -7.255   9.929   1.386
  670   2HD2  ASN  91          2HD2      ASN  91  -8.349   9.338   0.125
  671    H    LYS  92           H        LYS  92 -10.239   7.094   2.997
  672    HA   LYS  92           HA       LYS  92 -11.256   6.513   5.683
  673   1HB   LYS  92          HB2       LYS  92  -8.980   4.896   4.976
  674   2HB   LYS  92          HB3       LYS  92 -10.609   4.409   5.282
  675   1HG   LYS  92          HG2       LYS  92  -9.435   5.300   2.613
  676   2HG   LYS  92          HG3       LYS  92  -9.769   3.651   3.129
  677   1HD   LYS  92          HD2       LYS  92 -12.282   4.589   3.363
  678   2HD   LYS  92          HD3       LYS  92 -11.671   5.806   2.203
  679   1HE   LYS  92          HE2       LYS  92 -12.659   4.129   0.863
  680   2HE   LYS  92          HE3       LYS  92 -10.942   3.909   0.678
  681   1HZ   LYS  92          HZ1       LYS  92 -11.105   2.067   2.337
  682   2HZ   LYS  92          HZ2       LYS  92 -12.700   2.321   2.480
  683   3HZ   LYS  92          HZ3       LYS  92 -12.101   1.802   1.057
  684    H    ALA  93           H        ALA  93  -8.654   8.325   4.496
  685    HA   ALA  93           HA       ALA  93  -7.155   8.269   7.052
  686   1HB   ALA  93          HB1       ALA  93  -6.483   9.533   4.368
  687   2HB   ALA  93          HB2       ALA  93  -5.409   9.438   5.780
  688   3HB   ALA  93          HB3       ALA  93  -5.897   7.962   4.947
  689    H    GLY  94           H        GLY  94  -9.404  10.422   5.371
  690   1HA   GLY  94          HA2       GLY  94  -9.660  12.149   7.614
  691   2HA   GLY  94          HA3       GLY  94  -8.493  12.889   6.547
  692    H    GLU  95           H        GLU  95 -10.051  14.661   6.468
  693    HA   GLU  95           HA       GLU  95 -12.084  14.483   4.345
  694   1HB   GLU  95          HB2       GLU  95 -13.253  13.790   6.416
  695   2HB   GLU  95          HB3       GLU  95 -12.707  15.239   7.259
  696   1HG   GLU  95          HG2       GLU  95 -13.984  16.659   5.710
  697   2HG   GLU  95          HG3       GLU  95 -14.529  15.215   4.855
  698    H    GLN  96           H        GLN  96 -12.517  16.554   3.422
  699    HA   GLN  96           HA       GLN  96 -11.508  19.009   4.688
  700   1HB   GLN  96          HB2       GLN  96  -9.598  17.768   3.439
  701   2HB   GLN  96          HB3       GLN  96 -10.349  18.401   1.971
  702   1HG   GLN  96          HG2       GLN  96  -9.920  20.686   2.672
  703   2HG   GLN  96          HG3       GLN  96  -9.632  20.192   4.331
  704   1HE2  GLN  96          1HE2      GLN  96  -7.671  18.679   4.701
  705   2HE2  GLN  96          2HE2      GLN  96  -6.256  19.043   3.711
  706    H    ASP  97           H        ASP  97 -11.871  20.969   3.124
  707    HA   ASP  97           HA       ASP  97 -14.183  20.646   1.344
  708   1HB   ASP  97          HB2       ASP  97 -15.639  22.085   2.642
  709   2HB   ASP  97          HB3       ASP  97 -15.180  20.685   3.583
  710    H    ALA  98           H        ALA  98 -14.877  22.576   0.258
  711    HA   ALA  98           HA       ALA  98 -13.340  25.082   0.443
  712   1HB   ALA  98          HB1       ALA  98 -13.445  23.440  -2.132
  713   2HB   ALA  98          HB2       ALA  98 -12.836  25.071  -2.014
  714   3HB   ALA  98          HB3       ALA  98 -12.011  23.757  -1.155
  715    H    THR  99           H        THR  99 -14.350  26.563  -1.593
  716    HA   THR  99           HA       THR  99 -17.289  26.258  -1.697
  717    HB   THR  99           HB       THR  99 -15.843  28.473  -0.242
  718    HG1  THR  99           HG1      THR  99 -16.801  26.386   0.680
  719   1HG2  THR  99          1HG2      THR  99 -17.489  29.694  -1.563
  720   2HG2  THR  99          2HG2      THR  99 -18.763  28.502  -1.115
  721   3HG2  THR  99          3HG2      THR  99 -18.040  29.584   0.109
  722    H    ILE 100           H        ILE 100 -18.283  27.436  -3.339
  723    HA   ILE 100           HA       ILE 100 -16.682  29.165  -5.159
  724    HB   ILE 100           HB       ILE 100 -18.268  26.733  -6.119
  725   1HG1  ILE 100          2HG1      ILE 100 -15.240  27.119  -5.992
  726   2HG1  ILE 100          3HG1      ILE 100 -16.225  26.000  -5.020
  727   1HG2  ILE 100          1HG2      ILE 100 -16.655  28.774  -7.698
  728   2HG2  ILE 100          2HG2      ILE 100 -17.234  27.262  -8.368
  729   3HG2  ILE 100          3HG2      ILE 100 -18.394  28.399  -7.841
  730   1HD1  ILE 100          1HD1      ILE 100 -16.928  24.855  -7.119
  731   2HD1  ILE 100          2HD1      ILE 100 -15.659  25.767  -7.972
  732   3HD1  ILE 100          3HD1      ILE 100 -15.209  24.693  -6.645
  733    H    HIS 101           H        HIS 101 -18.105  30.343  -6.759
  734    HA   HIS 101           HA       HIS 101 -21.009  30.433  -6.070
  735   1HB   HIS 101          HB2       HIS 101 -19.228  32.853  -6.611
  736   2HB   HIS 101          HB3       HIS 101 -20.983  32.891  -6.310
  737    HD1  HIS 101           HD1      HIS 101 -21.657  33.230  -3.815
  738    HD2  HIS 101           HD2      HIS 101 -17.624  32.152  -4.410
  739    HE1  HIS 101           HE1      HIS 101 -20.493  33.473  -1.550
  740    H    LEU 102           H        LEU 102 -22.394  30.797  -7.786
  741    HA   LEU 102           HA       LEU 102 -21.305  31.493 -10.461
  742   1HB   LEU 102          HB2       LEU 102 -21.765  29.160 -10.557
  743   2HB   LEU 102          HB3       LEU 102 -23.325  29.353  -9.723
  744    HG   LEU 102           HG       LEU 102 -24.299  30.416 -11.686
  745   1HD1  LEU 102          1HD1      LEU 102 -21.580  30.227 -13.012
  746   2HD1  LEU 102          2HD1      LEU 102 -23.095  30.693 -13.807
  747   3HD1  LEU 102          3HD1      LEU 102 -22.402  31.726 -12.552
  748   1HD2  LEU 102          1HD2      LEU 102 -24.163  28.554 -13.267
  749   2HD2  LEU 102          2HD2      LEU 102 -22.633  28.007 -12.547
  750   3HD2  LEU 102          3HD2      LEU 102 -24.127  27.951 -11.602
  751    H    LYS 103           H        LYS 103 -21.911  33.502 -10.696
  752    HA   LYS 103           HA       LYS 103 -24.594  34.475  -9.850
  753   1HB   LYS 103          HB2       LYS 103 -21.952  35.896 -10.416
  754   2HB   LYS 103          HB3       LYS 103 -23.497  36.735 -10.201
  755   1HG   LYS 103          HG2       LYS 103 -23.810  35.849  -7.992
  756   2HG   LYS 103          HG3       LYS 103 -22.345  34.884  -8.084
  757   1HD   LYS 103          HD2       LYS 103 -22.359  37.911  -8.333
  758   2HD   LYS 103          HD3       LYS 103 -22.253  37.109  -6.758
  759   1HE   LYS 103          HE2       LYS 103 -20.304  36.535  -9.031
  760   2HE   LYS 103          HE3       LYS 103 -20.053  37.868  -7.914
  761   1HZ   LYS 103          HZ1       LYS 103 -19.991  36.301  -6.076
  762   2HZ   LYS 103          HZ2       LYS 103 -20.318  35.019  -7.032
  763   3HZ   LYS 103          HZ3       LYS 103 -18.899  35.810  -7.175
  764    H    VAL 104           H        VAL 104 -25.951  33.920 -11.378
  765    HA   VAL 104           HA       VAL 104 -25.390  34.195 -14.258
  766    HB   VAL 104           HB       VAL 104 -27.911  33.334 -12.817
  767   1HG1  VAL 104          1HG1      VAL 104 -28.577  32.344 -14.931
  768   2HG1  VAL 104          2HG1      VAL 104 -28.262  34.044 -15.209
  769   3HG1  VAL 104          3HG1      VAL 104 -27.067  32.850 -15.716
  770   1HG2  VAL 104          1HG2      VAL 104 -26.083  31.778 -12.308
  771   2HG2  VAL 104          2HG2      VAL 104 -27.238  31.033 -13.396
  772   3HG2  VAL 104          3HG2      VAL 104 -25.682  31.630 -14.026
  773    H    PHE 105           H        PHE 105 -26.146  35.878 -15.604
  774    HA   PHE 105           HA       PHE 105 -27.766  38.019 -14.348
  775   1HB   PHE 105          HB2       PHE 105 -26.679  39.470 -15.951
  776   2HB   PHE 105          HB3       PHE 105 -25.597  38.790 -14.781
  777    HD1  PHE 105           HD1      PHE 105 -26.344  39.194 -18.334
  778    HD2  PHE 105           HD2      PHE 105 -23.925  37.064 -15.477
  779    HE1  PHE 105           HE1      PHE 105 -24.723  38.637 -20.118
  780    HE2  PHE 105           HE2      PHE 105 -22.334  36.435 -17.290
  781    HZ   PHE 105           HZ       PHE 105 -22.712  37.269 -19.603
  782    H    ALA 106           H        ALA 106 -29.562  38.784 -15.347
  783    HA   ALA 106           HA       ALA 106 -30.653  37.220 -17.638
  784   1HB   ALA 106          HB1       ALA 106 -32.835  37.851 -16.675
  785   2HB   ALA 106          HB2       ALA 106 -31.805  37.067 -15.473
  786   3HB   ALA 106          HB3       ALA 106 -31.999  38.843 -15.439
  787    H    LYS 107           H        LYS 107 -28.877  38.979 -18.542
  788    HA   LYS 107           HA       LYS 107 -28.374  40.762 -19.826
  789   1HB   LYS 107          HB2       LYS 107 -31.294  40.505 -20.614
  790   2HB   LYS 107          HB3       LYS 107 -30.138  41.517 -21.462
  791   1HG   LYS 107          HG2       LYS 107 -29.799  38.501 -21.127
  792   2HG   LYS 107          HG3       LYS 107 -30.559  39.276 -22.524
  793   1HD   LYS 107          HD2       LYS 107 -27.680  39.569 -21.630
  794   2HD   LYS 107          HD3       LYS 107 -28.235  38.676 -23.028
  795   1HE   LYS 107          HE2       LYS 107 -28.389  41.713 -22.709
  796   2HE   LYS 107          HE3       LYS 107 -27.233  40.826 -23.677
  797   1HZ   LYS 107          HZ1       LYS 107 -29.061  41.656 -25.034
  798   2HZ   LYS 107          HZ2       LYS 107 -29.067  40.041 -25.071
  799   3HZ   LYS 107          HZ3       LYS 107 -30.162  40.820 -24.153
  Start of MODEL    4
    1   1H    GLY   1          H1        GLY   1  -7.856   1.386   5.810
    2   2H    GLY   1          H2        GLY   1  -6.943   0.020   5.955
    3   3H    GLY   1          H3        GLY   1  -7.075   1.047   7.221
    4   1HA   GLY   1          HA2       GLY   1  -4.924   1.339   6.227
    5   2HA   GLY   1          HA3       GLY   1  -5.699   1.673   4.680
    6    H    LYS   2           H        LYS   2  -3.927   3.407   6.083
    7    HA   LYS   2           HA       LYS   2  -5.367   5.908   5.949
    8   1HB   LYS   2          HB2       LYS   2  -4.967   6.665   8.268
    9   2HB   LYS   2          HB3       LYS   2  -6.089   5.305   8.222
   10   1HG   LYS   2          HG2       LYS   2  -4.315   3.749   8.917
   11   2HG   LYS   2          HG3       LYS   2  -3.136   5.050   8.906
   12   1HD   LYS   2          HD2       LYS   2  -4.438   6.271  10.652
   13   2HD   LYS   2          HD3       LYS   2  -5.608   4.956  10.708
   14   1HE   LYS   2          HE2       LYS   2  -2.644   4.689  11.337
   15   2HE   LYS   2          HE3       LYS   2  -3.899   4.949  12.551
   16   1HZ   LYS   2          HZ1       LYS   2  -4.873   2.825  11.953
   17   2HZ   LYS   2          HZ2       LYS   2  -3.793   2.564  10.746
   18   3HZ   LYS   2          HZ3       LYS   2  -3.294   2.601  12.290
   19    H    ASP   3           H        ASP   3  -3.938   7.788   6.557
   20    HA   ASP   3           HA       ASP   3  -1.367   7.497   5.149
   21   1HB   ASP   3          HB2       ASP   3  -2.713   9.425   4.767
   22   2HB   ASP   3          HB3       ASP   3  -2.872   9.775   6.468
   23    H    ILE   4           H        ILE   4  -2.285   7.320   8.473
   24    HA   ILE   4           HA       ILE   4   0.127   8.466   9.561
   25    HB   ILE   4           HB       ILE   4  -1.985   6.826  11.016
   26   1HG1  ILE   4          2HG1      ILE   4  -3.184   8.611   9.824
   27   2HG1  ILE   4          3HG1      ILE   4  -3.156   8.937  11.545
   28   1HG2  ILE   4          1HG2      ILE   4  -0.065   7.196  12.437
   29   2HG2  ILE   4          2HG2      ILE   4   0.037   8.908  11.987
   30   3HG2  ILE   4          3HG2      ILE   4  -1.324   8.334  12.954
   31   1HD1  ILE   4          1HD1      ILE   4  -2.807  10.981  10.313
   32   2HD1  ILE   4          2HD1      ILE   4  -1.301  10.606  11.156
   33   3HD1  ILE   4          3HD1      ILE   4  -1.434  10.287   9.416
   34    H    GLN   5           H        GLN   5  -0.786   5.158   8.821
   35    HA   GLN   5           HA       GLN   5   1.869   4.256   9.771
   36   1HB   GLN   5          HB2       GLN   5  -0.807   2.876  10.333
   37   2HB   GLN   5          HB3       GLN   5   0.757   2.150  10.670
   38   1HG   GLN   5          HG2       GLN   5   1.292   3.969  12.264
   39   2HG   GLN   5          HG3       GLN   5  -0.311   4.646  11.998
   40   1HE2  GLN   5          1HE2      GLN   5   0.019   1.818  14.760
   41   2HE2  GLN   5          2HE2      GLN   5   1.405   2.669  14.093
   42    H    VAL   6           H        VAL   6   0.602   4.726   7.158
   43    HA   VAL   6           HA       VAL   6   1.868   2.500   5.705
   44    HB   VAL   6           HB       VAL   6  -1.090   3.040   5.187
   45   1HG1  VAL   6          1HG1      VAL   6   0.890   1.123   3.872
   46   2HG1  VAL   6          2HG1      VAL   6  -0.865   1.166   3.556
   47   3HG1  VAL   6          3HG1      VAL   6   0.134   2.534   3.096
   48   1HG2  VAL   6          1HG2      VAL   6   0.254   0.551   6.304
   49   2HG2  VAL   6          2HG2      VAL   6  -0.940   1.624   7.116
   50   3HG2  VAL   6          3HG2      VAL   6  -1.450   0.670   5.751
   51    H    ILE   7           H        ILE   7   3.278   3.839   4.698
   52    HA   ILE   7           HA       ILE   7   2.447   6.500   3.797
   53    HB   ILE   7           HB       ILE   7   5.214   5.331   3.486
   54   1HG1  ILE   7          2HG1      ILE   7   4.743   5.177   5.862
   55   2HG1  ILE   7          3HG1      ILE   7   5.833   6.501   5.543
   56   1HG2  ILE   7          1HG2      ILE   7   4.009   8.130   3.500
   57   2HG2  ILE   7          2HG2      ILE   7   5.764   7.794   3.487
   58   3HG2  ILE   7          3HG2      ILE   7   4.734   7.280   2.135
   59   1HD1  ILE   7          1HD1      ILE   7   4.245   7.114   7.247
   60   2HD1  ILE   7          2HD1      ILE   7   3.895   8.094   5.825
   61   3HD1  ILE   7          3HD1      ILE   7   2.856   6.681   6.217
   62    H    VAL   8           H        VAL   8   0.964   5.843   2.412
   63    HA   VAL   8           HA       VAL   8   1.630   5.539  -0.414
   64    HB   VAL   8           HB       VAL   8  -0.165   3.431   0.903
   65   1HG1  VAL   8          1HG1      VAL   8   0.782   3.725  -1.979
   66   2HG1  VAL   8          2HG1      VAL   8  -0.200   2.375  -1.333
   67   3HG1  VAL   8          3HG1      VAL   8  -0.880   3.961  -1.399
   68   1HG2  VAL   8          1HG2      VAL   8   2.574   3.044  -0.330
   69   2HG2  VAL   8          2HG2      VAL   8   2.104   2.780   1.375
   70   3HG2  VAL   8          3HG2      VAL   8   1.467   1.729   0.142
   71    H    ASN   9           H        ASN   9  -0.807   5.666   2.150
   72    HA   ASN   9           HA       ASN   9  -2.922   6.681   0.455
   73   1HB   ASN   9          HB2       ASN   9  -2.690   6.546   3.498
   74   2HB   ASN   9          HB3       ASN   9  -4.180   6.828   2.587
   75   1HD2  ASN   9          1HD2      ASN   9  -2.937   3.036   3.136
   76   2HD2  ASN   9          2HD2      ASN   9  -2.328   4.420   4.074
   77    H    VAL  10           H        VAL  10  -4.108   8.693   0.914
   78    HA   VAL  10           HA       VAL  10  -2.523  11.036   1.758
   79    HB   VAL  10           HB       VAL  10  -3.723  10.824  -1.013
   80   1HG1  VAL  10          1HG1      VAL  10  -3.771  13.098  -0.136
   81   2HG1  VAL  10          2HG1      VAL  10  -2.060  13.020   0.313
   82   3HG1  VAL  10          3HG1      VAL  10  -2.557  12.970  -1.383
   83   1HG2  VAL  10          1HG2      VAL  10  -1.405  11.031  -1.859
   84   2HG2  VAL  10          2HG2      VAL  10  -0.783  10.854  -0.215
   85   3HG2  VAL  10          3HG2      VAL  10  -1.647   9.514  -1.031
   86    HA   PRO  11           HA       PRO  11  -6.775  11.905   3.206
   87   1HB   PRO  11          HB2       PRO  11  -5.556  14.656   3.524
   88   2HB   PRO  11          HB3       PRO  11  -6.592  13.747   4.681
   89   1HG   PRO  11          HG2       PRO  11  -3.908  13.915   5.024
   90   2HG   PRO  11          HG3       PRO  11  -4.770  12.365   5.311
   91   1HD   PRO  11          HD2       PRO  11  -3.178  13.225   2.893
   92   2HD   PRO  11          HD3       PRO  11  -3.185  11.636   3.764
   93    HA   PRO  12           HA       PRO  12  -8.585  13.898  -0.314
   94   1HB   PRO  12          HB2       PRO  12 -10.502  15.418   1.430
   95   2HB   PRO  12          HB3       PRO  12 -10.850  14.266   0.109
   96   1HG   PRO  12          HG2       PRO  12 -11.184  13.538   2.692
   97   2HG   PRO  12          HG3       PRO  12 -10.517  12.406   1.480
   98   1HD   PRO  12          HD2       PRO  12  -9.020  14.176   3.458
   99   2HD   PRO  12          HD3       PRO  12  -8.806  12.442   3.180
  100    H    SER  13           H        SER  13  -8.608  15.837  -1.473
  101    HA   SER  13           HA       SER  13  -7.595  18.324  -0.187
  102   1HB   SER  13          HB2       SER  13  -5.779  16.759  -1.080
  103   2HB   SER  13          HB3       SER  13  -6.376  17.153  -2.697
  104    HG   SER  13           HG       SER  13  -4.697  18.531  -2.011
  105    H    VAL  14           H        VAL  14 -10.221  18.248  -0.732
  106    HA   VAL  14           HA       VAL  14 -10.720  19.254  -3.426
  107    HB   VAL  14           HB       VAL  14 -12.458  17.985  -2.207
  108   1HG1  VAL  14          1HG1      VAL  14 -12.313  19.163   0.023
  109   2HG1  VAL  14          2HG1      VAL  14 -13.099  20.592  -0.736
  110   3HG1  VAL  14          3HG1      VAL  14 -13.931  19.040  -0.650
  111   1HG2  VAL  14          1HG2      VAL  14 -12.913  19.423  -4.199
  112   2HG2  VAL  14          2HG2      VAL  14 -14.302  19.255  -3.096
  113   3HG2  VAL  14          3HG2      VAL  14 -13.365  20.759  -3.117
  114    H    ARG  15           H        ARG  15 -10.592  21.116  -4.149
  115    HA   ARG  15           HA       ARG  15 -10.326  23.566  -2.415
  116   1HB   ARG  15          HB2       ARG  15  -8.642  22.577  -4.703
  117   2HB   ARG  15          HB3       ARG  15  -8.680  24.291  -4.319
  118   1HG   ARG  15          HG2       ARG  15  -7.583  24.034  -2.289
  119   2HG   ARG  15          HG3       ARG  15  -8.100  22.357  -2.059
  120   1HD   ARG  15          HD2       ARG  15  -6.101  23.269  -4.172
  121   2HD   ARG  15          HD3       ARG  15  -5.652  22.607  -2.602
  122    HE   ARG  15           HE       ARG  15  -7.290  20.655  -3.478
  123   1HH1  ARG  15          1HH1      ARG  15  -7.079  18.998  -4.687
  124   2HH1  ARG  15          2HH1      ARG  15  -5.803  18.850  -5.882
  125   1HH2  ARG  15          1HH2      ARG  15  -4.561  22.022  -5.246
  126   2HH2  ARG  15          2HH2      ARG  15  -4.411  20.562  -6.200
  127    H    ALA  16           H        ALA  16 -10.596  25.541  -3.824
  128    HA   ALA  16           HA       ALA  16 -12.937  25.234  -5.660
  129   1HB   ALA  16          HB1       ALA  16 -11.644  27.677  -4.364
  130   2HB   ALA  16          HB2       ALA  16 -13.019  27.718  -5.500
  131   3HB   ALA  16          HB3       ALA  16 -13.207  26.904  -3.921
  132    H    ARG  17           H        ARG  17 -12.566  25.093  -7.810
  133    HA   ARG  17           HA       ARG  17  -9.951  25.688  -8.972
  134   1HB   ARG  17          HB2       ARG  17 -11.559  23.919  -9.763
  135   2HB   ARG  17          HB3       ARG  17 -12.537  25.193 -10.516
  136   1HG   ARG  17          HG2       ARG  17 -10.568  25.923 -11.841
  137   2HG   ARG  17          HG3       ARG  17  -9.601  24.629 -11.106
  138   1HD   ARG  17          HD2       ARG  17 -12.104  24.204 -12.810
  139   2HD   ARG  17          HD3       ARG  17 -10.483  24.205 -13.437
  140    HE   ARG  17           HE       ARG  17 -11.810  22.082 -11.940
  141   1HH1  ARG  17          1HH1      ARG  17  -8.609  23.183 -12.894
  142   2HH1  ARG  17          2HH1      ARG  17  -7.937  21.577 -12.669
  143   1HH2  ARG  17          1HH2      ARG  17  -9.167  19.924 -12.071
  144   2HH2  ARG  17          2HH2      ARG  17 -10.872  20.084 -11.780
  145    H    GLN  18           H        GLN  18 -12.925  27.466  -8.621
  146    HA   GLN  18           HA       GLN  18 -11.556  30.035  -9.110
  147   1HB   GLN  18          HB2       GLN  18 -14.044  29.124 -10.687
  148   2HB   GLN  18          HB3       GLN  18 -13.625  30.825 -10.413
  149   1HG   GLN  18          HG2       GLN  18 -11.449  30.490 -11.565
  150   2HG   GLN  18          HG3       GLN  18 -11.907  28.814 -11.901
  151   1HE2  GLN  18          1HE2      GLN  18 -13.819  31.860 -13.960
  152   2HE2  GLN  18          2HE2      GLN  18 -13.183  32.200 -12.367
  153    H    SER  19           H        SER  19 -12.387  31.520  -7.576
  154    HA   SER  19           HA       SER  19 -14.124  30.440  -5.517
  155   1HB   SER  19          HB2       SER  19 -13.031  33.257  -5.780
  156   2HB   SER  19          HB3       SER  19 -13.644  32.491  -4.308
  157    HG   SER  19           HG       SER  19 -11.342  32.441  -4.460
  158    H    THR  20           H        THR  20 -14.666  32.545  -8.240
  159    HA   THR  20           HA       THR  20 -17.575  32.630  -7.709
  160    HB   THR  20           HB       THR  20 -15.913  35.131  -8.222
  161    HG1  THR  20           HG1      THR  20 -16.655  35.748  -6.253
  162   1HG2  THR  20          1HG2      THR  20 -17.974  35.319  -9.550
  163   2HG2  THR  20          2HG2      THR  20 -18.939  34.787  -8.144
  164   3HG2  THR  20          3HG2      THR  20 -18.089  36.327  -8.107
  165    H    MET  21           H        MET  21 -18.674  32.323  -9.527
  166    HA   MET  21           HA       MET  21 -17.472  32.848 -12.207
  167   1HB   MET  21          HB2       MET  21 -18.904  30.295 -11.338
  168   2HB   MET  21          HB3       MET  21 -18.517  30.730 -13.025
  169   1HG   MET  21          HG2       MET  21 -16.117  30.966 -12.317
  170   2HG   MET  21          HG3       MET  21 -16.568  30.261 -10.765
  171   1HE   MET  21          HE1       MET  21 -16.320  29.843 -14.587
  172   2HE   MET  21          HE2       MET  21 -16.360  28.100 -14.846
  173   3HE   MET  21          HE3       MET  21 -17.860  28.968 -14.480
  174    H    ASN  22           H        ASN  22 -19.394  32.435 -13.880
  175    HA   ASN  22           HA       ASN  22 -21.964  33.523 -13.078
  176   1HB   ASN  22          HB2       ASN  22 -21.687  35.652 -14.319
  177   2HB   ASN  22          HB3       ASN  22 -20.645  35.546 -12.917
  178   1HD2  ASN  22          1HD2      ASN  22 -18.894  35.711 -16.611
  179   2HD2  ASN  22          2HD2      ASN  22 -20.613  35.354 -16.491
  180    H    ALA  23           H        ALA  23 -23.282  34.124 -15.112
  181    HA   ALA  23           HA       ALA  23 -22.584  32.799 -17.607
  182   1HB   ALA  23          HB1       ALA  23 -24.761  31.610 -15.826
  183   2HB   ALA  23          HB2       ALA  23 -24.378  31.072 -17.489
  184   3HB   ALA  23          HB3       ALA  23 -23.216  30.829 -16.182
  185    H    THR  24           H        THR  24 -24.137  33.150 -19.254
  186    HA   THR  24           HA       THR  24 -26.046  35.376 -18.720
  187    HB   THR  24           HB       THR  24 -25.231  34.322 -21.421
  188    HG1  THR  24           HG1      THR  24 -23.388  35.138 -20.477
  189   1HG2  THR  24          1HG2      THR  24 -27.286  35.654 -21.461
  190   2HG2  THR  24          2HG2      THR  24 -26.503  36.909 -20.451
  191   3HG2  THR  24          3HG2      THR  24 -25.951  36.601 -22.107
  192    H    ALA  25           H        ALA  25 -27.973  34.671 -18.120
  193    HA   ALA  25           HA       ALA  25 -29.171  32.138 -18.954
  194   1HB   ALA  25          HB1       ALA  25 -30.139  34.512 -17.276
  195   2HB   ALA  25          HB2       ALA  25 -31.069  33.043 -17.555
  196   3HB   ALA  25          HB3       ALA  25 -29.487  32.944 -16.729
  197    H    ASN  26           H        ASN  26 -31.597  32.253 -19.694
  198    HA   ASN  26           HA       ASN  26 -33.073  32.509 -21.320
  199   1HB   ASN  26          HB2       ASN  26 -32.032  35.323 -21.730
  200   2HB   ASN  26          HB3       ASN  26 -33.559  34.670 -22.286
  201   1HD2  ASN  26          1HD2      ASN  26 -35.202  34.856 -19.135
  202   2HD2  ASN  26          2HD2      ASN  26 -35.224  34.067 -20.705
  203    H    LEU  27           H        LEU  27 -29.810  32.511 -22.108
  204    HA   LEU  27           HA       LEU  27 -30.231  32.208 -25.028
  205   1HB   LEU  27          HB2       LEU  27 -27.673  32.152 -23.365
  206   2HB   LEU  27          HB3       LEU  27 -27.761  32.124 -25.116
  207    HG   LEU  27           HG       LEU  27 -28.592  34.436 -23.322
  208   1HD1  LEU  27          1HD1      LEU  27 -26.156  34.085 -23.575
  209   2HD1  LEU  27          2HD1      LEU  27 -26.329  34.147 -25.338
  210   3HD1  LEU  27          3HD1      LEU  27 -26.698  35.570 -24.383
  211   1HD2  LEU  27          1HD2      LEU  27 -30.038  34.434 -25.276
  212   2HD2  LEU  27          2HD2      LEU  27 -28.841  35.722 -25.428
  213   3HD2  LEU  27          3HD2      LEU  27 -28.642  34.225 -26.357
  214    H    SER  28           H        SER  28 -30.317  30.141 -22.346
  215    HA   SER  28           HA       SER  28 -30.157  27.937 -22.012
  216   1HB   SER  28          HB2       SER  28 -30.843  27.758 -24.982
  217   2HB   SER  28          HB3       SER  28 -31.028  26.469 -23.803
  218    HG   SER  28           HG       SER  28 -32.976  27.665 -24.166
  219    H    GLN  29           H        GLN  29 -27.683  29.092 -22.367
  220    HA   GLN  29           HA       GLN  29 -25.949  27.393 -24.027
  221   1HB   GLN  29          HB2       GLN  29 -25.447  29.596 -22.001
  222   2HB   GLN  29          HB3       GLN  29 -24.145  28.763 -22.835
  223   1HG   GLN  29          HG2       GLN  29 -25.049  29.369 -25.009
  224   2HG   GLN  29          HG3       GLN  29 -26.369  30.273 -24.242
  225   1HE2  GLN  29          1HE2      GLN  29 -23.387  32.522 -25.165
  226   2HE2  GLN  29          2HE2      GLN  29 -24.171  31.261 -26.089
  227    H    SER  30           H        SER  30 -23.884  26.522 -22.970
  228    HA   SER  30           HA       SER  30 -24.474  25.035 -20.463
  229   1HB   SER  30          HB2       SER  30 -22.900  23.322 -21.271
  230   2HB   SER  30          HB3       SER  30 -24.282  23.494 -22.337
  231    HG   SER  30           HG       SER  30 -22.253  23.375 -23.472
  232    H    VAL  31           H        VAL  31 -22.840  24.785 -19.000
  233    HA   VAL  31           HA       VAL  31 -20.427  26.551 -19.249
  234    HB   VAL  31           HB       VAL  31 -22.376  26.793 -16.919
  235   1HG1  VAL  31          1HG1      VAL  31 -20.108  27.137 -16.104
  236   2HG1  VAL  31          2HG1      VAL  31 -19.728  28.174 -17.482
  237   3HG1  VAL  31          3HG1      VAL  31 -20.888  28.729 -16.281
  238   1HG2  VAL  31          1HG2      VAL  31 -22.700  29.139 -17.675
  239   2HG2  VAL  31          2HG2      VAL  31 -21.697  28.812 -19.108
  240   3HG2  VAL  31          3HG2      VAL  31 -23.276  28.005 -18.863
  241    H    THR  32           H        THR  32 -18.639  25.672 -18.258
  242    HA   THR  32           HA       THR  32 -18.981  23.295 -16.489
  243    HB   THR  32           HB       THR  32 -16.453  24.179 -17.913
  244    HG1  THR  32           HG1      THR  32 -18.093  23.539 -19.348
  245   1HG2  THR  32          1HG2      THR  32 -15.981  22.751 -15.982
  246   2HG2  THR  32          2HG2      THR  32 -17.234  21.616 -16.481
  247   3HG2  THR  32          3HG2      THR  32 -15.787  21.853 -17.467
  248    H    LEU  33           H        LEU  33 -18.193  23.324 -14.430
  249    HA   LEU  33           HA       LEU  33 -16.436  25.428 -13.383
  250   1HB   LEU  33          HB2       LEU  33 -18.069  26.181 -11.690
  251   2HB   LEU  33          HB3       LEU  33 -18.529  26.577 -13.332
  252    HG   LEU  33           HG       LEU  33 -20.115  24.529 -13.266
  253   1HD1  LEU  33          1HD1      LEU  33 -20.939  24.027 -10.909
  254   2HD1  LEU  33          2HD1      LEU  33 -19.334  23.385 -11.249
  255   3HD1  LEU  33          3HD1      LEU  33 -19.486  24.853 -10.283
  256   1HD2  LEU  33          1HD2      LEU  33 -21.807  25.862 -12.008
  257   2HD2  LEU  33          2HD2      LEU  33 -20.495  26.916 -11.432
  258   3HD2  LEU  33          3HD2      LEU  33 -20.882  26.853 -13.140
  259    H    ALA  34           H        ALA  34 -15.855  24.906 -10.976
  260    HA   ALA  34           HA       ALA  34 -16.249  22.061 -10.366
  261   1HB   ALA  34          HB1       ALA  34 -14.604  22.192 -12.387
  262   2HB   ALA  34          HB2       ALA  34 -13.519  23.059 -11.307
  263   3HB   ALA  34          HB3       ALA  34 -13.970  21.377 -10.946
  264    H    CYS  35           H        CYS  35 -15.501  21.261  -8.570
  265    HA   CYS  35           HA       CYS  35 -13.845  22.911  -6.695
  266   1HB   CYS  35          HB2       CYS  35 -16.110  20.977  -6.170
  267   2HB   CYS  35          HB3       CYS  35 -14.808  21.194  -4.998
  268    H    ASP  36           H        ASP  36 -11.814  22.161  -7.113
  269    HA   ASP  36           HA       ASP  36 -11.431  19.603  -8.382
  270   1HB   ASP  36          HB2       ASP  36  -9.145  20.217  -8.681
  271   2HB   ASP  36          HB3       ASP  36 -10.268  21.446  -9.245
  272    H    ALA  37           H        ALA  37 -12.248  18.239  -6.786
  273    HA   ALA  37           HA       ALA  37 -10.730  17.590  -4.408
  274   1HB   ALA  37          HB1       ALA  37 -13.189  17.134  -4.680
  275   2HB   ALA  37          HB2       ALA  37 -12.783  15.907  -5.923
  276   3HB   ALA  37          HB3       ALA  37 -12.265  15.687  -4.237
  277    H    ASP  38           H        ASP  38  -9.445  15.917  -3.970
  278    HA   ASP  38           HA       ASP  38  -8.731  13.794  -5.821
  279   1HB   ASP  38          HB2       ASP  38  -7.319  15.727  -6.632
  280   2HB   ASP  38          HB3       ASP  38  -6.751  15.977  -5.007
  281    H    GLY  39           H        GLY  39  -7.120  12.321  -4.683
  282   1HA   GLY  39          HA2       GLY  39  -6.221  12.425  -2.055
  283   2HA   GLY  39          HA3       GLY  39  -7.865  11.800  -1.948
  284    H    PHE  40           H        PHE  40  -6.034  10.099  -1.036
  285    HA   PHE  40           HA       PHE  40  -6.266   7.950  -3.019
  286   1HB   PHE  40          HB2       PHE  40  -4.015   8.928  -3.340
  287   2HB   PHE  40          HB3       PHE  40  -3.561   8.268  -1.785
  288    HD1  PHE  40           HD1      PHE  40  -4.281   7.563  -5.298
  289    HD2  PHE  40           HD2      PHE  40  -3.599   5.752  -1.448
  290    HE1  PHE  40           HE1      PHE  40  -3.868   5.387  -6.400
  291    HE2  PHE  40           HE2      PHE  40  -3.275   3.545  -2.540
  292    HZ   PHE  40           HZ       PHE  40  -3.398   3.359  -5.000
  293    HA   PRO  41           HA       PRO  41  -7.108   5.932  -3.059
  294   1HB   PRO  41          HB2       PRO  41  -9.548   4.900  -2.329
  295   2HB   PRO  41          HB3       PRO  41  -7.990   4.027  -2.154
  296   1HG   PRO  41          HG2       PRO  41  -9.469   5.674  -0.052
  297   2HG   PRO  41          HG3       PRO  41  -8.812   4.003   0.110
  298   1HD   PRO  41          HD2       PRO  41  -7.412   6.155   0.988
  299   2HD   PRO  41          HD3       PRO  41  -6.556   4.802   0.172
  300    H    GLU  42           H        GLU  42  -8.780   6.632  -4.445
  301    HA   GLU  42           HA       GLU  42  -9.431   9.230  -4.661
  302   1HB   GLU  42          HB2       GLU  42 -11.295   8.622  -6.161
  303   2HB   GLU  42          HB3       GLU  42  -9.836   7.673  -6.432
  304   1HG   GLU  42          HG2       GLU  42 -10.842   5.791  -5.098
  305   2HG   GLU  42          HG3       GLU  42 -12.346   6.719  -5.011
  306    HA   PRO  43           HA       PRO  43 -12.005  10.125  -1.277
  307   1HB   PRO  43          HB2       PRO  43 -12.776  12.698  -1.712
  308   2HB   PRO  43          HB3       PRO  43 -11.051  12.246  -1.443
  309   1HG   PRO  43          HG2       PRO  43 -12.479  12.639  -4.063
  310   2HG   PRO  43          HG3       PRO  43 -10.937  13.378  -3.572
  311   1HD   PRO  43          HD2       PRO  43 -10.994  11.132  -5.098
  312   2HD   PRO  43          HD3       PRO  43  -9.766  11.319  -3.818
  313    H    THR  44           H        THR  44 -14.005  10.483  -0.481
  314    HA   THR  44           HA       THR  44 -16.386  10.085  -2.294
  315    HB   THR  44           HB       THR  44 -16.184   9.942   0.751
  316    HG1  THR  44           HG1      THR  44 -16.258   7.945  -1.260
  317   1HG2  THR  44          1HG2      THR  44 -18.460   9.229  -1.163
  318   2HG2  THR  44          2HG2      THR  44 -18.427   8.846   0.574
  319   3HG2  THR  44          3HG2      THR  44 -18.453  10.537   0.010
  320    H    MET  45           H        MET  45 -17.012  12.068  -3.096
  321    HA   MET  45           HA       MET  45 -17.124  14.345  -1.187
  322   1HB   MET  45          HB2       MET  45 -16.123  15.793  -2.709
  323   2HB   MET  45          HB3       MET  45 -15.113  14.360  -2.707
  324   1HG   MET  45          HG2       MET  45 -15.159  14.877  -4.924
  325   2HG   MET  45          HG3       MET  45 -16.408  13.642  -4.808
  326   1HE   MET  45          HE1       MET  45 -15.499  17.378  -5.653
  327   2HE   MET  45          HE2       MET  45 -17.090  18.166  -5.552
  328   3HE   MET  45          HE3       MET  45 -16.307  17.572  -4.081
  329    H    THR  46           H        THR  46 -18.674  15.880  -1.416
  330    HA   THR  46           HA       THR  46 -20.675  15.779  -3.549
  331    HB   THR  46           HB       THR  46 -22.593  15.841  -1.998
  332    HG1  THR  46           HG1      THR  46 -22.268  15.035   0.105
  333   1HG2  THR  46          1HG2      THR  46 -21.078  13.245  -1.675
  334   2HG2  THR  46          2HG2      THR  46 -22.840  13.509  -1.583
  335   3HG2  THR  46          3HG2      THR  46 -21.961  13.716  -3.131
  336    H    TRP  47           H        TRP  47 -22.304  17.608  -3.203
  337    HA   TRP  47           HA       TRP  47 -21.322  19.915  -1.710
  338   1HB   TRP  47          HB2       TRP  47 -21.027  21.336  -3.789
  339   2HB   TRP  47          HB3       TRP  47 -19.779  20.200  -3.346
  340    HD1  TRP  47           HD1      TRP  47 -20.237  17.642  -4.905
  341    HE1  TRP  47           HE1      TRP  47 -19.343  17.698  -7.257
  342    HE3  TRP  47           HE3      TRP  47 -20.756  22.665  -5.832
  343    HZ2  TRP  47           HZ2      TRP  47 -18.602  19.685  -9.205
  344    HZ3  TRP  47           HZ3      TRP  47 -19.773  23.616  -7.903
  345    HH2  TRP  47           HH2      TRP  47 -18.658  22.149  -9.562
  346    H    THR  48           H        THR  48 -22.656  21.855  -1.930
  347    HA   THR  48           HA       THR  48 -25.478  21.025  -2.412
  348    HB   THR  48           HB       THR  48 -26.150  22.449  -0.571
  349    HG1  THR  48           HG1      THR  48 -24.561  23.383   0.737
  350   1HG2  THR  48          1HG2      THR  48 -25.209  21.151   1.267
  351   2HG2  THR  48          2HG2      THR  48 -25.415  20.076  -0.136
  352   3HG2  THR  48          3HG2      THR  48 -23.800  20.688   0.269
  353    H    LYS  49           H        LYS  49 -26.979  22.294  -3.287
  354    HA   LYS  49           HA       LYS  49 -26.119  24.696  -4.807
  355   1HB   LYS  49          HB2       LYS  49 -27.337  22.610  -5.716
  356   2HB   LYS  49          HB3       LYS  49 -28.783  23.206  -4.938
  357   1HG   LYS  49          HG2       LYS  49 -27.130  24.688  -7.046
  358   2HG   LYS  49          HG3       LYS  49 -28.574  23.711  -7.378
  359   1HD   LYS  49          HD2       LYS  49 -29.875  25.304  -5.864
  360   2HD   LYS  49          HD3       LYS  49 -28.460  26.373  -5.845
  361   1HE   LYS  49          HE2       LYS  49 -28.498  26.474  -8.330
  362   2HE   LYS  49          HE3       LYS  49 -29.877  25.366  -8.354
  363   1HZ   LYS  49          HZ1       LYS  49 -30.765  27.537  -8.528
  364   2HZ   LYS  49          HZ2       LYS  49 -31.055  27.097  -6.969
  365   3HZ   LYS  49          HZ3       LYS  49 -29.820  28.133  -7.318
  366    H    ASP  50           H        ASP  50 -25.820  25.727  -2.697
  367    HA   ASP  50           HA       ASP  50 -26.326  27.276  -1.124
  368   1HB   ASP  50          HB2       ASP  50 -27.815  28.280  -2.855
  369   2HB   ASP  50          HB3       ASP  50 -29.164  27.364  -2.166
  370    H    GLY  51           H        GLY  51 -28.096  24.305  -1.277
  371   1HA   GLY  51          HA2       GLY  51 -27.761  23.773   1.467
  372   2HA   GLY  51          HA3       GLY  51 -29.438  24.300   1.245
  373    H    GLU  52           H        GLU  52 -29.533  22.954  -1.523
  374    HA   GLU  52           HA       GLU  52 -30.076  20.254  -0.459
  375   1HB   GLU  52          HB2       GLU  52 -31.525  19.941  -2.383
  376   2HB   GLU  52          HB3       GLU  52 -31.912  21.397  -1.508
  377   1HG   GLU  52          HG2       GLU  52 -30.723  22.768  -3.254
  378   2HG   GLU  52          HG3       GLU  52 -30.353  21.271  -4.134
  379    HA   PRO  53           HA       PRO  53 -26.532  18.562  -2.297
  380   1HB   PRO  53          HB2       PRO  53 -27.969  16.057  -3.065
  381   2HB   PRO  53          HB3       PRO  53 -26.539  16.265  -1.993
  382   1HG   PRO  53          HG2       PRO  53 -29.021  15.761  -0.968
  383   2HG   PRO  53          HG3       PRO  53 -27.926  16.954  -0.185
  384   1HD   PRO  53          HD2       PRO  53 -30.235  17.492  -2.079
  385   2HD   PRO  53          HD3       PRO  53 -29.819  18.252  -0.498
  386    H    ILE  54           H        ILE  54 -25.334  18.443  -4.011
  387    HA   ILE  54           HA       ILE  54 -26.399  18.176  -6.776
  388    HB   ILE  54           HB       ILE  54 -23.709  19.203  -5.832
  389   1HG1  ILE  54          2HG1      ILE  54 -26.050  20.927  -6.799
  390   2HG1  ILE  54          3HG1      ILE  54 -25.781  20.646  -5.097
  391   1HG2  ILE  54          1HG2      ILE  54 -25.089  19.655  -8.533
  392   2HG2  ILE  54          2HG2      ILE  54 -23.486  20.209  -8.074
  393   3HG2  ILE  54          3HG2      ILE  54 -23.764  18.483  -8.282
  394   1HD1  ILE  54          1HD1      ILE  54 -23.627  21.649  -5.129
  395   2HD1  ILE  54          2HD1      ILE  54 -23.683  21.920  -6.871
  396   3HD1  ILE  54          3HD1      ILE  54 -24.843  22.756  -5.833
  397    H    GLU  55           H        GLU  55 -26.465  15.981  -5.229
  398    HA   GLU  55           HA       GLU  55 -24.284  14.314  -4.955
  399   1HB   GLU  55          HB2       GLU  55 -26.013  12.455  -4.980
  400   2HB   GLU  55          HB3       GLU  55 -26.180  13.712  -3.761
  401   1HG   GLU  55          HG2       GLU  55 -27.975  14.773  -5.244
  402   2HG   GLU  55          HG3       GLU  55 -27.872  13.354  -6.291
  403    H    GLN  56           H        GLN  56 -22.996  13.171  -6.212
  404    HA   GLN  56           HA       GLN  56 -23.061  12.985  -8.991
  405   1HB   GLN  56          HB2       GLN  56 -21.812  11.126  -6.930
  406   2HB   GLN  56          HB3       GLN  56 -21.390  11.158  -8.637
  407   1HG   GLN  56          HG2       GLN  56 -20.643  13.545  -8.360
  408   2HG   GLN  56          HG3       GLN  56 -20.945  13.381  -6.608
  409   1HE2  GLN  56          1HE2      GLN  56 -17.757  11.955  -6.103
  410   2HE2  GLN  56          2HE2      GLN  56 -19.094  12.891  -5.406
  411    H    GLU  57           H        GLU  57 -24.923  11.067  -6.748
  412    HA   GLU  57           HA       GLU  57 -25.242   8.812  -8.626
  413   1HB   GLU  57          HB2       GLU  57 -26.131   9.284  -5.733
  414   2HB   GLU  57          HB3       GLU  57 -26.359   7.783  -6.626
  415   1HG   GLU  57          HG2       GLU  57 -23.899   7.588  -6.949
  416   2HG   GLU  57          HG3       GLU  57 -23.670   8.990  -5.910
  417    H    ASP  58           H        ASP  58 -26.938  11.657  -8.183
  418    HA   ASP  58           HA       ASP  58 -29.300  10.629  -9.610
  419   1HB   ASP  58          HB2       ASP  58 -29.698  10.103  -7.167
  420   2HB   ASP  58          HB3       ASP  58 -29.758  11.826  -6.860
  421    H    ASN  59           H        ASN  59 -27.448  13.390  -8.479
  422    HA   ASN  59           HA       ASN  59 -29.334  15.309  -9.676
  423   1HB   ASN  59          HB2       ASN  59 -27.990  15.880  -7.648
  424   2HB   ASN  59          HB3       ASN  59 -26.516  15.839  -8.626
  425   1HD2  ASN  59          1HD2      ASN  59 -27.110  18.975 -10.091
  426   2HD2  ASN  59          2HD2      ASN  59 -26.073  17.563 -10.000
  427    H    GLU  60           H        GLU  60 -29.417  14.190 -11.649
  428    HA   GLU  60           HA       GLU  60 -27.256  14.775 -13.654
  429   1HB   GLU  60          HB2       GLU  60 -29.211  12.458 -13.510
  430   2HB   GLU  60          HB3       GLU  60 -28.001  12.709 -14.770
  431   1HG   GLU  60          HG2       GLU  60 -26.181  12.490 -13.112
  432   2HG   GLU  60          HG3       GLU  60 -27.384  12.165 -11.833
  433    H    GLU  61           H        GLU  61 -30.195  15.977 -12.868
  434    HA   GLU  61           HA       GLU  61 -31.815  15.662 -15.132
  435   1HB   GLU  61          HB2       GLU  61 -31.750  17.991 -13.153
  436   2HB   GLU  61          HB3       GLU  61 -33.027  17.686 -14.312
  437   1HG   GLU  61          HG2       GLU  61 -32.221  15.719 -12.122
  438   2HG   GLU  61          HG3       GLU  61 -33.494  16.912 -11.974
  439    H    LYS  62           H        LYS  62 -29.275  18.045 -14.727
  440    HA   LYS  62           HA       LYS  62 -29.091  18.337 -17.580
  441   1HB   LYS  62          HB2       LYS  62 -29.478  20.688 -17.866
  442   2HB   LYS  62          HB3       LYS  62 -30.880  19.976 -17.122
  443   1HG   LYS  62          HG2       LYS  62 -29.759  20.855 -14.861
  444   2HG   LYS  62          HG3       LYS  62 -28.898  21.928 -15.992
  445   1HD   LYS  62          HD2       LYS  62 -31.325  22.374 -16.984
  446   2HD   LYS  62          HD3       LYS  62 -31.877  21.691 -15.437
  447   1HE   LYS  62          HE2       LYS  62 -31.811  24.019 -15.068
  448   2HE   LYS  62          HE3       LYS  62 -30.356  23.403 -14.286
  449   1HZ   LYS  62          HZ1       LYS  62 -29.778  25.289 -15.545
  450   2HZ   LYS  62          HZ2       LYS  62 -29.148  24.015 -16.383
  451   3HZ   LYS  62          HZ3       LYS  62 -30.488  24.752 -16.916
  452    H    TYR  63           H        TYR  63 -27.393  17.183 -15.959
  453    HA   TYR  63           HA       TYR  63 -25.015  18.873 -16.110
  454   1HB   TYR  63          HB2       TYR  63 -25.134  17.612 -13.480
  455   2HB   TYR  63          HB3       TYR  63 -24.635  19.252 -13.963
  456    HD1  TYR  63           HD1      TYR  63 -27.647  17.145 -13.171
  457    HD2  TYR  63           HD2      TYR  63 -25.940  21.093 -13.260
  458    HE1  TYR  63           HE1      TYR  63 -29.655  18.057 -12.008
  459    HE2  TYR  63           HE2      TYR  63 -27.958  22.009 -12.165
  460    HH   TYR  63           HH       TYR  63 -30.736  19.915 -11.225
  461    H    SER  64           H        SER  64 -23.034  17.828 -16.001
  462    HA   SER  64           HA       SER  64 -22.831  14.867 -15.845
  463   1HB   SER  64          HB2       SER  64 -21.953  16.437 -18.316
  464   2HB   SER  64          HB3       SER  64 -21.792  14.686 -18.047
  465    HG   SER  64           HG       SER  64 -24.047  14.507 -18.083
  466    H    PHE  65           H        PHE  65 -20.765  14.281 -15.098
  467    HA   PHE  65           HA       PHE  65 -18.644  16.296 -15.057
  468   1HB   PHE  65          HB2       PHE  65 -18.575  15.872 -12.615
  469   2HB   PHE  65          HB3       PHE  65 -20.158  16.430 -13.195
  470    HD1  PHE  65           HD1      PHE  65 -22.161  15.052 -12.893
  471    HD2  PHE  65           HD2      PHE  65 -18.257  13.485 -11.937
  472    HE1  PHE  65           HE1      PHE  65 -23.204  13.013 -11.909
  473    HE2  PHE  65           HE2      PHE  65 -19.304  11.442 -11.001
  474    HZ   PHE  65           HZ       PHE  65 -21.783  11.213 -11.004
  475    H    ASN  66           H        ASN  66 -16.654  15.504 -13.916
  476    HA   ASN  66           HA       ASN  66 -15.620  13.325 -15.579
  477   1HB   ASN  66          HB2       ASN  66 -13.464  14.270 -15.122
  478   2HB   ASN  66          HB3       ASN  66 -14.557  15.626 -15.358
  479   1HD2  ASN  66          1HD2      ASN  66 -12.622  16.645 -12.467
  480   2HD2  ASN  66          2HD2      ASN  66 -12.520  16.638 -14.234
  481    H    TYR  67           H        TYR  67 -13.549  12.220 -14.452
  482    HA   TYR  67           HA       TYR  67 -14.753  10.225 -12.752
  483   1HB   TYR  67          HB2       TYR  67 -11.881  10.507 -13.640
  484   2HB   TYR  67          HB3       TYR  67 -12.644   9.045 -13.012
  485    HD1  TYR  67           HD1      TYR  67 -11.813  10.955 -15.943
  486    HD2  TYR  67           HD2      TYR  67 -14.700   8.153 -14.381
  487    HE1  TYR  67           HE1      TYR  67 -12.448  10.321 -18.270
  488    HE2  TYR  67           HE2      TYR  67 -15.335   7.524 -16.751
  489    HH   TYR  67           HH       TYR  67 -13.710   8.943 -19.594
  490    H    ASP  68           H        ASP  68 -13.090  13.110 -11.876
  491    HA   ASP  68           HA       ASP  68 -12.245  12.157  -9.186
  492   1HB   ASP  68          HB2       ASP  68 -12.020  14.831 -10.593
  493   2HB   ASP  68          HB3       ASP  68 -11.410  14.514  -8.993
  494    H    GLY  69           H        GLY  69 -15.039  13.406 -10.749
  495   1HA   GLY  69          HA2       GLY  69 -17.115  13.972  -9.865
  496   2HA   GLY  69          HA3       GLY  69 -16.450  13.939  -8.238
  497    H    SER  70           H        SER  70 -14.430  15.825 -10.243
  498    HA   SER  70           HA       SER  70 -15.160  18.191  -8.665
  499   1HB   SER  70          HB2       SER  70 -13.041  19.062  -9.531
  500   2HB   SER  70          HB3       SER  70 -12.880  17.534  -8.680
  501    HG   SER  70           HG       SER  70 -11.640  17.432 -10.520
  502    H    GLU  71           H        GLU  71 -14.390  17.716 -12.135
  503    HA   GLU  71           HA       GLU  71 -15.501  20.314 -12.791
  504   1HB   GLU  71          HB2       GLU  71 -14.655  18.031 -14.610
  505   2HB   GLU  71          HB3       GLU  71 -15.095  19.630 -15.149
  506   1HG   GLU  71          HG2       GLU  71 -13.235  20.619 -13.969
  507   2HG   GLU  71          HG3       GLU  71 -12.798  19.093 -13.223
  508    H    LEU  72           H        LEU  72 -17.593  20.628 -12.452
  509    HA   LEU  72           HA       LEU  72 -19.602  18.704 -13.496
  510   1HB   LEU  72          HB2       LEU  72 -19.778  19.413 -11.132
  511   2HB   LEU  72          HB3       LEU  72 -19.814  21.096 -11.624
  512    HG   LEU  72           HG       LEU  72 -21.989  20.666 -12.839
  513   1HD1  LEU  72          1HD1      LEU  72 -21.842  18.285 -13.331
  514   2HD1  LEU  72          2HD1      LEU  72 -21.659  17.910 -11.579
  515   3HD1  LEU  72          3HD1      LEU  72 -23.183  18.538 -12.225
  516   1HD2  LEU  72          1HD2      LEU  72 -21.926  19.874  -9.915
  517   2HD2  LEU  72          2HD2      LEU  72 -21.965  21.520 -10.579
  518   3HD2  LEU  72          3HD2      LEU  72 -23.356  20.456 -10.816
  519    H    ILE  73           H        ILE  73 -20.149  18.984 -15.463
  520    HA   ILE  73           HA       ILE  73 -20.228  21.660 -16.767
  521    HB   ILE  73           HB       ILE  73 -20.900  18.935 -17.924
  522   1HG1  ILE  73          2HG1      ILE  73 -18.276  20.304 -18.565
  523   2HG1  ILE  73          3HG1      ILE  73 -18.373  19.321 -17.104
  524   1HG2  ILE  73          1HG2      ILE  73 -20.543  20.161 -20.101
  525   2HG2  ILE  73          2HG2      ILE  73 -21.862  20.833 -19.146
  526   3HG2  ILE  73          3HG2      ILE  73 -20.284  21.649 -19.184
  527   1HD1  ILE  73          1HD1      ILE  73 -19.083  18.308 -19.896
  528   2HD1  ILE  73          2HD1      ILE  73 -17.570  18.044 -19.009
  529   3HD1  ILE  73          3HD1      ILE  73 -19.087  17.384 -18.379
  530    H    ILE  74           H        ILE  74 -22.093  22.715 -16.790
  531    HA   ILE  74           HA       ILE  74 -24.667  21.289 -16.188
  532    HB   ILE  74           HB       ILE  74 -24.091  24.250 -15.801
  533   1HG1  ILE  74          2HG1      ILE  74 -23.998  21.962 -13.783
  534   2HG1  ILE  74          3HG1      ILE  74 -22.672  23.020 -14.239
  535   1HG2  ILE  74          1HG2      ILE  74 -26.449  23.686 -16.201
  536   2HG2  ILE  74          2HG2      ILE  74 -26.403  22.453 -14.925
  537   3HG2  ILE  74          3HG2      ILE  74 -26.245  24.159 -14.523
  538   1HD1  ILE  74          1HD1      ILE  74 -25.070  23.806 -12.576
  539   2HD1  ILE  74          2HD1      ILE  74 -23.396  23.670 -12.076
  540   3HD1  ILE  74          3HD1      ILE  74 -23.871  24.957 -13.248
  541    H    LYS  75           H        LYS  75 -26.332  21.641 -17.652
  542    HA   LYS  75           HA       LYS  75 -25.701  23.261 -20.081
  543   1HB   LYS  75          HB2       LYS  75 -26.578  21.575 -21.529
  544   2HB   LYS  75          HB3       LYS  75 -25.389  20.842 -20.454
  545   1HG   LYS  75          HG2       LYS  75 -27.503  20.221 -18.966
  546   2HG   LYS  75          HG3       LYS  75 -28.391  20.515 -20.448
  547   1HD   LYS  75          HD2       LYS  75 -27.953  18.189 -20.305
  548   2HD   LYS  75          HD3       LYS  75 -26.892  18.830 -21.564
  549   1HE   LYS  75          HE2       LYS  75 -24.984  18.858 -19.924
  550   2HE   LYS  75          HE3       LYS  75 -26.057  18.294 -18.661
  551   1HZ   LYS  75          HZ1       LYS  75 -26.370  16.231 -19.945
  552   2HZ   LYS  75          HZ2       LYS  75 -25.291  16.754 -21.069
  553   3HZ   LYS  75          HZ3       LYS  75 -24.819  16.466 -19.539
  554    H    LYS  76           H        LYS  76 -27.416  24.035 -21.264
  555    HA   LYS  76           HA       LYS  76 -29.144  25.499 -21.445
  556   1HB   LYS  76          HB2       LYS  76 -31.379  24.642 -21.182
  557   2HB   LYS  76          HB3       LYS  76 -30.348  23.514 -22.036
  558   1HG   LYS  76          HG2       LYS  76 -30.167  22.073 -20.065
  559   2HG   LYS  76          HG3       LYS  76 -31.154  23.196 -19.123
  560   1HD   LYS  76          HD2       LYS  76 -33.037  22.859 -20.616
  561   2HD   LYS  76          HD3       LYS  76 -32.075  21.776 -21.646
  562   1HE   LYS  76          HE2       LYS  76 -31.774  20.251 -19.627
  563   2HE   LYS  76          HE3       LYS  76 -32.782  21.352 -18.685
  564   1HZ   LYS  76          HZ1       LYS  76 -34.627  20.869 -20.224
  565   2HZ   LYS  76          HZ2       LYS  76 -33.702  19.839 -21.082
  566   3HZ   LYS  76          HZ3       LYS  76 -34.097  19.483 -19.551
  567    H    VAL  77           H        VAL  77 -27.709  26.530 -19.813
  568    HA   VAL  77           HA       VAL  77 -28.655  26.762 -17.099
  569    HB   VAL  77           HB       VAL  77 -26.507  28.216 -18.662
  570   1HG1  VAL  77          1HG1      VAL  77 -25.622  29.030 -16.485
  571   2HG1  VAL  77          2HG1      VAL  77 -27.184  29.772 -16.902
  572   3HG1  VAL  77          3HG1      VAL  77 -27.125  28.470 -15.682
  573   1HG2  VAL  77          1HG2      VAL  77 -25.028  26.838 -17.194
  574   2HG2  VAL  77          2HG2      VAL  77 -26.460  26.077 -16.469
  575   3HG2  VAL  77          3HG2      VAL  77 -26.085  25.834 -18.169
  576    H    ASP  78           H        ASP  78 -29.712  28.278 -16.052
  577    HA   ASP  78           HA       ASP  78 -30.422  30.835 -17.334
  578   1HB   ASP  78          HB2       ASP  78 -32.203  28.908 -17.829
  579   2HB   ASP  78          HB3       ASP  78 -32.756  29.284 -16.205
  580    H    LYS  79           H        LYS  79 -32.159  31.960 -15.599
  581    HA   LYS  79           HA       LYS  79 -30.466  32.657 -13.387
  582   1HB   LYS  79          HB2       LYS  79 -33.278  33.291 -14.306
  583   2HB   LYS  79          HB3       LYS  79 -32.816  33.840 -12.705
  584   1HG   LYS  79          HG2       LYS  79 -30.853  34.425 -14.893
  585   2HG   LYS  79          HG3       LYS  79 -32.383  35.292 -14.946
  586   1HD   LYS  79          HD2       LYS  79 -30.505  36.447 -13.746
  587   2HD   LYS  79          HD3       LYS  79 -32.046  36.337 -12.876
  588   1HE   LYS  79          HE2       LYS  79 -31.194  34.561 -11.447
  589   2HE   LYS  79          HE3       LYS  79 -29.719  34.443 -12.407
  590   1HZ   LYS  79          HZ1       LYS  79 -29.019  36.560 -11.609
  591   2HZ   LYS  79          HZ2       LYS  79 -30.482  36.927 -10.933
  592   3HZ   LYS  79          HZ3       LYS  79 -29.526  35.773 -10.284
  593    H    SER  80           H        SER  80 -32.632  29.989 -13.630
  594    HA   SER  80           HA       SER  80 -33.069  29.639 -10.768
  595   1HB   SER  80          HB2       SER  80 -33.799  27.359 -11.524
  596   2HB   SER  80          HB3       SER  80 -34.658  28.704 -12.307
  597    HG   SER  80           HG       SER  80 -34.003  27.106 -13.817
  598    H    ASP  81           H        ASP  81 -30.285  29.103 -12.818
  599    HA   ASP  81           HA       ASP  81 -29.211  26.918 -11.166
  600   1HB   ASP  81          HB2       ASP  81 -28.024  28.518 -13.471
  601   2HB   ASP  81          HB3       ASP  81 -27.204  27.204 -12.631
  602    H    GLU  82           H        GLU  82 -29.266  30.284 -10.736
  603    HA   GLU  82           HA       GLU  82 -26.790  30.980  -9.671
  604   1HB   GLU  82          HB2       GLU  82 -28.760  32.504 -10.063
  605   2HB   GLU  82          HB3       GLU  82 -29.522  31.800  -8.631
  606   1HG   GLU  82          HG2       GLU  82 -27.566  32.560  -7.251
  607   2HG   GLU  82          HG3       GLU  82 -26.938  33.368  -8.689
  608    H    ALA  83           H        ALA  83 -25.574  30.295  -7.944
  609    HA   ALA  83           HA       ALA  83 -26.870  28.925  -5.654
  610   1HB   ALA  83          HB1       ALA  83 -25.533  26.828  -5.991
  611   2HB   ALA  83          HB2       ALA  83 -26.528  27.136  -7.435
  612   3HB   ALA  83          HB3       ALA  83 -24.820  27.534  -7.480
  613    H    GLU  84           H        GLU  84 -25.601  28.565  -3.890
  614    HA   GLU  84           HA       GLU  84 -22.831  29.756  -3.808
  615   1HB   GLU  84          HB2       GLU  84 -24.492  31.015  -2.445
  616   2HB   GLU  84          HB3       GLU  84 -24.835  29.541  -1.508
  617   1HG   GLU  84          HG2       GLU  84 -22.460  29.476  -0.781
  618   2HG   GLU  84          HG3       GLU  84 -22.108  30.882  -1.785
  619    H    TYR  85           H        TYR  85 -21.640  28.026  -4.251
  620    HA   TYR  85           HA       TYR  85 -22.503  25.338  -3.514
  621   1HB   TYR  85          HB2       TYR  85 -20.095  26.375  -5.030
  622   2HB   TYR  85          HB3       TYR  85 -20.487  24.704  -4.836
  623    HD1  TYR  85           HD1      TYR  85 -20.505  27.170  -7.222
  624    HD2  TYR  85           HD2      TYR  85 -23.109  24.203  -5.513
  625    HE1  TYR  85           HE1      TYR  85 -21.675  26.918  -9.427
  626    HE2  TYR  85           HE2      TYR  85 -24.288  23.981  -7.706
  627    HH   TYR  85           HH       TYR  85 -24.468  24.702  -9.813
  628    H    ILE  86           H        ILE  86 -22.033  24.531  -1.534
  629    HA   ILE  86           HA       ILE  86 -19.266  25.000  -0.435
  630    HB   ILE  86           HB       ILE  86 -21.801  24.141   0.997
  631   1HG1  ILE  86          2HG1      ILE  86 -21.198  26.073   2.529
  632   2HG1  ILE  86          3HG1      ILE  86 -19.972  26.568   1.379
  633   1HG2  ILE  86          1HG2      ILE  86 -20.336  23.984   3.003
  634   2HG2  ILE  86          2HG2      ILE  86 -19.849  22.819   1.785
  635   3HG2  ILE  86          3HG2      ILE  86 -18.908  24.300   2.003
  636   1HD1  ILE  86          1HD1      ILE  86 -22.132  27.875   1.289
  637   2HD1  ILE  86          2HD1      ILE  86 -21.647  27.181  -0.247
  638   3HD1  ILE  86          3HD1      ILE  86 -22.940  26.393   0.695
  639    H    CYS  87           H        CYS  87 -17.928  23.358  -0.740
  640    HA   CYS  87           HA       CYS  87 -19.026  20.710  -1.520
  641   1HB   CYS  87          HB2       CYS  87 -17.249  20.567  -3.245
  642   2HB   CYS  87          HB3       CYS  87 -18.369  21.913  -3.502
  643    H    ILE  88           H        ILE  88 -18.272  18.954  -0.660
  644    HA   ILE  88           HA       ILE  88 -16.064  19.194   1.349
  645    HB   ILE  88           HB       ILE  88 -18.614  17.591   1.713
  646   1HG1  ILE  88          2HG1      ILE  88 -18.932  19.511   3.592
  647   2HG1  ILE  88          3HG1      ILE  88 -18.118  20.519   2.410
  648   1HG2  ILE  88          1HG2      ILE  88 -16.444  18.495   3.671
  649   2HG2  ILE  88          2HG2      ILE  88 -17.876  17.528   4.078
  650   3HG2  ILE  88          3HG2      ILE  88 -16.648  16.836   3.034
  651   1HD1  ILE  88          1HD1      ILE  88 -20.637  20.606   2.291
  652   2HD1  ILE  88          2HD1      ILE  88 -19.930  20.020   0.776
  653   3HD1  ILE  88          3HD1      ILE  88 -20.659  18.890   1.963
  654    H    ALA  89           H        ALA  89 -14.710  17.441   1.544
  655    HA   ALA  89           HA       ALA  89 -15.353  14.941   0.055
  656   1HB   ALA  89          HB1       ALA  89 -12.683  16.413  -0.038
  657   2HB   ALA  89          HB2       ALA  89 -13.043  14.879  -0.843
  658   3HB   ALA  89          HB3       ALA  89 -13.866  16.348  -1.376
  659    H    GLU  90           H        GLU  90 -14.579  13.097   0.889
  660    HA   GLU  90           HA       GLU  90 -13.132  13.080   3.510
  661   1HB   GLU  90          HB2       GLU  90 -15.673  13.279   3.759
  662   2HB   GLU  90          HB3       GLU  90 -15.789  11.710   2.961
  663   1HG   GLU  90          HG2       GLU  90 -14.280  10.808   4.837
  664   2HG   GLU  90          HG3       GLU  90 -14.490  12.363   5.634
  665    H    ASN  91           H        ASN  91 -11.992  11.155   3.889
  666    HA   ASN  91           HA       ASN  91 -12.647   8.747   2.417
  667   1HB   ASN  91          HB2       ASN  91 -10.789   8.288   1.131
  668   2HB   ASN  91          HB3       ASN  91 -11.209   9.949   0.746
  669   1HD2  ASN  91          1HD2      ASN  91  -7.525   9.869   0.967
  670   2HD2  ASN  91          2HD2      ASN  91  -8.763   9.208  -0.100
  671    H    LYS  92           H        LYS  92 -10.251   7.289   2.924
  672    HA   LYS  92           HA       LYS  92 -10.790   6.639   5.710
  673   1HB   LYS  92          HB2       LYS  92  -8.419   5.315   4.628
  674   2HB   LYS  92          HB3       LYS  92  -9.917   4.627   5.201
  675   1HG   LYS  92          HG2       LYS  92  -9.257   5.605   2.397
  676   2HG   LYS  92          HG3       LYS  92  -9.377   3.951   2.933
  677   1HD   LYS  92          HD2       LYS  92 -11.664   5.881   2.414
  678   2HD   LYS  92          HD3       LYS  92 -11.304   4.338   1.661
  679   1HE   LYS  92          HE2       LYS  92 -11.749   3.177   3.805
  680   2HE   LYS  92          HE3       LYS  92 -12.178   4.707   4.564
  681   1HZ   LYS  92          HZ1       LYS  92 -14.165   3.523   3.776
  682   2HZ   LYS  92          HZ2       LYS  92 -14.006   4.961   3.034
  683   3HZ   LYS  92          HZ3       LYS  92 -13.625   3.595   2.239
  684    H    ALA  93           H        ALA  93  -8.418   8.606   4.182
  685    HA   ALA  93           HA       ALA  93  -6.586   8.606   6.515
  686   1HB   ALA  93          HB1       ALA  93  -6.339   9.676   3.694
  687   2HB   ALA  93          HB2       ALA  93  -5.080   9.789   4.950
  688   3HB   ALA  93          HB3       ALA  93  -5.580   8.221   4.349
  689    H    GLY  94           H        GLY  94  -9.141  10.672   5.164
  690   1HA   GLY  94          HA2       GLY  94  -9.070  12.434   7.404
  691   2HA   GLY  94          HA3       GLY  94  -8.145  13.173   6.154
  692    H    GLU  95           H        GLU  95  -9.560  14.908   6.068
  693    HA   GLU  95           HA       GLU  95 -12.035  14.676   4.506
  694   1HB   GLU  95          HB2       GLU  95 -12.667  14.172   6.894
  695   2HB   GLU  95          HB3       GLU  95 -12.005  15.716   7.379
  696   1HG   GLU  95          HG2       GLU  95 -13.706  16.852   5.894
  697   2HG   GLU  95          HG3       GLU  95 -14.392  15.262   5.567
  698    H    GLN  96           H        GLN  96 -12.650  16.747   3.613
  699    HA   GLN  96           HA       GLN  96 -11.105  19.178   4.224
  700   1HB   GLN  96          HB2       GLN  96  -9.859  17.453   2.623
  701   2HB   GLN  96          HB3       GLN  96 -11.022  17.962   1.437
  702   1HG   GLN  96          HG2       GLN  96  -9.059  19.247   1.071
  703   2HG   GLN  96          HG3       GLN  96 -10.177  20.385   1.798
  704   1HE2  GLN  96          1HE2      GLN  96  -7.546  18.016   2.717
  705   2HE2  GLN  96          2HE2      GLN  96  -6.887  19.081   3.956
  706    H    ASP  97           H        ASP  97 -11.838  21.081   2.834
  707    HA   ASP  97           HA       ASP  97 -14.248  20.762   1.257
  708   1HB   ASP  97          HB2       ASP  97 -15.760  22.081   2.595
  709   2HB   ASP  97          HB3       ASP  97 -15.217  20.702   3.518
  710    H    ALA  98           H        ALA  98 -15.040  22.687   0.211
  711    HA   ALA  98           HA       ALA  98 -13.601  25.209   0.478
  712   1HB   ALA  98          HB1       ALA  98 -12.225  23.868  -1.180
  713   2HB   ALA  98          HB2       ALA  98 -13.629  23.743  -2.235
  714   3HB   ALA  98          HB3       ALA  98 -12.917  25.317  -1.925
  715    H    THR  99           H        THR  99 -14.537  26.793  -1.324
  716    HA   THR  99           HA       THR  99 -17.496  26.540  -1.491
  717    HB   THR  99           HB       THR  99 -15.997  28.901  -0.296
  718    HG1  THR  99           HG1      THR  99 -16.841  28.220   1.636
  719   1HG2  THR  99          1HG2      THR  99 -18.159  29.603  -1.257
  720   2HG2  THR  99          2HG2      THR  99 -18.995  28.224  -0.468
  721   3HG2  THR  99          3HG2      THR  99 -18.311  29.563   0.495
  722    H    ILE 100           H        ILE 100 -18.471  27.658  -3.208
  723    HA   ILE 100           HA       ILE 100 -16.913  29.615  -4.843
  724    HB   ILE 100           HB       ILE 100 -18.324  27.165  -5.983
  725   1HG1  ILE 100          2HG1      ILE 100 -15.354  27.761  -5.758
  726   2HG1  ILE 100          3HG1      ILE 100 -16.255  26.469  -4.978
  727   1HG2  ILE 100          1HG2      ILE 100 -18.601  28.992  -7.525
  728   2HG2  ILE 100          2HG2      ILE 100 -16.906  29.476  -7.406
  729   3HG2  ILE 100          3HG2      ILE 100 -17.377  27.963  -8.207
  730   1HD1  ILE 100          1HD1      ILE 100 -16.781  25.530  -7.263
  731   2HD1  ILE 100          2HD1      ILE 100 -15.581  26.650  -7.920
  732   3HD1  ILE 100          3HD1      ILE 100 -15.075  25.457  -6.736
  733    H    HIS 101           H        HIS 101 -18.211  31.190  -5.825
  734    HA   HIS 101           HA       HIS 101 -21.189  31.034  -5.395
  735   1HB   HIS 101          HB2       HIS 101 -19.639  33.414  -6.372
  736   2HB   HIS 101          HB3       HIS 101 -21.196  33.386  -5.608
  737    HD1  HIS 101           HD1      HIS 101 -17.623  33.919  -4.856
  738    HD2  HIS 101           HD2      HIS 101 -21.043  32.593  -2.805
  739    HE1  HIS 101           HE1      HIS 101 -17.100  34.153  -2.351
  740    H    LEU 102           H        LEU 102 -22.624  31.142  -7.183
  741    HA   LEU 102           HA       LEU 102 -21.457  31.511  -9.888
  742   1HB   LEU 102          HB2       LEU 102 -22.074  29.149  -9.496
  743   2HB   LEU 102          HB3       LEU 102 -23.723  29.612  -9.131
  744    HG   LEU 102           HG       LEU 102 -23.940  30.580 -11.445
  745   1HD1  LEU 102          1HD1      LEU 102 -21.577  31.019 -12.037
  746   2HD1  LEU 102          2HD1      LEU 102 -21.187  29.290 -11.819
  747   3HD1  LEU 102          3HD1      LEU 102 -22.259  29.821 -13.141
  748   1HD2  LEU 102          1HD2      LEU 102 -23.128  27.674 -11.234
  749   2HD2  LEU 102          2HD2      LEU 102 -24.750  28.352 -10.933
  750   3HD2  LEU 102          3HD2      LEU 102 -24.026  28.376 -12.575
  751    H    LYS 103           H        LYS 103 -21.878  33.570 -10.190
  752    HA   LYS 103           HA       LYS 103 -24.468  34.816  -9.435
  753   1HB   LYS 103          HB2       LYS 103 -21.815  35.986 -10.346
  754   2HB   LYS 103          HB3       LYS 103 -23.244  36.896  -9.827
  755   1HG   LYS 103          HG2       LYS 103 -23.090  35.764  -7.607
  756   2HG   LYS 103          HG3       LYS 103 -21.582  34.981  -8.139
  757   1HD   LYS 103          HD2       LYS 103 -20.554  37.215  -8.473
  758   2HD   LYS 103          HD3       LYS 103 -22.042  37.977  -7.881
  759   1HE   LYS 103          HE2       LYS 103 -21.817  36.807  -5.739
  760   2HE   LYS 103          HE3       LYS 103 -20.347  36.017  -6.284
  761   1HZ   LYS 103          HZ1       LYS 103 -20.656  38.965  -5.967
  762   2HZ   LYS 103          HZ2       LYS 103 -19.846  37.976  -4.942
  763   3HZ   LYS 103          HZ3       LYS 103 -19.285  38.220  -6.468
  764    H    VAL 104           H        VAL 104 -25.687  33.702 -11.097
  765    HA   VAL 104           HA       VAL 104 -25.231  34.117 -13.943
  766    HB   VAL 104           HB       VAL 104 -27.759  33.263 -12.457
  767   1HG1  VAL 104          1HG1      VAL 104 -26.955  32.905 -15.393
  768   2HG1  VAL 104          2HG1      VAL 104 -28.350  32.153 -14.610
  769   3HG1  VAL 104          3HG1      VAL 104 -28.282  33.901 -14.766
  770   1HG2  VAL 104          1HG2      VAL 104 -26.007  31.691 -11.879
  771   2HG2  VAL 104          2HG2      VAL 104 -27.050  30.936 -13.090
  772   3HG2  VAL 104          3HG2      VAL 104 -25.461  31.594 -13.576
  773    H    PHE 105           H        PHE 105 -26.093  35.713 -15.338
  774    HA   PHE 105           HA       PHE 105 -28.088  37.642 -14.292
  775   1HB   PHE 105          HB2       PHE 105 -26.701  39.238 -15.712
  776   2HB   PHE 105          HB3       PHE 105 -26.170  38.866 -14.089
  777    HD1  PHE 105           HD1      PHE 105 -25.589  37.816 -17.668
  778    HD2  PHE 105           HD2      PHE 105 -23.849  38.493 -13.788
  779    HE1  PHE 105           HE1      PHE 105 -23.347  37.431 -18.611
  780    HE2  PHE 105           HE2      PHE 105 -21.592  38.136 -14.734
  781    HZ   PHE 105           HZ       PHE 105 -21.329  37.595 -17.142
  782    H    ALA 106           H        ALA 106 -29.135  38.845 -16.008
  783    HA   ALA 106           HA       ALA 106 -29.858  36.960 -18.203
  784   1HB   ALA 106          HB1       ALA 106 -31.509  37.214 -16.381
  785   2HB   ALA 106          HB2       ALA 106 -31.553  38.975 -16.673
  786   3HB   ALA 106          HB3       ALA 106 -32.129  37.825 -17.928
  787    H    LYS 107           H        LYS 107 -27.808  38.702 -18.710
  788    HA   LYS 107           HA       LYS 107 -28.629  40.048 -21.114
  789   1HB   LYS 107          HB2       LYS 107 -28.052  42.332 -20.525
  790   2HB   LYS 107          HB3       LYS 107 -29.401  41.784 -19.558
  791   1HG   LYS 107          HG2       LYS 107 -27.756  41.291 -17.670
  792   2HG   LYS 107          HG3       LYS 107 -26.526  42.114 -18.664
  793   1HD   LYS 107          HD2       LYS 107 -29.089  43.342 -17.605
  794   2HD   LYS 107          HD3       LYS 107 -27.474  43.603 -16.948
  795   1HE   LYS 107          HE2       LYS 107 -28.376  44.426 -19.760
  796   2HE   LYS 107          HE3       LYS 107 -28.311  45.483 -18.357
  797   1HZ   LYS 107          HZ1       LYS 107 -25.965  44.091 -19.581
  798   2HZ   LYS 107          HZ2       LYS 107 -26.290  45.673 -19.701
  799   3HZ   LYS 107          HZ3       LYS 107 -25.903  45.056 -18.245
  Start of MODEL    5
    1   1H    GLY   1          H1        GLY   1 -11.349  -1.126   2.694
    2   2H    GLY   1          H2        GLY   1 -12.262  -0.056   3.538
    3   3H    GLY   1          H3        GLY   1 -12.263   0.007   1.917
    4   1HA   GLY   1          HA2       GLY   1  -9.930   0.644   1.889
    5   2HA   GLY   1          HA3       GLY   1 -10.916   1.782   2.867
    6    H    LYS   2           H        LYS   2  -8.118   1.468   3.123
    7    HA   LYS   2           HA       LYS   2  -7.877   0.921   6.004
    8   1HB   LYS   2          HB2       LYS   2  -6.151  -0.771   5.866
    9   2HB   LYS   2          HB3       LYS   2  -7.582  -1.321   4.995
   10   1HG   LYS   2          HG2       LYS   2  -6.509  -0.619   2.836
   11   2HG   LYS   2          HG3       LYS   2  -5.056  -0.176   3.750
   12   1HD   LYS   2          HD2       LYS   2  -4.840  -2.504   4.579
   13   2HD   LYS   2          HD3       LYS   2  -6.259  -2.983   3.638
   14   1HE   LYS   2          HE2       LYS   2  -5.149  -2.320   1.532
   15   2HE   LYS   2          HE3       LYS   2  -3.730  -1.775   2.426
   16   1HZ   LYS   2          HZ1       LYS   2  -3.452  -4.095   1.563
   17   2HZ   LYS   2          HZ2       LYS   2  -3.474  -4.110   3.210
   18   3HZ   LYS   2          HZ3       LYS   2  -4.782  -4.566   2.358
   19    H    ASP   3           H        ASP   3  -5.690   1.291   6.781
   20    HA   ASP   3           HA       ASP   3  -4.244   3.552   5.510
   21   1HB   ASP   3          HB2       ASP   3  -5.095   3.827   7.840
   22   2HB   ASP   3          HB3       ASP   3  -4.199   2.407   8.359
   23    H    ILE   4           H        ILE   4  -1.875   3.402   5.371
   24    HA   ILE   4           HA       ILE   4  -0.802   0.620   5.188
   25    HB   ILE   4           HB       ILE   4  -0.670   2.796   3.040
   26   1HG1  ILE   4          2HG1      ILE   4  -2.241   0.173   3.130
   27   2HG1  ILE   4          3HG1      ILE   4  -2.953   1.776   3.200
   28   1HG2  ILE   4          1HG2      ILE   4   1.353   1.316   3.038
   29   2HG2  ILE   4          2HG2      ILE   4   0.326  -0.109   2.964
   30   3HG2  ILE   4          3HG2      ILE   4   0.381   1.067   1.613
   31   1HD1  ILE   4          1HD1      ILE   4  -3.280   0.931   1.025
   32   2HD1  ILE   4          2HD1      ILE   4  -2.060   2.195   0.861
   33   3HD1  ILE   4          3HD1      ILE   4  -1.594   0.494   0.799
   34    H    GLN   5           H        GLN   5   1.481   0.403   5.329
   35    HA   GLN   5           HA       GLN   5   2.774   2.490   6.946
   36   1HB   GLN   5          HB2       GLN   5   3.743  -0.262   6.113
   37   2HB   GLN   5          HB3       GLN   5   4.586   0.808   7.246
   38   1HG   GLN   5          HG2       GLN   5   2.613   0.724   8.767
   39   2HG   GLN   5          HG3       GLN   5   1.803  -0.410   7.699
   40   1HE2  GLN   5          1HE2      GLN   5   3.262  -0.440  10.574
   41   2HE2  GLN   5          2HE2      GLN   5   4.097  -1.990  10.497
   42    H    VAL   6           H        VAL   6   2.282   3.227   4.335
   43    HA   VAL   6           HA       VAL   6   4.849   4.044   3.161
   44    HB   VAL   6           HB       VAL   6   2.890   2.486   1.452
   45   1HG1  VAL   6          1HG1      VAL   6   4.224   4.078   0.184
   46   2HG1  VAL   6          2HG1      VAL   6   5.748   3.491   0.906
   47   3HG1  VAL   6          3HG1      VAL   6   4.786   2.457  -0.188
   48   1HG2  VAL   6          1HG2      VAL   6   5.544   1.458   2.498
   49   2HG2  VAL   6          2HG2      VAL   6   3.926   0.824   2.924
   50   3HG2  VAL   6          3HG2      VAL   6   4.529   0.674   1.271
   51    H    ILE   7           H        ILE   7   4.493   5.888   1.743
   52    HA   ILE   7           HA       ILE   7   2.082   7.348   2.381
   53    HB   ILE   7           HB       ILE   7   4.302   8.182   0.472
   54   1HG1  ILE   7          2HG1      ILE   7   5.414   7.659   2.566
   55   2HG1  ILE   7          3HG1      ILE   7   5.311   9.417   2.369
   56   1HG2  ILE   7          1HG2      ILE   7   2.129   9.688   2.012
   57   2HG2  ILE   7          2HG2      ILE   7   3.502  10.459   1.197
   58   3HG2  ILE   7          3HG2      ILE   7   2.327   9.576   0.247
   59   1HD1  ILE   7          1HD1      ILE   7   3.518   7.730   4.181
   60   2HD1  ILE   7          2HD1      ILE   7   4.847   8.790   4.680
   61   3HD1  ILE   7          3HD1      ILE   7   3.384   9.487   3.957
   62    H    VAL   8           H        VAL   8   0.480   6.154   1.588
   63    HA   VAL   8           HA       VAL   8  -0.159   6.300  -1.320
   64    HB   VAL   8           HB       VAL   8  -0.499   3.831   0.408
   65   1HG1  VAL   8          1HG1      VAL   8  -1.054   4.301  -2.534
   66   2HG1  VAL   8          2HG1      VAL   8  -1.080   2.717  -1.731
   67   3HG1  VAL   8          3HG1      VAL   8  -2.267   3.957  -1.310
   68   1HG2  VAL   8          1HG2      VAL   8   1.871   4.065  -0.173
   69   2HG2  VAL   8          2HG2      VAL   8   1.142   2.774  -1.124
   70   3HG2  VAL   8          3HG2      VAL   8   1.426   4.382  -1.852
   71    H    ASN   9           H        ASN   9  -1.325   6.200   1.992
   72    HA   ASN   9           HA       ASN   9  -4.156   6.305   1.232
   73   1HB   ASN   9          HB2       ASN   9  -4.457   6.356   3.716
   74   2HB   ASN   9          HB3       ASN   9  -3.747   4.918   3.037
   75   1HD2  ASN   9          1HD2      ASN   9  -1.330   7.392   5.286
   76   2HD2  ASN   9          2HD2      ASN   9  -2.698   8.100   4.414
   77    H    VAL  10           H        VAL  10  -3.400   8.339  -0.069
   78    HA   VAL  10           HA       VAL  10  -2.815  10.742   1.284
   79    HB   VAL  10           HB       VAL  10  -3.818  10.434  -1.529
   80   1HG1  VAL  10          1HG1      VAL  10  -2.720  12.598  -1.941
   81   2HG1  VAL  10          2HG1      VAL  10  -4.003  12.781  -0.772
   82   3HG1  VAL  10          3HG1      VAL  10  -2.293  12.718  -0.215
   83   1HG2  VAL  10          1HG2      VAL  10  -1.751   9.144  -1.216
   84   2HG2  VAL  10          2HG2      VAL  10  -1.368  10.644  -2.086
   85   3HG2  VAL  10          3HG2      VAL  10  -1.007  10.499  -0.342
   86    HA   PRO  11           HA       PRO  11  -6.961  11.858   2.779
   87   1HB   PRO  11          HB2       PRO  11  -5.631  14.558   2.962
   88   2HB   PRO  11          HB3       PRO  11  -6.690  13.769   4.158
   89   1HG   PRO  11          HG2       PRO  11  -4.045  13.674   4.520
   90   2HG   PRO  11          HG3       PRO  11  -4.991  12.131   4.726
   91   1HD   PRO  11          HD2       PRO  11  -3.327  13.046   2.353
   92   2HD   PRO  11          HD3       PRO  11  -3.373  11.461   3.177
   93    HA   PRO  12           HA       PRO  12  -8.970  13.741  -0.703
   94   1HB   PRO  12          HB2       PRO  12 -11.451  14.127   0.242
   95   2HB   PRO  12          HB3       PRO  12 -10.694  12.515   0.311
   96   1HG   PRO  12          HG2       PRO  12 -10.819  14.593   2.493
   97   2HG   PRO  12          HG3       PRO  12 -11.260  12.880   2.612
   98   1HD   PRO  12          HD2       PRO  12  -8.807  13.804   3.357
   99   2HD   PRO  12          HD3       PRO  12  -9.079  12.164   2.681
  100    H    SER  13           H        SER  13  -7.433  15.669  -0.623
  101    HA   SER  13           HA       SER  13  -8.218  18.042   0.896
  102   1HB   SER  13          HB2       SER  13  -5.955  17.631  -1.073
  103   2HB   SER  13          HB3       SER  13  -6.176  19.034  -0.028
  104    HG   SER  13           HG       SER  13  -4.762  17.607   1.013
  105    H    VAL  14           H        VAL  14 -10.377  18.088  -0.290
  106    HA   VAL  14           HA       VAL  14 -10.417  19.048  -2.983
  107    HB   VAL  14           HB       VAL  14 -12.364  17.973  -1.901
  108   1HG1  VAL  14          1HG1      VAL  14 -13.023  20.662  -0.639
  109   2HG1  VAL  14          2HG1      VAL  14 -13.970  19.182  -0.578
  110   3HG1  VAL  14          3HG1      VAL  14 -12.398  19.276   0.260
  111   1HG2  VAL  14          1HG2      VAL  14 -13.054  20.655  -3.092
  112   2HG2  VAL  14          2HG2      VAL  14 -12.657  19.191  -3.990
  113   3HG2  VAL  14          3HG2      VAL  14 -14.103  19.238  -2.977
  114    H    ARG  15           H        ARG  15 -10.614  20.951  -3.917
  115    HA   ARG  15           HA       ARG  15 -10.434  23.493  -2.314
  116   1HB   ARG  15          HB2       ARG  15  -8.678  22.522  -4.599
  117   2HB   ARG  15          HB3       ARG  15  -8.835  24.233  -4.236
  118   1HG   ARG  15          HG2       ARG  15  -7.624  24.160  -2.323
  119   2HG   ARG  15          HG3       ARG  15  -8.140  22.529  -1.873
  120   1HD   ARG  15          HD2       ARG  15  -6.137  23.106  -4.107
  121   2HD   ARG  15          HD3       ARG  15  -5.729  22.615  -2.463
  122    HE   ARG  15           HE       ARG  15  -6.905  20.514  -2.796
  123   1HH1  ARG  15          1HH1      ARG  15  -7.105  18.818  -5.730
  124   2HH1  ARG  15          2HH1      ARG  15  -7.393  18.833  -3.978
  125   1HH2  ARG  15          1HH2      ARG  15  -6.340  22.168  -5.825
  126   2HH2  ARG  15          2HH2      ARG  15  -7.036  20.871  -6.726
  127    H    ALA  16           H        ALA  16 -10.821  25.384  -3.810
  128    HA   ALA  16           HA       ALA  16 -13.025  24.739  -5.735
  129   1HB   ALA  16          HB1       ALA  16 -12.215  27.348  -4.375
  130   2HB   ALA  16          HB2       ALA  16 -13.548  27.143  -5.526
  131   3HB   ALA  16          HB3       ALA  16 -13.620  26.319  -3.966
  132    H    ARG  17           H        ARG  17 -12.525  24.791  -7.837
  133    HA   ARG  17           HA       ARG  17  -9.836  25.345  -8.769
  134   1HB   ARG  17          HB2       ARG  17 -11.402  23.648  -9.708
  135   2HB   ARG  17          HB3       ARG  17 -12.379  24.938 -10.421
  136   1HG   ARG  17          HG2       ARG  17 -10.521  25.632 -11.854
  137   2HG   ARG  17          HG3       ARG  17  -9.448  24.475 -11.075
  138   1HD   ARG  17          HD2       ARG  17 -11.936  23.816 -12.698
  139   2HD   ARG  17          HD3       ARG  17 -10.302  23.829 -13.347
  140    HE   ARG  17           HE       ARG  17 -11.529  21.657 -11.872
  141   1HH1  ARG  17          1HH1      ARG  17  -8.729  19.743 -11.719
  142   2HH1  ARG  17          2HH1      ARG  17 -10.490  19.829 -11.705
  143   1HH2  ARG  17          1HH2      ARG  17  -7.553  21.596 -12.119
  144   2HH2  ARG  17          2HH2      ARG  17  -8.368  23.120 -12.420
  145    H    GLN  18           H        GLN  18 -12.434  27.369  -8.216
  146    HA   GLN  18           HA       GLN  18 -11.197  29.838  -9.150
  147   1HB   GLN  18          HB2       GLN  18 -12.933  30.476 -10.643
  148   2HB   GLN  18          HB3       GLN  18 -12.313  28.933 -11.196
  149   1HG   GLN  18          HG2       GLN  18 -14.936  29.415  -9.693
  150   2HG   GLN  18          HG3       GLN  18 -14.758  29.123 -11.413
  151   1HE2  GLN  18          1HE2      GLN  18 -14.685  25.920  -8.864
  152   2HE2  GLN  18          2HE2      GLN  18 -14.541  27.554  -8.211
  153    H    SER  19           H        SER  19 -12.297  31.700  -8.144
  154    HA   SER  19           HA       SER  19 -13.662  30.956  -5.635
  155   1HB   SER  19          HB2       SER  19 -12.941  33.716  -6.693
  156   2HB   SER  19          HB3       SER  19 -13.333  33.275  -5.016
  157    HG   SER  19           HG       SER  19 -11.442  31.969  -4.988
  158    H    THR  20           H        THR  20 -14.614  32.405  -8.654
  159    HA   THR  20           HA       THR  20 -17.485  32.601  -7.878
  160    HB   THR  20           HB       THR  20 -15.943  34.980  -9.008
  161    HG1  THR  20           HG1      THR  20 -16.326  35.936  -6.988
  162   1HG2  THR  20          1HG2      THR  20 -18.826  34.649  -8.010
  163   2HG2  THR  20          2HG2      THR  20 -18.076  36.220  -8.367
  164   3HG2  THR  20          3HG2      THR  20 -18.309  35.059  -9.675
  165    H    MET  21           H        MET  21 -18.750  32.169  -9.488
  166    HA   MET  21           HA       MET  21 -17.760  32.130 -12.338
  167   1HB   MET  21          HB2       MET  21 -19.507  30.155 -10.815
  168   2HB   MET  21          HB3       MET  21 -19.583  30.265 -12.558
  169   1HG   MET  21          HG2       MET  21 -17.048  29.736 -10.989
  170   2HG   MET  21          HG3       MET  21 -18.029  28.510 -11.771
  171   1HE   MET  21          HE1       MET  21 -18.379  28.319 -14.426
  172   2HE   MET  21          HE2       MET  21 -18.700  30.062 -14.689
  173   3HE   MET  21          HE3       MET  21 -17.455  29.225 -15.615
  174    H    ASN  22           H        ASN  22 -19.592  32.219 -13.881
  175    HA   ASN  22           HA       ASN  22 -22.044  33.640 -13.151
  176   1HB   ASN  22          HB2       ASN  22 -21.514  35.679 -14.382
  177   2HB   ASN  22          HB3       ASN  22 -20.392  35.486 -13.052
  178   1HD2  ASN  22          1HD2      ASN  22 -19.008  35.448 -16.882
  179   2HD2  ASN  22          2HD2      ASN  22 -20.719  35.534 -16.564
  180    H    ALA  23           H        ALA  23 -23.347  34.107 -15.176
  181    HA   ALA  23           HA       ALA  23 -22.692  32.738 -17.685
  182   1HB   ALA  23          HB1       ALA  23 -24.732  31.581 -15.735
  183   2HB   ALA  23          HB2       ALA  23 -24.466  31.009 -17.409
  184   3HB   ALA  23          HB3       ALA  23 -23.198  30.799 -16.193
  185    H    THR  24           H        THR  24 -24.278  33.013 -19.287
  186    HA   THR  24           HA       THR  24 -26.149  35.262 -18.818
  187    HB   THR  24           HB       THR  24 -25.523  34.035 -21.499
  188    HG1  THR  24           HG1      THR  24 -23.981  35.652 -21.686
  189   1HG2  THR  24          1HG2      THR  24 -27.462  35.559 -21.392
  190   2HG2  THR  24          2HG2      THR  24 -26.457  36.802 -20.581
  191   3HG2  THR  24          3HG2      THR  24 -26.121  36.309 -22.252
  192    H    ALA  25           H        ALA  25 -28.058  34.563 -18.072
  193    HA   ALA  25           HA       ALA  25 -29.116  31.957 -18.437
  194   1HB   ALA  25          HB1       ALA  25 -30.232  34.524 -17.312
  195   2HB   ALA  25          HB2       ALA  25 -31.135  33.016 -17.288
  196   3HB   ALA  25          HB3       ALA  25 -29.595  33.120 -16.454
  197    H    ASN  26           H        ASN  26 -31.007  31.260 -19.370
  198    HA   ASN  26           HA       ASN  26 -32.755  31.015 -20.695
  199   1HB   ASN  26          HB2       ASN  26 -33.282  33.293 -19.578
  200   2HB   ASN  26          HB3       ASN  26 -32.938  34.001 -21.149
  201   1HD2  ASN  26          1HD2      ASN  26 -36.274  31.636 -20.616
  202   2HD2  ASN  26          2HD2      ASN  26 -34.859  31.429 -19.549
  203    H    LEU  27           H        LEU  27 -29.932  32.045 -21.991
  204    HA   LEU  27           HA       LEU  27 -30.682  31.856 -24.836
  205   1HB   LEU  27          HB2       LEU  27 -27.938  31.981 -23.488
  206   2HB   LEU  27          HB3       LEU  27 -28.250  32.082 -25.218
  207    HG   LEU  27           HG       LEU  27 -29.089  34.133 -23.145
  208   1HD1  LEU  27          1HD1      LEU  27 -27.449  35.554 -24.288
  209   2HD1  LEU  27          2HD1      LEU  27 -26.695  34.087 -23.639
  210   3HD1  LEU  27          3HD1      LEU  27 -27.044  34.217 -25.367
  211   1HD2  LEU  27          1HD2      LEU  27 -29.506  34.099 -26.152
  212   2HD2  LEU  27          2HD2      LEU  27 -30.785  34.117 -24.904
  213   3HD2  LEU  27          3HD2      LEU  27 -29.734  35.534 -25.110
  214    H    SER  28           H        SER  28 -30.465  29.612 -22.462
  215    HA   SER  28           HA       SER  28 -30.214  27.356 -22.315
  216   1HB   SER  28          HB2       SER  28 -30.590  27.417 -25.335
  217   2HB   SER  28          HB3       SER  28 -30.660  25.975 -24.335
  218    HG   SER  28           HG       SER  28 -32.356  28.242 -24.164
  219    H    GLN  29           H        GLN  29 -27.767  29.006 -22.656
  220    HA   GLN  29           HA       GLN  29 -25.840  27.367 -24.089
  221   1HB   GLN  29          HB2       GLN  29 -24.212  28.984 -23.374
  222   2HB   GLN  29          HB3       GLN  29 -25.647  29.779 -24.007
  223   1HG   GLN  29          HG2       GLN  29 -26.396  30.307 -21.684
  224   2HG   GLN  29          HG3       GLN  29 -24.976  29.470 -21.039
  225   1HE2  GLN  29          1HE2      GLN  29 -23.115  32.480 -21.235
  226   2HE2  GLN  29          2HE2      GLN  29 -23.550  31.050 -20.286
  227    H    SER  30           H        SER  30 -23.700  26.858 -22.896
  228    HA   SER  30           HA       SER  30 -24.333  25.213 -20.464
  229   1HB   SER  30          HB2       SER  30 -22.528  24.489 -22.810
  230   2HB   SER  30          HB3       SER  30 -22.855  23.507 -21.374
  231    HG   SER  30           HG       SER  30 -24.118  22.890 -23.200
  232    H    VAL  31           H        VAL  31 -22.707  24.916 -18.990
  233    HA   VAL  31           HA       VAL  31 -20.237  26.587 -19.188
  234    HB   VAL  31           HB       VAL  31 -22.332  26.935 -17.001
  235   1HG1  VAL  31          1HG1      VAL  31 -20.895  28.824 -16.224
  236   2HG1  VAL  31          2HG1      VAL  31 -20.136  27.258 -16.027
  237   3HG1  VAL  31          3HG1      VAL  31 -19.651  28.323 -17.390
  238   1HG2  VAL  31          1HG2      VAL  31 -21.501  28.870 -19.184
  239   2HG2  VAL  31          2HG2      VAL  31 -23.096  28.125 -18.954
  240   3HG2  VAL  31          3HG2      VAL  31 -22.477  29.291 -17.780
  241    H    THR  32           H        THR  32 -18.533  25.817 -17.999
  242    HA   THR  32           HA       THR  32 -19.028  23.456 -16.237
  243    HB   THR  32           HB       THR  32 -16.415  24.237 -17.522
  244    HG1  THR  32           HG1      THR  32 -16.841  22.604 -18.998
  245   1HG2  THR  32          1HG2      THR  32 -17.364  21.640 -16.172
  246   2HG2  THR  32          2HG2      THR  32 -15.843  21.787 -17.074
  247   3HG2  THR  32          3HG2      THR  32 -16.085  22.716 -15.576
  248    H    LEU  33           H        LEU  33 -18.226  23.395 -14.175
  249    HA   LEU  33           HA       LEU  33 -16.236  25.319 -13.224
  250   1HB   LEU  33          HB2       LEU  33 -17.555  26.212 -11.374
  251   2HB   LEU  33          HB3       LEU  33 -18.162  26.675 -12.922
  252    HG   LEU  33           HG       LEU  33 -20.028  24.951 -12.687
  253   1HD1  LEU  33          1HD1      LEU  33 -19.200  23.443 -11.006
  254   2HD1  LEU  33          2HD1      LEU  33 -18.912  24.778  -9.873
  255   3HD1  LEU  33          3HD1      LEU  33 -20.564  24.305 -10.318
  256   1HD2  LEU  33          1HD2      LEU  33 -20.322  27.364 -12.230
  257   2HD2  LEU  33          2HD2      LEU  33 -21.335  26.374 -11.161
  258   3HD2  LEU  33          3HD2      LEU  33 -19.825  27.083 -10.531
  259    H    ALA  34           H        ALA  34 -15.663  24.787 -10.806
  260    HA   ALA  34           HA       ALA  34 -16.115  21.920 -10.211
  261   1HB   ALA  34          HB1       ALA  34 -14.512  21.924 -12.084
  262   2HB   ALA  34          HB2       ALA  34 -13.444  22.996 -11.143
  263   3HB   ALA  34          HB3       ALA  34 -13.761  21.357 -10.566
  264    H    CYS  35           H        CYS  35 -15.562  21.148  -8.372
  265    HA   CYS  35           HA       CYS  35 -14.010  22.683  -6.332
  266   1HB   CYS  35          HB2       CYS  35 -16.558  21.047  -6.067
  267   2HB   CYS  35          HB3       CYS  35 -15.371  21.038  -4.775
  268    H    ASP  36           H        ASP  36 -12.058  21.697  -7.141
  269    HA   ASP  36           HA       ASP  36 -12.127  18.927  -7.965
  270   1HB   ASP  36          HB2       ASP  36  -9.928  19.246  -8.808
  271   2HB   ASP  36          HB3       ASP  36 -10.980  20.562  -9.315
  272    H    ALA  37           H        ALA  37 -12.048  17.345  -6.698
  273    HA   ALA  37           HA       ALA  37 -10.545  17.436  -4.128
  274   1HB   ALA  37          HB1       ALA  37 -12.887  16.631  -4.102
  275   2HB   ALA  37          HB2       ALA  37 -12.477  15.382  -5.284
  276   3HB   ALA  37          HB3       ALA  37 -11.761  15.335  -3.653
  277    H    ASP  38           H        ASP  38  -8.819  16.137  -3.719
  278    HA   ASP  38           HA       ASP  38  -7.822  14.185  -5.742
  279   1HB   ASP  38          HB2       ASP  38  -6.300  16.557  -4.593
  280   2HB   ASP  38          HB3       ASP  38  -5.478  15.139  -5.273
  281    H    GLY  39           H        GLY  39  -6.764  12.488  -4.836
  282   1HA   GLY  39          HA2       GLY  39  -5.587  12.135  -2.336
  283   2HA   GLY  39          HA3       GLY  39  -7.308  11.784  -2.105
  284    H    PHE  40           H        PHE  40  -6.117   9.598  -1.594
  285    HA   PHE  40           HA       PHE  40  -6.682   7.944  -3.938
  286   1HB   PHE  40          HB2       PHE  40  -4.307   8.441  -4.172
  287   2HB   PHE  40          HB3       PHE  40  -3.978   7.700  -2.611
  288    HD1  PHE  40           HD1      PHE  40  -4.906   7.105  -6.139
  289    HD2  PHE  40           HD2      PHE  40  -4.120   5.231  -2.347
  290    HE1  PHE  40           HE1      PHE  40  -4.802   4.889  -7.253
  291    HE2  PHE  40           HE2      PHE  40  -3.992   3.003  -3.471
  292    HZ   PHE  40           HZ       PHE  40  -4.364   2.840  -5.932
  293    HA   PRO  41           HA       PRO  41  -7.516   6.025  -4.427
  294   1HB   PRO  41          HB2       PRO  41  -9.878   4.749  -4.189
  295   2HB   PRO  41          HB3       PRO  41  -8.333   3.944  -3.800
  296   1HG   PRO  41          HG2       PRO  41 -10.285   5.291  -1.850
  297   2HG   PRO  41          HG3       PRO  41  -9.589   3.629  -1.739
  298   1HD   PRO  41          HD2       PRO  41  -8.501   5.805  -0.455
  299   2HD   PRO  41          HD3       PRO  41  -7.486   4.477  -1.094
  300    H    GLU  42           H        GLU  42  -9.163   6.904  -5.827
  301    HA   GLU  42           HA       GLU  42  -9.923   9.444  -5.885
  302   1HB   GLU  42          HB2       GLU  42 -11.815   7.190  -6.622
  303   2HB   GLU  42          HB3       GLU  42 -11.938   8.887  -7.090
  304   1HG   GLU  42          HG2       GLU  42 -10.983   7.982  -8.948
  305   2HG   GLU  42          HG3       GLU  42  -9.566   8.619  -8.110
  306    HA   PRO  43           HA       PRO  43 -11.941   9.996  -1.903
  307   1HB   PRO  43          HB2       PRO  43 -12.441  12.718  -3.161
  308   2HB   PRO  43          HB3       PRO  43 -12.049  12.302  -1.451
  309   1HG   PRO  43          HG2       PRO  43 -10.078  13.089  -3.156
  310   2HG   PRO  43          HG3       PRO  43  -9.792  11.705  -2.068
  311   1HD   PRO  43          HD2       PRO  43 -10.567  11.741  -4.992
  312   2HD   PRO  43          HD3       PRO  43  -9.378  10.701  -4.164
  313    H    THR  44           H        THR  44 -13.994  10.324  -0.945
  314    HA   THR  44           HA       THR  44 -16.391  10.125  -2.747
  315    HB   THR  44           HB       THR  44 -16.087   9.847   0.271
  316    HG1  THR  44           HG1      THR  44 -15.218   8.162  -0.924
  317   1HG2  THR  44          1HG2      THR  44 -18.494   9.402  -1.524
  318   2HG2  THR  44          2HG2      THR  44 -18.372   8.861   0.178
  319   3HG2  THR  44          3HG2      THR  44 -18.364  10.574  -0.201
  320    H    MET  45           H        MET  45 -17.368  12.058  -3.288
  321    HA   MET  45           HA       MET  45 -17.137  14.341  -1.383
  322   1HB   MET  45          HB2       MET  45 -16.310  15.828  -3.027
  323   2HB   MET  45          HB3       MET  45 -15.273  14.439  -2.997
  324   1HG   MET  45          HG2       MET  45 -15.457  14.645  -5.264
  325   2HG   MET  45          HG3       MET  45 -16.852  13.604  -4.968
  326   1HE   MET  45          HE1       MET  45 -16.810  18.095  -6.024
  327   2HE   MET  45          HE2       MET  45 -16.103  17.483  -4.531
  328   3HE   MET  45          HE3       MET  45 -15.453  16.969  -6.116
  329    H    THR  46           H        THR  46 -18.604  16.006  -1.586
  330    HA   THR  46           HA       THR  46 -20.934  15.806  -3.396
  331    HB   THR  46           HB       THR  46 -22.584  15.960  -1.563
  332    HG1  THR  46           HG1      THR  46 -21.960  15.249   0.501
  333   1HG2  THR  46          1HG2      THR  46 -21.065  13.341  -1.407
  334   2HG2  THR  46          2HG2      THR  46 -22.782  13.633  -1.017
  335   3HG2  THR  46          3HG2      THR  46 -22.203  13.783  -2.681
  336    H    TRP  47           H        TRP  47 -22.472  17.614  -3.018
  337    HA   TRP  47           HA       TRP  47 -21.517  20.002  -1.732
  338   1HB   TRP  47          HB2       TRP  47 -21.063  21.300  -3.845
  339   2HB   TRP  47          HB3       TRP  47 -19.878  20.158  -3.283
  340    HD1  TRP  47           HD1      TRP  47 -21.027  17.588  -5.091
  341    HE1  TRP  47           HE1      TRP  47 -19.925  17.533  -7.404
  342    HE3  TRP  47           HE3      TRP  47 -19.784  22.510  -5.524
  343    HZ2  TRP  47           HZ2      TRP  47 -18.628  19.399  -9.189
  344    HZ3  TRP  47           HZ3      TRP  47 -18.793  23.397  -7.609
  345    HH2  TRP  47           HH2      TRP  47 -18.277  21.806  -9.489
  346    H    THR  48           H        THR  48 -22.762  22.000  -2.456
  347    HA   THR  48           HA       THR  48 -25.586  21.164  -2.997
  348    HB   THR  48           HB       THR  48 -26.368  22.568  -1.192
  349    HG1  THR  48           HG1      THR  48 -24.815  23.451   0.230
  350   1HG2  THR  48          1HG2      THR  48 -25.702  20.198  -0.635
  351   2HG2  THR  48          2HG2      THR  48 -24.135  20.813  -0.073
  352   3HG2  THR  48          3HG2      THR  48 -25.619  21.303   0.748
  353    H    LYS  49           H        LYS  49 -27.082  22.667  -3.549
  354    HA   LYS  49           HA       LYS  49 -26.144  24.866  -5.339
  355   1HB   LYS  49          HB2       LYS  49 -27.554  22.783  -6.035
  356   2HB   LYS  49          HB3       LYS  49 -28.857  23.500  -5.130
  357   1HG   LYS  49          HG2       LYS  49 -29.316  24.068  -7.331
  358   2HG   LYS  49          HG3       LYS  49 -28.624  25.551  -6.668
  359   1HD   LYS  49          HD2       LYS  49 -26.470  25.048  -7.807
  360   2HD   LYS  49          HD3       LYS  49 -27.100  23.468  -8.351
  361   1HE   LYS  49          HE2       LYS  49 -28.996  24.758  -9.467
  362   2HE   LYS  49          HE3       LYS  49 -28.080  26.235  -9.147
  363   1HZ   LYS  49          HZ1       LYS  49 -27.070  23.905 -10.710
  364   2HZ   LYS  49          HZ2       LYS  49 -27.684  25.238 -11.392
  365   3HZ   LYS  49          HZ3       LYS  49 -26.281  25.333 -10.540
  366    H    ASP  50           H        ASP  50 -25.868  25.743  -2.912
  367    HA   ASP  50           HA       ASP  50 -26.378  27.326  -1.401
  368   1HB   ASP  50          HB2       ASP  50 -27.450  28.588  -3.272
  369   2HB   ASP  50          HB3       ASP  50 -29.018  27.968  -2.748
  370    H    GLY  51           H        GLY  51 -27.972  24.468  -1.643
  371   1HA   GLY  51          HA2       GLY  51 -28.316  24.126   1.100
  372   2HA   GLY  51          HA3       GLY  51 -29.882  24.708   0.555
  373    H    GLU  52           H        GLU  52 -29.713  23.257  -2.077
  374    HA   GLU  52           HA       GLU  52 -30.391  20.525  -1.102
  375   1HB   GLU  52          HB2       GLU  52 -31.641  20.252  -3.154
  376   2HB   GLU  52          HB3       GLU  52 -32.163  21.673  -2.285
  377   1HG   GLU  52          HG2       GLU  52 -30.833  23.114  -3.830
  378   2HG   GLU  52          HG3       GLU  52 -30.352  21.664  -4.729
  379    HA   PRO  53           HA       PRO  53 -26.730  18.992  -2.649
  380   1HB   PRO  53          HB2       PRO  53 -27.131  16.322  -3.065
  381   2HB   PRO  53          HB3       PRO  53 -27.285  17.100  -1.450
  382   1HG   PRO  53          HG2       PRO  53 -29.509  16.487  -3.440
  383   2HG   PRO  53          HG3       PRO  53 -29.432  16.054  -1.697
  384   1HD   PRO  53          HD2       PRO  53 -30.739  18.273  -2.589
  385   2HD   PRO  53          HD3       PRO  53 -29.801  18.297  -1.067
  386    H    ILE  54           H        ILE  54 -25.448  18.928  -4.317
  387    HA   ILE  54           HA       ILE  54 -26.285  18.140  -7.049
  388    HB   ILE  54           HB       ILE  54 -23.748  19.602  -6.144
  389   1HG1  ILE  54          2HG1      ILE  54 -26.277  20.931  -7.229
  390   2HG1  ILE  54          3HG1      ILE  54 -25.823  20.941  -5.518
  391   1HG2  ILE  54          1HG2      ILE  54 -25.064  19.645  -8.883
  392   2HG2  ILE  54          2HG2      ILE  54 -23.474  20.284  -8.437
  393   3HG2  ILE  54          3HG2      ILE  54 -23.728  18.572  -8.504
  394   1HD1  ILE  54          1HD1      ILE  54 -24.215  22.226  -7.712
  395   2HD1  ILE  54          2HD1      ILE  54 -25.133  23.033  -6.437
  396   3HD1  ILE  54          3HD1      ILE  54 -23.734  22.067  -5.999
  397    H    GLU  55           H        GLU  55 -26.070  16.100  -5.182
  398    HA   GLU  55           HA       GLU  55 -23.390  15.024  -5.037
  399   1HB   GLU  55          HB2       GLU  55 -24.355  13.193  -3.852
  400   2HB   GLU  55          HB3       GLU  55 -24.976  14.738  -3.238
  401   1HG   GLU  55          HG2       GLU  55 -27.097  14.334  -4.490
  402   2HG   GLU  55          HG3       GLU  55 -26.474  12.773  -4.997
  403    H    GLN  56           H        GLN  56 -22.398  13.402  -6.069
  404    HA   GLN  56           HA       GLN  56 -23.015  13.126  -8.783
  405   1HB   GLN  56          HB2       GLN  56 -20.849  11.860  -7.016
  406   2HB   GLN  56          HB3       GLN  56 -20.886  11.774  -8.779
  407   1HG   GLN  56          HG2       GLN  56 -20.937  14.284  -8.873
  408   2HG   GLN  56          HG3       GLN  56 -20.576  14.324  -7.134
  409   1HE2  GLN  56          1HE2      GLN  56 -17.473  14.157  -9.545
  410   2HE2  GLN  56          2HE2      GLN  56 -19.006  14.957  -9.835
  411    H    GLU  57           H        GLU  57 -24.517  11.407  -6.466
  412    HA   GLU  57           HA       GLU  57 -24.703   8.846  -8.030
  413   1HB   GLU  57          HB2       GLU  57 -25.129   9.419  -5.084
  414   2HB   GLU  57          HB3       GLU  57 -25.385   7.859  -5.883
  415   1HG   GLU  57          HG2       GLU  57 -23.008   7.858  -6.622
  416   2HG   GLU  57          HG3       GLU  57 -22.733   9.358  -5.692
  417    H    ASP  58           H        ASP  58 -26.559  11.640  -7.318
  418    HA   ASP  58           HA       ASP  58 -29.082  10.215  -8.019
  419   1HB   ASP  58          HB2       ASP  58 -28.626  10.034  -5.530
  420   2HB   ASP  58          HB3       ASP  58 -28.752  11.791  -5.426
  421    H    ASN  59           H        ASN  59 -27.254  13.008  -8.457
  422    HA   ASN  59           HA       ASN  59 -29.661  14.576  -9.294
  423   1HB   ASN  59          HB2       ASN  59 -27.392  15.525  -7.513
  424   2HB   ASN  59          HB3       ASN  59 -28.355  16.616  -8.500
  425   1HD2  ASN  59          1HD2      ASN  59 -30.059  14.940  -5.191
  426   2HD2  ASN  59          2HD2      ASN  59 -28.489  14.397  -5.739
  427    H    GLU  60           H        GLU  60 -29.580  14.890 -11.359
  428    HA   GLU  60           HA       GLU  60 -27.125  15.472 -12.890
  429   1HB   GLU  60          HB2       GLU  60 -27.631  12.929 -12.281
  430   2HB   GLU  60          HB3       GLU  60 -28.928  13.102 -13.476
  431   1HG   GLU  60          HG2       GLU  60 -27.127  13.813 -15.128
  432   2HG   GLU  60          HG3       GLU  60 -25.941  13.558 -13.845
  433    H    GLU  61           H        GLU  61 -30.086  16.495 -12.352
  434    HA   GLU  61           HA       GLU  61 -31.801  16.160 -14.463
  435   1HB   GLU  61          HB2       GLU  61 -31.459  18.707 -12.797
  436   2HB   GLU  61          HB3       GLU  61 -32.848  18.324 -13.819
  437   1HG   GLU  61          HG2       GLU  61 -33.167  16.201 -12.496
  438   2HG   GLU  61          HG3       GLU  61 -31.933  16.767 -11.378
  439    H    LYS  62           H        LYS  62 -29.116  18.401 -14.637
  440    HA   LYS  62           HA       LYS  62 -29.266  18.373 -17.524
  441   1HB   LYS  62          HB2       LYS  62 -29.411  20.781 -17.983
  442   2HB   LYS  62          HB3       LYS  62 -30.870  20.165 -17.217
  443   1HG   LYS  62          HG2       LYS  62 -30.032  21.094 -15.001
  444   2HG   LYS  62          HG3       LYS  62 -28.700  21.824 -15.893
  445   1HD   LYS  62          HD2       LYS  62 -30.493  22.986 -17.341
  446   2HD   LYS  62          HD3       LYS  62 -31.673  22.403 -16.132
  447   1HE   LYS  62          HE2       LYS  62 -30.416  23.546 -14.339
  448   2HE   LYS  62          HE3       LYS  62 -29.189  24.058 -15.506
  449   1HZ   LYS  62          HZ1       LYS  62 -32.012  24.949 -15.495
  450   2HZ   LYS  62          HZ2       LYS  62 -30.650  25.868 -15.195
  451   3HZ   LYS  62          HZ3       LYS  62 -30.931  25.274 -16.708
  452    H    TYR  63           H        TYR  63 -27.380  17.297 -15.923
  453    HA   TYR  63           HA       TYR  63 -24.980  18.771 -16.656
  454   1HB   TYR  63          HB2       TYR  63 -24.201  18.920 -14.208
  455   2HB   TYR  63          HB3       TYR  63 -25.271  20.128 -14.859
  456    HD1  TYR  63           HD1      TYR  63 -27.495  20.455 -14.087
  457    HD2  TYR  63           HD2      TYR  63 -25.007  17.375 -12.417
  458    HE1  TYR  63           HE1      TYR  63 -29.065  20.264 -12.176
  459    HE2  TYR  63           HE2      TYR  63 -26.494  17.267 -10.439
  460    HH   TYR  63           HH       TYR  63 -29.474  19.243 -10.125
  461    H    SER  64           H        SER  64 -23.001  17.853 -16.149
  462    HA   SER  64           HA       SER  64 -22.885  15.012 -15.338
  463   1HB   SER  64          HB2       SER  64 -21.624  14.376 -17.371
  464   2HB   SER  64          HB3       SER  64 -23.300  14.775 -17.698
  465    HG   SER  64           HG       SER  64 -21.995  15.758 -19.242
  466    H    PHE  65           H        PHE  65 -20.877  14.347 -14.585
  467    HA   PHE  65           HA       PHE  65 -18.616  16.264 -14.380
  468   1HB   PHE  65          HB2       PHE  65 -19.004  15.822 -11.890
  469   2HB   PHE  65          HB3       PHE  65 -20.241  16.693 -12.814
  470    HD1  PHE  65           HD1      PHE  65 -19.518  13.049 -11.882
  471    HD2  PHE  65           HD2      PHE  65 -22.467  16.192 -12.310
  472    HE1  PHE  65           HE1      PHE  65 -21.332  11.462 -11.328
  473    HE2  PHE  65           HE2      PHE  65 -24.231  14.616 -11.682
  474    HZ   PHE  65           HZ       PHE  65 -23.687  12.249 -11.226
  475    H    ASN  66           H        ASN  66 -17.109  15.021 -12.534
  476    HA   ASN  66           HA       ASN  66 -16.683  12.196 -13.237
  477   1HB   ASN  66          HB2       ASN  66 -14.617  12.404 -14.278
  478   2HB   ASN  66          HB3       ASN  66 -15.462  13.815 -14.924
  479   1HD2  ASN  66          1HD2      ASN  66 -13.356  16.145 -13.247
  480   2HD2  ASN  66          2HD2      ASN  66 -15.046  15.959 -13.693
  481    H    TYR  67           H        TYR  67 -14.646  11.324 -12.057
  482    HA   TYR  67           HA       TYR  67 -14.976  12.027  -9.170
  483   1HB   TYR  67          HB2       TYR  67 -14.016   9.462 -10.441
  484   2HB   TYR  67          HB3       TYR  67 -14.381   9.729  -8.761
  485    HD1  TYR  67           HD1      TYR  67 -16.832  10.592  -8.226
  486    HD2  TYR  67           HD2      TYR  67 -15.689   8.578 -11.861
  487    HE1  TYR  67           HE1      TYR  67 -19.206   9.910  -8.586
  488    HE2  TYR  67           HE2      TYR  67 -18.069   7.905 -12.215
  489    HH   TYR  67           HH       TYR  67 -20.679   8.874 -10.004
  490    H    ASP  68           H        ASP  68 -12.579  12.520 -11.523
  491    HA   ASP  68           HA       ASP  68 -10.255  12.148  -9.701
  492   1HB   ASP  68          HB2       ASP  68 -10.351  11.098 -12.024
  493   2HB   ASP  68          HB3       ASP  68 -10.284  12.733 -12.676
  494    H    GLY  69           H        GLY  69 -12.343  14.392  -9.858
  495   1HA   GLY  69          HA2       GLY  69 -10.838  16.576  -8.844
  496   2HA   GLY  69          HA3       GLY  69 -11.253  16.894 -10.539
  497    H    SER  70           H        SER  70 -13.367  17.086 -11.124
  498    HA   SER  70           HA       SER  70 -15.688  16.237  -9.821
  499   1HB   SER  70          HB2       SER  70 -16.759  18.295  -9.089
  500   2HB   SER  70          HB3       SER  70 -15.384  17.920  -8.089
  501    HG   SER  70           HG       SER  70 -14.147  19.411  -9.281
  502    H    GLU  71           H        GLU  71 -14.323  18.880 -11.713
  503    HA   GLU  71           HA       GLU  71 -15.383  20.304 -13.258
  504   1HB   GLU  71          HB2       GLU  71 -14.558  17.815 -14.756
  505   2HB   GLU  71          HB3       GLU  71 -14.873  19.385 -15.495
  506   1HG   GLU  71          HG2       GLU  71 -12.479  19.065 -15.199
  507   2HG   GLU  71          HG3       GLU  71 -13.073  20.434 -14.253
  508    H    LEU  72           H        LEU  72 -17.452  20.465 -12.419
  509    HA   LEU  72           HA       LEU  72 -19.618  18.783 -13.483
  510   1HB   LEU  72          HB2       LEU  72 -19.676  19.468 -11.153
  511   2HB   LEU  72          HB3       LEU  72 -19.470  21.155 -11.587
  512    HG   LEU  72           HG       LEU  72 -21.709  21.087 -12.756
  513   1HD1  LEU  72          1HD1      LEU  72 -21.952  18.686 -13.189
  514   2HD1  LEU  72          2HD1      LEU  72 -21.851  18.347 -11.429
  515   3HD1  LEU  72          3HD1      LEU  72 -23.238  19.227 -12.065
  516   1HD2  LEU  72          1HD2      LEU  72 -21.412  21.971 -10.492
  517   2HD2  LEU  72          2HD2      LEU  72 -22.996  21.156 -10.661
  518   3HD2  LEU  72          3HD2      LEU  72 -21.659  20.350  -9.813
  519    H    ILE  73           H        ILE  73 -20.250  19.119 -15.432
  520    HA   ILE  73           HA       ILE  73 -20.277  21.769 -16.749
  521    HB   ILE  73           HB       ILE  73 -20.913  19.055 -17.923
  522   1HG1  ILE  73          2HG1      ILE  73 -18.182  20.279 -18.420
  523   2HG1  ILE  73          3HG1      ILE  73 -18.391  19.376 -16.917
  524   1HG2  ILE  73          1HG2      ILE  73 -21.686  20.998 -19.200
  525   2HG2  ILE  73          2HG2      ILE  73 -20.067  21.735 -19.114
  526   3HG2  ILE  73          3HG2      ILE  73 -20.329  20.247 -20.077
  527   1HD1  ILE  73          1HD1      ILE  73 -17.553  17.935 -18.653
  528   2HD1  ILE  73          2HD1      ILE  73 -19.168  17.436 -18.070
  529   3HD1  ILE  73          3HD1      ILE  73 -19.008  18.234 -19.650
  530    H    ILE  74           H        ILE  74 -22.132  22.832 -16.869
  531    HA   ILE  74           HA       ILE  74 -24.747  21.409 -16.431
  532    HB   ILE  74           HB       ILE  74 -24.049  24.315 -15.808
  533   1HG1  ILE  74          2HG1      ILE  74 -24.505  22.021 -13.814
  534   2HG1  ILE  74          3HG1      ILE  74 -22.913  22.645 -14.252
  535   1HG2  ILE  74          1HG2      ILE  74 -26.428  23.923 -16.410
  536   2HG2  ILE  74          2HG2      ILE  74 -26.535  22.641 -15.189
  537   3HG2  ILE  74          3HG2      ILE  74 -26.299  24.332 -14.714
  538   1HD1  ILE  74          1HD1      ILE  74 -23.554  24.911 -13.468
  539   2HD1  ILE  74          2HD1      ILE  74 -25.051  24.200 -12.814
  540   3HD1  ILE  74          3HD1      ILE  74 -23.468  23.636 -12.230
  541    H    LYS  75           H        LYS  75 -26.028  21.364 -18.158
  542    HA   LYS  75           HA       LYS  75 -25.575  23.331 -20.351
  543   1HB   LYS  75          HB2       LYS  75 -26.631  21.854 -21.843
  544   2HB   LYS  75          HB3       LYS  75 -25.371  20.969 -20.989
  545   1HG   LYS  75          HG2       LYS  75 -27.270  20.109 -19.440
  546   2HG   LYS  75          HG3       LYS  75 -28.406  20.761 -20.612
  547   1HD   LYS  75          HD2       LYS  75 -26.270  18.655 -21.119
  548   2HD   LYS  75          HD3       LYS  75 -27.982  18.352 -20.969
  549   1HE   LYS  75          HE2       LYS  75 -26.690  20.034 -23.184
  550   2HE   LYS  75          HE3       LYS  75 -27.120  18.322 -23.328
  551   1HZ   LYS  75          HZ1       LYS  75 -28.846  19.735 -24.237
  552   2HZ   LYS  75          HZ2       LYS  75 -29.429  18.912 -22.954
  553   3HZ   LYS  75          HZ3       LYS  75 -29.090  20.505 -22.815
  554    H    LYS  76           H        LYS  76 -27.302  24.359 -21.224
  555    HA   LYS  76           HA       LYS  76 -29.216  25.624 -21.287
  556   1HB   LYS  76          HB2       LYS  76 -30.177  23.365 -21.666
  557   2HB   LYS  76          HB3       LYS  76 -30.514  23.222 -19.946
  558   1HG   LYS  76          HG2       LYS  76 -32.140  25.034 -20.061
  559   2HG   LYS  76          HG3       LYS  76 -31.576  25.484 -21.669
  560   1HD   LYS  76          HD2       LYS  76 -32.392  23.306 -22.548
  561   2HD   LYS  76          HD3       LYS  76 -32.999  22.899 -20.919
  562   1HE   LYS  76          HE2       LYS  76 -34.457  24.906 -20.992
  563   2HE   LYS  76          HE3       LYS  76 -33.811  25.333 -22.592
  564   1HZ   LYS  76          HZ1       LYS  76 -35.334  22.830 -21.988
  565   2HZ   LYS  76          HZ2       LYS  76 -35.966  24.127 -22.715
  566   3HZ   LYS  76          HZ3       LYS  76 -34.801  23.277 -23.469
  567    H    VAL  77           H        VAL  77 -27.701  26.744 -19.669
  568    HA   VAL  77           HA       VAL  77 -28.573  26.872 -16.919
  569    HB   VAL  77           HB       VAL  77 -26.681  28.626 -18.513
  570   1HG1  VAL  77          1HG1      VAL  77 -27.373  29.916 -16.566
  571   2HG1  VAL  77          2HG1      VAL  77 -27.148  28.516 -15.498
  572   3HG1  VAL  77          3HG1      VAL  77 -25.747  29.247 -16.282
  573   1HG2  VAL  77          1HG2      VAL  77 -26.179  26.380 -16.548
  574   2HG2  VAL  77          2HG2      VAL  77 -25.935  26.269 -18.301
  575   3HG2  VAL  77          3HG2      VAL  77 -24.929  27.353 -17.328
  576    H    ASP  78           H        ASP  78 -29.688  28.432 -15.804
  577    HA   ASP  78           HA       ASP  78 -30.673  30.871 -17.115
  578   1HB   ASP  78          HB2       ASP  78 -32.404  28.833 -17.240
  579   2HB   ASP  78          HB3       ASP  78 -32.738  29.358 -15.598
  580    H    LYS  79           H        LYS  79 -32.081  32.089 -15.150
  581    HA   LYS  79           HA       LYS  79 -30.118  32.434 -12.997
  582   1HB   LYS  79          HB2       LYS  79 -32.760  33.758 -13.612
  583   2HB   LYS  79          HB3       LYS  79 -31.969  34.009 -12.070
  584   1HG   LYS  79          HG2       LYS  79 -29.850  34.698 -13.300
  585   2HG   LYS  79          HG3       LYS  79 -30.750  34.623 -14.809
  586   1HD   LYS  79          HD2       LYS  79 -30.681  36.909 -14.125
  587   2HD   LYS  79          HD3       LYS  79 -32.335  36.316 -13.999
  588   1HE   LYS  79          HE2       LYS  79 -31.833  37.772 -12.166
  589   2HE   LYS  79          HE3       LYS  79 -32.103  36.155 -11.521
  590   1HZ   LYS  79          HZ1       LYS  79 -30.066  37.589 -10.762
  591   2HZ   LYS  79          HZ2       LYS  79 -29.882  36.001 -10.887
  592   3HZ   LYS  79          HZ3       LYS  79 -29.322  36.941 -12.093
  593    H    SER  80           H        SER  80 -32.523  30.128 -13.388
  594    HA   SER  80           HA       SER  80 -33.089  29.626 -10.565
  595   1HB   SER  80          HB2       SER  80 -33.876  27.433 -11.447
  596   2HB   SER  80          HB3       SER  80 -34.648  28.835 -12.200
  597    HG   SER  80           HG       SER  80 -33.965  27.271 -13.759
  598    H    ASP  81           H        ASP  81 -30.282  29.235 -12.572
  599    HA   ASP  81           HA       ASP  81 -29.100  27.112 -10.880
  600   1HB   ASP  81          HB2       ASP  81 -28.049  28.700 -13.244
  601   2HB   ASP  81          HB3       ASP  81 -27.103  27.538 -12.378
  602    H    GLU  82           H        GLU  82 -29.440  30.479 -10.515
  603    HA   GLU  82           HA       GLU  82 -26.901  31.260  -9.524
  604   1HB   GLU  82          HB2       GLU  82 -28.834  32.741 -10.098
  605   2HB   GLU  82          HB3       GLU  82 -29.670  32.211  -8.626
  606   1HG   GLU  82          HG2       GLU  82 -27.786  33.121  -7.245
  607   2HG   GLU  82          HG3       GLU  82 -27.004  33.677  -8.727
  608    H    ALA  83           H        ALA  83 -25.793  30.501  -7.805
  609    HA   ALA  83           HA       ALA  83 -27.105  29.414  -5.378
  610   1HB   ALA  83          HB1       ALA  83 -26.001  27.123  -5.874
  611   2HB   ALA  83          HB2       ALA  83 -27.306  27.570  -7.002
  612   3HB   ALA  83          HB3       ALA  83 -25.609  27.778  -7.473
  613    H    GLU  84           H        GLU  84 -25.643  28.766  -3.728
  614    HA   GLU  84           HA       GLU  84 -22.819  29.688  -3.979
  615   1HB   GLU  84          HB2       GLU  84 -24.172  30.830  -2.268
  616   2HB   GLU  84          HB3       GLU  84 -24.425  29.282  -1.446
  617   1HG   GLU  84          HG2       GLU  84 -21.974  29.064  -1.088
  618   2HG   GLU  84          HG3       GLU  84 -21.694  30.479  -2.074
  619    H    TYR  85           H        TYR  85 -21.512  28.103  -4.421
  620    HA   TYR  85           HA       TYR  85 -22.339  25.284  -4.175
  621   1HB   TYR  85          HB2       TYR  85 -20.263  26.752  -5.741
  622   2HB   TYR  85          HB3       TYR  85 -20.225  25.012  -5.581
  623    HD1  TYR  85           HD1      TYR  85 -21.374  23.610  -7.052
  624    HD2  TYR  85           HD2      TYR  85 -22.475  27.769  -6.768
  625    HE1  TYR  85           HE1      TYR  85 -22.812  23.380  -9.044
  626    HE2  TYR  85           HE2      TYR  85 -23.962  27.471  -8.768
  627    HH   TYR  85           HH       TYR  85 -24.170  24.389 -10.501
  628    H    ILE  86           H        ILE  86 -22.099  25.346  -1.810
  629    HA   ILE  86           HA       ILE  86 -19.304  25.232  -0.778
  630    HB   ILE  86           HB       ILE  86 -21.882  24.428   0.605
  631   1HG1  ILE  86          2HG1      ILE  86 -20.234  27.006   0.881
  632   2HG1  ILE  86          3HG1      ILE  86 -21.732  26.864  -0.001
  633   1HG2  ILE  86          1HG2      ILE  86 -19.028  24.879   1.685
  634   2HG2  ILE  86          2HG2      ILE  86 -20.469  24.486   2.668
  635   3HG2  ILE  86          3HG2      ILE  86 -19.847  23.309   1.541
  636   1HD1  ILE  86          1HD1      ILE  86 -21.395  26.557   2.974
  637   2HD1  ILE  86          2HD1      ILE  86 -22.238  27.828   2.117
  638   3HD1  ILE  86          3HD1      ILE  86 -22.901  26.180   2.069
  639    H    CYS  87           H        CYS  87 -18.163  23.386  -0.556
  640    HA   CYS  87           HA       CYS  87 -19.292  20.804  -1.415
  641   1HB   CYS  87          HB2       CYS  87 -17.474  20.621  -3.102
  642   2HB   CYS  87          HB3       CYS  87 -18.588  21.937  -3.424
  643    H    ILE  88           H        ILE  88 -18.317  18.992  -0.784
  644    HA   ILE  88           HA       ILE  88 -16.173  19.200   1.287
  645    HB   ILE  88           HB       ILE  88 -18.849  17.730   1.504
  646   1HG1  ILE  88          2HG1      ILE  88 -17.871  20.283   2.905
  647   2HG1  ILE  88          3HG1      ILE  88 -19.221  20.162   1.767
  648   1HG2  ILE  88          1HG2      ILE  88 -18.143  17.222   3.834
  649   2HG2  ILE  88          2HG2      ILE  88 -16.990  16.577   2.711
  650   3HG2  ILE  88          3HG2      ILE  88 -16.593  18.073   3.575
  651   1HD1  ILE  88          1HD1      ILE  88 -20.409  18.685   3.395
  652   2HD1  ILE  88          2HD1      ILE  88 -19.152  19.083   4.600
  653   3HD1  ILE  88          3HD1      ILE  88 -20.155  20.363   3.919
  654    H    ALA  89           H        ALA  89 -14.887  17.375   1.481
  655    HA   ALA  89           HA       ALA  89 -15.528  14.978  -0.085
  656   1HB   ALA  89          HB1       ALA  89 -13.274  14.820  -0.995
  657   2HB   ALA  89          HB2       ALA  89 -14.016  16.362  -1.474
  658   3HB   ALA  89          HB3       ALA  89 -12.839  16.321  -0.141
  659    H    GLU  90           H        GLU  90 -14.538  13.089   0.595
  660    HA   GLU  90           HA       GLU  90 -13.350  13.008   3.339
  661   1HB   GLU  90          HB2       GLU  90 -15.937  13.136   3.369
  662   2HB   GLU  90          HB3       GLU  90 -15.923  11.560   2.565
  663   1HG   GLU  90          HG2       GLU  90 -14.583  10.644   4.507
  664   2HG   GLU  90          HG3       GLU  90 -14.741  12.210   5.298
  665    H    ASN  91           H        ASN  91 -12.412  10.993   3.824
  666    HA   ASN  91           HA       ASN  91 -12.510   8.739   1.960
  667   1HB   ASN  91          HB2       ASN  91 -10.546  10.647   1.463
  668   2HB   ASN  91          HB3       ASN  91  -9.671   9.540   2.521
  669   1HD2  ASN  91          1HD2      ASN  91  -9.468   8.628  -1.195
  670   2HD2  ASN  91          2HD2      ASN  91  -9.208  10.114  -0.292
  671    H    LYS  92           H        LYS  92 -10.905   6.934   2.877
  672    HA   LYS  92           HA       LYS  92 -11.411   6.421   5.640
  673   1HB   LYS  92          HB2       LYS  92 -10.031   4.538   5.404
  674   2HB   LYS  92          HB3       LYS  92 -10.749   4.739   3.825
  675   1HG   LYS  92          HG2       LYS  92  -7.891   5.466   4.620
  676   2HG   LYS  92          HG3       LYS  92  -8.429   4.026   3.750
  677   1HD   LYS  92          HD2       LYS  92  -9.142   5.371   1.809
  678   2HD   LYS  92          HD3       LYS  92  -8.713   6.868   2.661
  679   1HE   LYS  92          HE2       LYS  92  -6.971   6.319   1.090
  680   2HE   LYS  92          HE3       LYS  92  -6.351   6.224   2.738
  681   1HZ   LYS  92          HZ1       LYS  92  -6.468   3.835   2.656
  682   2HZ   LYS  92          HZ2       LYS  92  -7.238   3.825   1.199
  683   3HZ   LYS  92          HZ3       LYS  92  -5.680   4.311   1.293
  684    H    ALA  93           H        ALA  93  -8.884   8.246   4.186
  685    HA   ALA  93           HA       ALA  93  -7.222   8.364   6.633
  686   1HB   ALA  93          HB1       ALA  93  -6.739   9.385   3.804
  687   2HB   ALA  93          HB2       ALA  93  -5.551   9.309   5.100
  688   3HB   ALA  93          HB3       ALA  93  -6.221   7.801   4.419
  689    H    GLY  94           H        GLY  94  -9.738  10.399   5.408
  690   1HA   GLY  94          HA2       GLY  94  -9.201  12.535   7.188
  691   2HA   GLY  94          HA3       GLY  94  -8.388  12.933   5.668
  692    H    GLU  95           H        GLU  95  -9.784  14.770   5.789
  693    HA   GLU  95           HA       GLU  95 -12.321  14.585   4.379
  694   1HB   GLU  95          HB2       GLU  95 -12.836  13.962   6.821
  695   2HB   GLU  95          HB3       GLU  95 -12.290  15.577   7.262
  696   1HG   GLU  95          HG2       GLU  95 -14.097  16.529   5.813
  697   2HG   GLU  95          HG3       GLU  95 -14.649  14.864   5.461
  698    H    GLN  96           H        GLN  96 -12.848  16.703   3.505
  699    HA   GLN  96           HA       GLN  96 -11.643  19.164   4.565
  700   1HB   GLN  96          HB2       GLN  96  -9.940  17.802   2.942
  701   2HB   GLN  96          HB3       GLN  96 -10.859  18.616   1.724
  702   1HG   GLN  96          HG2       GLN  96  -9.477  20.377   2.028
  703   2HG   GLN  96          HG3       GLN  96 -10.332  20.685   3.539
  704   1HE2  GLN  96          1HE2      GLN  96  -7.579  18.826   5.324
  705   2HE2  GLN  96          2HE2      GLN  96  -9.291  18.454   5.119
  706    H    ASP  97           H        ASP  97 -12.116  21.097   2.959
  707    HA   ASP  97           HA       ASP  97 -14.540  20.786   1.362
  708   1HB   ASP  97          HB2       ASP  97 -15.966  22.222   2.703
  709   2HB   ASP  97          HB3       ASP  97 -15.462  20.853   3.636
  710    H    ALA  98           H        ALA  98 -15.202  22.648   0.199
  711    HA   ALA  98           HA       ALA  98 -13.714  25.185   0.393
  712   1HB   ALA  98          HB1       ALA  98 -13.019  25.213  -1.904
  713   2HB   ALA  98          HB2       ALA  98 -12.422  23.720  -1.203
  714   3HB   ALA  98          HB3       ALA  98 -13.821  23.699  -2.285
  715    H    THR  99           H        THR  99 -14.687  26.735  -1.497
  716    HA   THR  99           HA       THR  99 -17.644  26.450  -1.738
  717    HB   THR  99           HB       THR  99 -16.232  28.744  -0.365
  718    HG1  THR  99           HG1      THR  99 -16.697  26.731   0.819
  719   1HG2  THR  99          1HG2      THR  99 -18.147  29.680  -1.568
  720   2HG2  THR  99          2HG2      THR  99 -19.196  28.324  -1.047
  721   3HG2  THR  99          3HG2      THR  99 -18.597  29.533   0.116
  722    H    ILE 100           H        ILE 100 -18.472  27.468  -3.499
  723    HA   ILE 100           HA       ILE 100 -16.996  29.609  -4.916
  724    HB   ILE 100           HB       ILE 100 -18.732  27.902  -6.633
  725   1HG1  ILE 100          2HG1      ILE 100 -15.940  26.826  -6.171
  726   2HG1  ILE 100          3HG1      ILE 100 -17.347  26.138  -5.370
  727   1HG2  ILE 100          1HG2      ILE 100 -16.035  29.226  -7.059
  728   2HG2  ILE 100          2HG2      ILE 100 -17.000  28.463  -8.332
  729   3HG2  ILE 100          3HG2      ILE 100 -17.637  29.887  -7.520
  730   1HD1  ILE 100          1HD1      ILE 100 -17.066  26.302  -8.387
  731   2HD1  ILE 100          2HD1      ILE 100 -16.863  24.863  -7.355
  732   3HD1  ILE 100          3HD1      ILE 100 -18.442  25.655  -7.472
  733    H    HIS 101           H        HIS 101 -18.647  30.838  -6.411
  734    HA   HIS 101           HA       HIS 101 -21.495  30.536  -5.650
  735   1HB   HIS 101          HB2       HIS 101 -20.661  32.226  -4.094
  736   2HB   HIS 101          HB3       HIS 101 -19.939  33.140  -5.442
  737    HD1  HIS 101           HD1      HIS 101 -23.599  31.818  -5.504
  738    HD2  HIS 101           HD2      HIS 101 -21.341  35.329  -4.923
  739    HE1  HIS 101           HE1      HIS 101 -25.260  33.780  -5.466
  740    H    LEU 102           H        LEU 102 -22.805  30.877  -7.255
  741    HA   LEU 102           HA       LEU 102 -21.679  31.403  -9.969
  742   1HB   LEU 102          HB2       LEU 102 -22.438  29.143  -9.642
  743   2HB   LEU 102          HB3       LEU 102 -24.018  29.688  -9.052
  744    HG   LEU 102           HG       LEU 102 -24.675  30.461 -11.217
  745   1HD1  LEU 102          1HD1      LEU 102 -22.599  31.447 -12.100
  746   2HD1  LEU 102          2HD1      LEU 102 -21.876  29.815 -12.253
  747   3HD1  LEU 102          3HD1      LEU 102 -23.252  30.304 -13.255
  748   1HD2  LEU 102          1HD2      LEU 102 -24.817  28.005 -10.876
  749   2HD2  LEU 102          2HD2      LEU 102 -24.620  28.418 -12.572
  750   3HD2  LEU 102          3HD2      LEU 102 -23.249  27.808 -11.619
  751    H    LYS 103           H        LYS 103 -21.936  33.573 -10.133
  752    HA   LYS 103           HA       LYS 103 -24.466  34.963  -9.522
  753   1HB   LYS 103          HB2       LYS 103 -21.805  35.998 -10.551
  754   2HB   LYS 103          HB3       LYS 103 -23.200  36.969 -10.043
  755   1HG   LYS 103          HG2       LYS 103 -23.025  35.948  -7.740
  756   2HG   LYS 103          HG3       LYS 103 -21.612  35.030  -8.288
  757   1HD   LYS 103          HD2       LYS 103 -20.823  36.944  -7.074
  758   2HD   LYS 103          HD3       LYS 103 -20.440  37.200  -8.779
  759   1HE   LYS 103          HE2       LYS 103 -22.413  38.673  -9.034
  760   2HE   LYS 103          HE3       LYS 103 -22.869  38.351  -7.353
  761   1HZ   LYS 103          HZ1       LYS 103 -20.813  39.431  -6.650
  762   2HZ   LYS 103          HZ2       LYS 103 -20.364  39.691  -8.214
  763   3HZ   LYS 103          HZ3       LYS 103 -21.666  40.466  -7.598
  764    H    VAL 104           H        VAL 104 -25.877  34.025 -11.051
  765    HA   VAL 104           HA       VAL 104 -25.339  34.262 -13.954
  766    HB   VAL 104           HB       VAL 104 -27.925  33.446 -12.580
  767   1HG1  VAL 104          1HG1      VAL 104 -28.074  33.945 -15.011
  768   2HG1  VAL 104          2HG1      VAL 104 -26.729  32.822 -15.320
  769   3HG1  VAL 104          3HG1      VAL 104 -28.287  32.222 -14.707
  770   1HG2  VAL 104          1HG2      VAL 104 -25.558  31.722 -13.313
  771   2HG2  VAL 104          2HG2      VAL 104 -26.269  31.952 -11.703
  772   3HG2  VAL 104          3HG2      VAL 104 -27.195  31.093 -12.954
  773    H    PHE 105           H        PHE 105 -26.104  35.792 -15.361
  774    HA   PHE 105           HA       PHE 105 -28.122  37.777 -14.456
  775   1HB   PHE 105          HB2       PHE 105 -26.801  39.260 -16.088
  776   2HB   PHE 105          HB3       PHE 105 -26.174  39.029 -14.457
  777    HD1  PHE 105           HD1      PHE 105 -23.905  38.441 -14.162
  778    HD2  PHE 105           HD2      PHE 105 -25.789  37.743 -17.997
  779    HE1  PHE 105           HE1      PHE 105 -21.704  37.938 -15.147
  780    HE2  PHE 105           HE2      PHE 105 -23.581  37.204 -18.967
  781    HZ   PHE 105           HZ       PHE 105 -21.533  37.335 -17.575
  782    H    ALA 106           H        ALA 106 -29.467  38.597 -16.179
  783    HA   ALA 106           HA       ALA 106 -29.845  36.601 -18.355
  784   1HB   ALA 106          HB1       ALA 106 -31.554  36.618 -16.547
  785   2HB   ALA 106          HB2       ALA 106 -31.894  38.322 -16.912
  786   3HB   ALA 106          HB3       ALA 106 -32.255  37.070 -18.122
  787    H    LYS 107           H        LYS 107 -28.085  38.686 -18.777
  788    HA   LYS 107           HA       LYS 107 -28.898  39.793 -21.306
  789   1HB   LYS 107          HB2       LYS 107 -28.841  42.214 -20.674
  790   2HB   LYS 107          HB3       LYS 107 -30.186  41.359 -19.969
  791   1HG   LYS 107          HG2       LYS 107 -28.972  41.232 -17.779
  792   2HG   LYS 107          HG3       LYS 107 -27.622  42.099 -18.514
  793   1HD   LYS 107          HD2       LYS 107 -29.169  44.012 -18.982
  794   2HD   LYS 107          HD3       LYS 107 -30.500  43.103 -18.199
  795   1HE   LYS 107          HE2       LYS 107 -29.201  43.028 -16.095
  796   2HE   LYS 107          HE3       LYS 107 -27.899  43.970 -16.868
  797   1HZ   LYS 107          HZ1       LYS 107 -29.384  45.397 -15.574
  798   2HZ   LYS 107          HZ2       LYS 107 -29.476  45.795 -17.139
  799   3HZ   LYS 107          HZ3       LYS 107 -30.675  44.927 -16.433
  Start of MODEL    6
    1   1H    GLY   1          H1        GLY   1   0.328  -4.158  -3.253
    2   2H    GLY   1          H2        GLY   1   1.401  -5.321  -2.853
    3   3H    GLY   1          H3        GLY   1  -0.201  -5.559  -2.600
    4   1HA   GLY   1          HA2       GLY   1   0.905  -5.077  -0.509
    5   2HA   GLY   1          HA3       GLY   1   1.473  -3.560  -1.213
    6    H    LYS   2           H        LYS   2   0.428  -2.071  -0.063
    7    HA   LYS   2           HA       LYS   2  -2.410  -1.598  -0.400
    8   1HB   LYS   2          HB2       LYS   2  -2.062  -3.318   1.628
    9   2HB   LYS   2          HB3       LYS   2  -1.486  -1.904   2.498
   10   1HG   LYS   2          HG2       LYS   2  -3.725  -0.816   1.992
   11   2HG   LYS   2          HG3       LYS   2  -4.234  -2.345   1.243
   12   1HD   LYS   2          HD2       LYS   2  -3.761  -3.465   3.455
   13   2HD   LYS   2          HD3       LYS   2  -3.360  -1.891   4.160
   14   1HE   LYS   2          HE2       LYS   2  -5.665  -1.107   3.532
   15   2HE   LYS   2          HE3       LYS   2  -6.039  -2.724   2.927
   16   1HZ   LYS   2          HZ1       LYS   2  -5.253  -2.120   5.725
   17   2HZ   LYS   2          HZ2       LYS   2  -6.786  -2.455   5.227
   18   3HZ   LYS   2          HZ3       LYS   2  -5.640  -3.610   5.169
   19    H    ASP   3           H        ASP   3  -3.085   0.441   0.404
   20    HA   ASP   3           HA       ASP   3  -0.916   2.444   0.532
   21   1HB   ASP   3          HB2       ASP   3  -3.939   2.754   0.211
   22   2HB   ASP   3          HB3       ASP   3  -2.754   4.047   0.108
   23    H    ILE   4           H        ILE   4  -3.081   0.941   2.789
   24    HA   ILE   4           HA       ILE   4  -3.176   3.293   4.559
   25    HB   ILE   4           HB       ILE   4  -4.591   0.635   4.834
   26   1HG1  ILE   4          2HG1      ILE   4  -5.569   3.300   3.719
   27   2HG1  ILE   4          3HG1      ILE   4  -5.256   1.853   2.754
   28   1HG2  ILE   4          1HG2      ILE   4  -5.080   3.344   6.193
   29   2HG2  ILE   4          2HG2      ILE   4  -6.067   1.864   6.413
   30   3HG2  ILE   4          3HG2      ILE   4  -4.397   1.902   6.984
   31   1HD1  ILE   4          1HD1      ILE   4  -7.498   2.274   4.736
   32   2HD1  ILE   4          2HD1      ILE   4  -7.576   1.943   3.015
   33   3HD1  ILE   4          3HD1      ILE   4  -7.080   0.671   4.127
   34    H    GLN   5           H        GLN   5  -1.897   0.010   4.736
   35    HA   GLN   5           HA       GLN   5  -0.668   0.528   7.374
   36   1HB   GLN   5          HB2       GLN   5  -1.335  -1.937   5.787
   37   2HB   GLN   5          HB3       GLN   5   0.000  -2.044   6.910
   38   1HG   GLN   5          HG2       GLN   5  -1.982  -2.783   8.003
   39   2HG   GLN   5          HG3       GLN   5  -1.398  -1.314   8.776
   40   1HE2  GLN   5          1HE2      GLN   5  -4.715  -0.072   8.602
   41   2HE2  GLN   5          2HE2      GLN   5  -3.260  -0.308   9.559
   42    H    VAL   6           H        VAL   6   0.199   1.865   5.050
   43    HA   VAL   6           HA       VAL   6   3.096   1.615   5.303
   44    HB   VAL   6           HB       VAL   6   1.934   1.544   2.490
   45   1HG1  VAL   6          1HG1      VAL   6   4.744   1.058   3.568
   46   2HG1  VAL   6          2HG1      VAL   6   4.246   0.915   1.868
   47   3HG1  VAL   6          3HG1      VAL   6   4.200   2.471   2.619
   48   1HG2  VAL   6          1HG2      VAL   6   1.388  -0.622   3.415
   49   2HG2  VAL   6          2HG2      VAL   6   2.700  -0.791   2.248
   50   3HG2  VAL   6          3HG2      VAL   6   3.043  -0.854   4.015
   51    H    ILE   7           H        ILE   7   4.106   3.636   4.612
   52    HA   ILE   7           HA       ILE   7   2.309   5.919   4.744
   53    HB   ILE   7           HB       ILE   7   5.328   5.943   4.356
   54   1HG1  ILE   7          2HG1      ILE   7   4.888   4.742   6.415
   55   2HG1  ILE   7          3HG1      ILE   7   5.534   6.336   6.736
   56   1HG2  ILE   7          1HG2      ILE   7   4.335   8.072   3.753
   57   2HG2  ILE   7          2HG2      ILE   7   3.329   8.059   5.216
   58   3HG2  ILE   7          3HG2      ILE   7   5.100   8.224   5.317
   59   1HD1  ILE   7          1HD1      ILE   7   3.806   5.769   8.326
   60   2HD1  ILE   7          2HD1      ILE   7   3.288   7.138   7.359
   61   3HD1  ILE   7          3HD1      ILE   7   2.606   5.527   7.019
   62    H    VAL   8           H        VAL   8   1.047   5.727   2.945
   63    HA   VAL   8           HA       VAL   8   2.160   6.715   0.386
   64    HB   VAL   8           HB       VAL   8   0.409   4.248   0.363
   65   1HG1  VAL   8          1HG1      VAL   8   1.201   4.094  -2.029
   66   2HG1  VAL   8          2HG1      VAL   8   0.337   5.559  -1.701
   67   3HG1  VAL   8          3HG1      VAL   8   2.110   5.585  -1.801
   68   1HG2  VAL   8          1HG2      VAL   8   3.443   4.261  -0.012
   69   2HG2  VAL   8          2HG2      VAL   8   2.526   3.490   1.317
   70   3HG2  VAL   8          3HG2      VAL   8   2.358   2.890  -0.331
   71    H    ASN   9           H        ASN   9  -0.639   5.926   2.421
   72    HA   ASN   9           HA       ASN   9  -2.560   7.179   0.745
   73   1HB   ASN   9          HB2       ASN   9  -4.025   7.187   2.728
   74   2HB   ASN   9          HB3       ASN   9  -3.284   5.634   2.430
   75   1HD2  ASN   9          1HD2      ASN   9  -1.395   7.275   5.598
   76   2HD2  ASN   9          2HD2      ASN   9  -1.160   7.978   4.000
   77    H    VAL  10           H        VAL  10  -3.738   8.982   1.022
   78    HA   VAL  10           HA       VAL  10  -2.480  11.437   2.181
   79    HB   VAL  10           HB       VAL  10  -3.462  11.157  -0.684
   80   1HG1  VAL  10          1HG1      VAL  10  -3.823  13.435   0.174
   81   2HG1  VAL  10          2HG1      VAL  10  -2.120  13.519   0.679
   82   3HG1  VAL  10          3HG1      VAL  10  -2.581  13.422  -1.045
   83   1HG2  VAL  10          1HG2      VAL  10  -1.245  10.104  -0.488
   84   2HG2  VAL  10          2HG2      VAL  10  -1.067  11.647  -1.303
   85   3HG2  VAL  10          3HG2      VAL  10  -0.641  11.532   0.412
   86    HA   PRO  11           HA       PRO  11  -6.842  12.055   3.383
   87   1HB   PRO  11          HB2       PRO  11  -5.768  14.875   3.578
   88   2HB   PRO  11          HB3       PRO  11  -6.855  14.018   4.736
   89   1HG   PRO  11          HG2       PRO  11  -4.213  14.280   5.285
   90   2HG   PRO  11          HG3       PRO  11  -4.993  12.678   5.529
   91   1HD   PRO  11          HD2       PRO  11  -3.368  13.674   3.168
   92   2HD   PRO  11          HD3       PRO  11  -3.254  12.105   4.051
   93    HA   PRO  12           HA       PRO  12  -8.628  13.863  -0.299
   94   1HB   PRO  12          HB2       PRO  12 -10.997  14.932   0.506
   95   2HB   PRO  12          HB3       PRO  12 -10.732  13.178   0.495
   96   1HG   PRO  12          HG2       PRO  12 -10.515  15.040   2.869
   97   2HG   PRO  12          HG3       PRO  12 -11.319  13.440   2.740
   98   1HD   PRO  12          HD2       PRO  12  -8.791  13.813   3.757
   99   2HD   PRO  12          HD3       PRO  12  -9.310  12.311   2.956
  100    H    SER  13           H        SER  13  -8.654  15.825  -1.339
  101    HA   SER  13           HA       SER  13  -7.868  18.273   0.135
  102   1HB   SER  13          HB2       SER  13  -6.001  16.868  -0.854
  103   2HB   SER  13          HB3       SER  13  -6.595  17.367  -2.443
  104    HG   SER  13           HG       SER  13  -4.932  18.733  -1.550
  105    H    VAL  14           H        VAL  14 -10.418  18.125  -0.316
  106    HA   VAL  14           HA       VAL  14 -11.168  18.982  -2.954
  107    HB   VAL  14           HB       VAL  14 -12.707  17.746  -1.547
  108   1HG1  VAL  14          1HG1      VAL  14 -12.431  19.205   0.557
  109   2HG1  VAL  14          2HG1      VAL  14 -13.446  20.412  -0.248
  110   3HG1  VAL  14          3HG1      VAL  14 -14.119  18.817   0.086
  111   1HG2  VAL  14          1HG2      VAL  14 -13.839  20.364  -2.535
  112   2HG2  VAL  14          2HG2      VAL  14 -13.392  19.025  -3.596
  113   3HG2  VAL  14          3HG2      VAL  14 -14.697  18.844  -2.399
  114    H    ARG  15           H        ARG  15 -11.155  20.863  -3.862
  115    HA   ARG  15           HA       ARG  15 -10.723  23.408  -2.302
  116   1HB   ARG  15          HB2       ARG  15  -9.032  22.204  -4.515
  117   2HB   ARG  15          HB3       ARG  15  -8.919  23.893  -4.025
  118   1HG   ARG  15          HG2       ARG  15  -8.187  23.404  -1.866
  119   2HG   ARG  15          HG3       ARG  15  -8.514  21.659  -2.016
  120   1HD   ARG  15          HD2       ARG  15  -6.343  23.217  -3.440
  121   2HD   ARG  15          HD3       ARG  15  -6.156  21.992  -2.164
  122    HE   ARG  15           HE       ARG  15  -7.597  20.792  -4.270
  123   1HH1  ARG  15          1HH1      ARG  15  -4.321  21.557  -3.408
  124   2HH1  ARG  15          2HH1      ARG  15  -3.666  20.472  -4.619
  125   1HH2  ARG  15          1HH2      ARG  15  -6.746  19.786  -5.993
  126   2HH2  ARG  15          2HH2      ARG  15  -5.019  19.467  -6.063
  127    H    ALA  16           H        ALA  16 -10.990  25.292  -3.475
  128    HA   ALA  16           HA       ALA  16 -13.091  25.234  -5.514
  129   1HB   ALA  16          HB1       ALA  16 -11.578  27.521  -4.239
  130   2HB   ALA  16          HB2       ALA  16 -12.960  27.697  -5.325
  131   3HB   ALA  16          HB3       ALA  16 -13.188  26.908  -3.772
  132    H    ARG  17           H        ARG  17 -12.535  24.673  -7.543
  133    HA   ARG  17           HA       ARG  17  -9.927  25.214  -8.697
  134   1HB   ARG  17          HB2       ARG  17 -11.720  23.346  -9.340
  135   2HB   ARG  17          HB3       ARG  17 -12.340  24.629 -10.395
  136   1HG   ARG  17          HG2       ARG  17 -10.035  24.848 -11.386
  137   2HG   ARG  17          HG3       ARG  17  -9.511  23.461 -10.429
  138   1HD   ARG  17          HD2       ARG  17 -11.760  23.437 -12.481
  139   2HD   ARG  17          HD3       ARG  17 -10.103  23.016 -12.853
  140    HE   ARG  17           HE       ARG  17 -12.050  21.424 -11.263
  141   1HH1  ARG  17          1HH1      ARG  17  -8.754  21.532 -12.509
  142   2HH1  ARG  17          2HH1      ARG  17  -8.563  19.824 -12.371
  143   1HH2  ARG  17          1HH2      ARG  17 -11.723  19.227 -11.115
  144   2HH2  ARG  17          2HH2      ARG  17 -10.155  18.579 -11.517
  145    H    GLN  18           H        GLN  18 -12.735  27.077  -8.358
  146    HA   GLN  18           HA       GLN  18 -11.370  29.525  -9.015
  147   1HB   GLN  18          HB2       GLN  18 -12.151  29.046 -11.308
  148   2HB   GLN  18          HB3       GLN  18 -13.745  28.604 -10.726
  149   1HG   GLN  18          HG2       GLN  18 -13.724  30.782 -11.837
  150   2HG   GLN  18          HG3       GLN  18 -14.304  30.871 -10.190
  151   1HE2  GLN  18          1HE2      GLN  18 -12.271  33.837 -10.393
  152   2HE2  GLN  18          2HE2      GLN  18 -13.898  33.245 -10.777
  153    H    SER  19           H        SER  19 -12.345  31.219  -7.798
  154    HA   SER  19           HA       SER  19 -14.149  30.321  -5.680
  155   1HB   SER  19          HB2       SER  19 -13.682  32.587  -4.784
  156   2HB   SER  19          HB3       SER  19 -12.244  31.637  -5.114
  157    HG   SER  19           HG       SER  19 -12.052  33.801  -5.924
  158    H    THR  20           H        THR  20 -14.524  32.225  -8.578
  159    HA   THR  20           HA       THR  20 -17.417  32.704  -8.024
  160    HB   THR  20           HB       THR  20 -15.531  34.998  -8.762
  161    HG1  THR  20           HG1      THR  20 -15.988  35.798  -6.751
  162   1HG2  THR  20          1HG2      THR  20 -18.510  34.899  -8.118
  163   2HG2  THR  20          2HG2      THR  20 -17.539  36.382  -8.359
  164   3HG2  THR  20          3HG2      THR  20 -17.788  35.247  -9.691
  165    H    MET  21           H        MET  21 -18.355  31.874  -9.654
  166    HA   MET  21           HA       MET  21 -17.255  32.025 -12.422
  167   1HB   MET  21          HB2       MET  21 -19.337  30.258 -11.106
  168   2HB   MET  21          HB3       MET  21 -19.051  30.265 -12.827
  169   1HG   MET  21          HG2       MET  21 -17.000  29.520 -10.730
  170   2HG   MET  21          HG3       MET  21 -17.927  28.420 -11.712
  171   1HE   MET  21          HE1       MET  21 -16.352  29.075 -15.303
  172   2HE   MET  21          HE2       MET  21 -17.716  28.376 -14.421
  173   3HE   MET  21          HE3       MET  21 -17.637  30.128 -14.669
  174    H    ASN  22           H        ASN  22 -19.007  32.228 -14.118
  175    HA   ASN  22           HA       ASN  22 -21.433  33.658 -13.346
  176   1HB   ASN  22          HB2       ASN  22 -21.047  35.581 -14.669
  177   2HB   ASN  22          HB3       ASN  22 -19.684  35.436 -13.581
  178   1HD2  ASN  22          1HD2      ASN  22 -19.083  35.326 -17.601
  179   2HD2  ASN  22          2HD2      ASN  22 -20.708  35.441 -16.923
  180    H    ALA  23           H        ALA  23 -22.952  33.960 -15.215
  181    HA   ALA  23           HA       ALA  23 -22.447  32.457 -17.671
  182   1HB   ALA  23          HB1       ALA  23 -24.461  31.387 -15.656
  183   2HB   ALA  23          HB2       ALA  23 -24.223  30.778 -17.309
  184   3HB   ALA  23          HB3       ALA  23 -22.927  30.615 -16.118
  185    H    THR  24           H        THR  24 -24.130  32.606 -19.236
  186    HA   THR  24           HA       THR  24 -25.850  34.978 -18.880
  187    HB   THR  24           HB       THR  24 -25.206  33.568 -21.456
  188    HG1  THR  24           HG1      THR  24 -23.632  35.142 -21.752
  189   1HG2  THR  24          1HG2      THR  24 -25.709  35.852 -22.384
  190   2HG2  THR  24          2HG2      THR  24 -27.102  35.109 -21.584
  191   3HG2  THR  24          3HG2      THR  24 -26.176  36.370 -20.745
  192    H    ALA  25           H        ALA  25 -27.912  34.705 -18.500
  193    HA   ALA  25           HA       ALA  25 -29.399  32.200 -19.191
  194   1HB   ALA  25          HB1       ALA  25 -29.553  32.910 -16.908
  195   2HB   ALA  25          HB2       ALA  25 -30.017  34.553 -17.369
  196   3HB   ALA  25          HB3       ALA  25 -31.131  33.212 -17.675
  197    H    ASN  26           H        ASN  26 -31.716  32.619 -19.829
  198    HA   ASN  26           HA       ASN  26 -33.245  33.261 -21.361
  199   1HB   ASN  26          HB2       ASN  26 -33.134  35.349 -20.001
  200   2HB   ASN  26          HB3       ASN  26 -31.999  36.033 -21.141
  201   1HD2  ASN  26          1HD2      ASN  26 -35.943  35.618 -22.221
  202   2HD2  ASN  26          2HD2      ASN  26 -35.287  34.649 -20.906
  203    H    LEU  27           H        LEU  27 -30.860  32.044 -22.212
  204    HA   LEU  27           HA       LEU  27 -31.365  32.086 -25.005
  205   1HB   LEU  27          HB2       LEU  27 -29.170  32.667 -25.891
  206   2HB   LEU  27          HB3       LEU  27 -30.056  33.993 -25.253
  207    HG   LEU  27           HG       LEU  27 -28.699  34.198 -23.310
  208   1HD1  LEU  27          1HD1      LEU  27 -27.373  31.611 -24.158
  209   2HD1  LEU  27          2HD1      LEU  27 -26.787  32.690 -22.851
  210   3HD1  LEU  27          3HD1      LEU  27 -28.357  31.895 -22.708
  211   1HD2  LEU  27          1HD2      LEU  27 -27.795  35.054 -25.487
  212   2HD2  LEU  27          2HD2      LEU  27 -26.516  34.624 -24.349
  213   3HD2  LEU  27          3HD2      LEU  27 -26.925  33.536 -25.697
  214    H    SER  28           H        SER  28 -30.816  30.271 -22.486
  215    HA   SER  28           HA       SER  28 -30.369  28.067 -22.224
  216   1HB   SER  28          HB2       SER  28 -30.646  27.983 -25.247
  217   2HB   SER  28          HB3       SER  28 -30.747  26.607 -24.141
  218    HG   SER  28           HG       SER  28 -32.797  27.569 -24.763
  219    H    GLN  29           H        GLN  29 -28.043  29.399 -21.942
  220    HA   GLN  29           HA       GLN  29 -25.873  28.436 -23.597
  221   1HB   GLN  29          HB2       GLN  29 -26.119  30.518 -21.969
  222   2HB   GLN  29          HB3       GLN  29 -25.495  29.358 -20.790
  223   1HG   GLN  29          HG2       GLN  29 -23.471  29.046 -22.212
  224   2HG   GLN  29          HG3       GLN  29 -24.137  30.163 -23.392
  225   1HE2  GLN  29          1HE2      GLN  29 -22.504  32.826 -21.680
  226   2HE2  GLN  29          2HE2      GLN  29 -22.785  32.009 -23.232
  227    H    SER  30           H        SER  30 -24.002  27.260 -22.665
  228    HA   SER  30           HA       SER  30 -24.588  25.188 -20.611
  229   1HB   SER  30          HB2       SER  30 -23.123  24.694 -23.237
  230   2HB   SER  30          HB3       SER  30 -23.212  23.558 -21.855
  231    HG   SER  30           HG       SER  30 -24.777  23.206 -23.551
  232    H    VAL  31           H        VAL  31 -22.989  24.931 -19.143
  233    HA   VAL  31           HA       VAL  31 -20.433  26.484 -19.443
  234    HB   VAL  31           HB       VAL  31 -22.462  26.916 -17.224
  235   1HG1  VAL  31          1HG1      VAL  31 -20.265  27.135 -16.231
  236   2HG1  VAL  31          2HG1      VAL  31 -19.701  28.144 -17.591
  237   3HG1  VAL  31          3HG1      VAL  31 -20.920  28.730 -16.453
  238   1HG2  VAL  31          1HG2      VAL  31 -21.553  28.760 -19.460
  239   2HG2  VAL  31          2HG2      VAL  31 -23.177  28.108 -19.213
  240   3HG2  VAL  31          3HG2      VAL  31 -22.506  29.258 -18.069
  241    H    THR  32           H        THR  32 -18.700  25.712 -18.310
  242    HA   THR  32           HA       THR  32 -19.084  23.334 -16.532
  243    HB   THR  32           HB       THR  32 -16.478  24.294 -17.809
  244    HG1  THR  32           HG1      THR  32 -16.886  22.754 -19.368
  245   1HG2  THR  32          1HG2      THR  32 -15.819  21.910 -17.431
  246   2HG2  THR  32          2HG2      THR  32 -16.187  22.745 -15.911
  247   3HG2  THR  32          3HG2      THR  32 -17.373  21.624 -16.612
  248    H    LEU  33           H        LEU  33 -18.317  23.366 -14.450
  249    HA   LEU  33           HA       LEU  33 -16.485  25.382 -13.460
  250   1HB   LEU  33          HB2       LEU  33 -17.958  26.265 -11.708
  251   2HB   LEU  33          HB3       LEU  33 -18.460  26.660 -13.305
  252    HG   LEU  33           HG       LEU  33 -20.161  24.652 -13.073
  253   1HD1  LEU  33          1HD1      LEU  33 -19.340  23.684 -10.974
  254   2HD1  LEU  33          2HD1      LEU  33 -19.486  25.262 -10.151
  255   3HD1  LEU  33          3HD1      LEU  33 -20.931  24.368 -10.715
  256   1HD2  LEU  33          1HD2      LEU  33 -20.466  27.194 -11.452
  257   2HD2  LEU  33          2HD2      LEU  33 -20.769  27.035 -13.178
  258   3HD2  LEU  33          3HD2      LEU  33 -21.768  26.137 -12.045
  259    H    ALA  34           H        ALA  34 -15.952  24.867 -11.059
  260    HA   ALA  34           HA       ALA  34 -16.416  22.064 -10.339
  261   1HB   ALA  34          HB1       ALA  34 -14.826  22.025 -12.307
  262   2HB   ALA  34          HB2       ALA  34 -13.679  22.929 -11.306
  263   3HB   ALA  34          HB3       ALA  34 -14.180  21.275 -10.850
  264    H    CYS  35           H        CYS  35 -15.763  21.338  -8.507
  265    HA   CYS  35           HA       CYS  35 -13.947  22.919  -6.731
  266   1HB   CYS  35          HB2       CYS  35 -16.288  23.064  -5.931
  267   2HB   CYS  35          HB3       CYS  35 -16.380  21.309  -5.890
  268    H    ASP  36           H        ASP  36 -12.075  21.753  -7.206
  269    HA   ASP  36           HA       ASP  36 -12.126  19.015  -8.113
  270   1HB   ASP  36          HB2       ASP  36  -9.905  19.222  -8.610
  271   2HB   ASP  36          HB3       ASP  36 -10.577  20.803  -8.936
  272    H    ALA  37           H        ALA  37 -11.794  17.126  -7.065
  273    HA   ALA  37           HA       ALA  37 -11.009  17.264  -4.187
  274   1HB   ALA  37          HB1       ALA  37 -13.447  16.912  -4.302
  275   2HB   ALA  37          HB2       ALA  37 -13.193  15.489  -5.338
  276   3HB   ALA  37          HB3       ALA  37 -12.585  15.482  -3.674
  277    H    ASP  38           H        ASP  38  -8.950  16.677  -4.555
  278    HA   ASP  38           HA       ASP  38  -8.327  14.071  -5.874
  279   1HB   ASP  38          HB2       ASP  38  -7.057  16.122  -6.495
  280   2HB   ASP  38          HB3       ASP  38  -6.560  16.319  -4.832
  281    H    GLY  39           H        GLY  39  -6.876  12.498  -4.699
  282   1HA   GLY  39          HA2       GLY  39  -5.959  12.619  -2.106
  283   2HA   GLY  39          HA3       GLY  39  -7.640  12.049  -1.941
  284    H    PHE  40           H        PHE  40  -5.637  10.383  -1.063
  285    HA   PHE  40           HA       PHE  40  -5.733   8.155  -3.032
  286   1HB   PHE  40          HB2       PHE  40  -3.175   9.133  -1.726
  287   2HB   PHE  40          HB3       PHE  40  -3.360   7.595  -2.532
  288    HD1  PHE  40           HD1      PHE  40  -3.001  11.219  -3.060
  289    HD2  PHE  40           HD2      PHE  40  -3.806   7.429  -4.987
  290    HE1  PHE  40           HE1      PHE  40  -2.546  12.235  -5.264
  291    HE2  PHE  40           HE2      PHE  40  -3.325   8.463  -7.191
  292    HZ   PHE  40           HZ       PHE  40  -2.718  10.850  -7.337
  293    HA   PRO  41           HA       PRO  41  -6.308   5.993  -3.061
  294   1HB   PRO  41          HB2       PRO  41  -8.537   4.833  -1.416
  295   2HB   PRO  41          HB3       PRO  41  -7.584   4.103  -2.735
  296   1HG   PRO  41          HG2       PRO  41  -7.041   3.492  -0.112
  297   2HG   PRO  41          HG3       PRO  41  -5.719   3.735  -1.300
  298   1HD   PRO  41          HD2       PRO  41  -6.824   5.713   0.735
  299   2HD   PRO  41          HD3       PRO  41  -5.135   5.319   0.374
  300    H    GLU  42           H        GLU  42  -8.160   6.387  -4.393
  301    HA   GLU  42           HA       GLU  42  -9.053   8.863  -4.735
  302   1HB   GLU  42          HB2       GLU  42 -10.680   6.372  -5.322
  303   2HB   GLU  42          HB3       GLU  42 -10.980   7.987  -6.010
  304   1HG   GLU  42          HG2       GLU  42  -8.711   7.933  -7.033
  305   2HG   GLU  42          HG3       GLU  42  -8.424   6.348  -6.341
  306    HA   PRO  43           HA       PRO  43 -11.642   9.641  -1.219
  307   1HB   PRO  43          HB2       PRO  43 -12.229  12.288  -1.577
  308   2HB   PRO  43          HB3       PRO  43 -10.528  11.734  -1.287
  309   1HG   PRO  43          HG2       PRO  43 -11.896  12.264  -3.937
  310   2HG   PRO  43          HG3       PRO  43 -10.354  12.960  -3.339
  311   1HD   PRO  43          HD2       PRO  43 -10.421  10.744  -4.968
  312   2HD   PRO  43          HD3       PRO  43  -9.233  10.899  -3.623
  313    H    THR  44           H        THR  44 -13.689  10.310  -0.502
  314    HA   THR  44           HA       THR  44 -15.939  10.046  -2.509
  315    HB   THR  44           HB       THR  44 -15.994   9.810   0.533
  316    HG1  THR  44           HG1      THR  44 -14.924   8.094  -0.563
  317   1HG2  THR  44          1HG2      THR  44 -18.185  10.511  -0.314
  318   2HG2  THR  44          2HG2      THR  44 -18.147   9.265  -1.564
  319   3HG2  THR  44          3HG2      THR  44 -18.236   8.812   0.138
  320    H    MET  45           H        MET  45 -17.361  11.860  -2.813
  321    HA   MET  45           HA       MET  45 -17.216  14.098  -0.926
  322   1HB   MET  45          HB2       MET  45 -16.425  15.696  -2.573
  323   2HB   MET  45          HB3       MET  45 -15.288  14.401  -2.455
  324   1HG   MET  45          HG2       MET  45 -15.338  14.528  -4.713
  325   2HG   MET  45          HG3       MET  45 -16.661  13.401  -4.517
  326   1HE   MET  45          HE1       MET  45 -17.006  17.887  -5.584
  327   2HE   MET  45          HE2       MET  45 -16.198  17.288  -4.105
  328   3HE   MET  45          HE3       MET  45 -15.521  16.929  -5.728
  329    H    THR  46           H        THR  46 -18.761  15.752  -1.279
  330    HA   THR  46           HA       THR  46 -20.758  15.480  -3.394
  331    HB   THR  46           HB       THR  46 -22.718  15.669  -1.870
  332    HG1  THR  46           HG1      THR  46 -20.874  14.870   0.133
  333   1HG2  THR  46          1HG2      THR  46 -23.018  13.386  -1.301
  334   2HG2  THR  46          2HG2      THR  46 -22.154  13.484  -2.846
  335   3HG2  THR  46          3HG2      THR  46 -21.268  13.070  -1.354
  336    H    TRP  47           H        TRP  47 -22.344  17.364  -3.219
  337    HA   TRP  47           HA       TRP  47 -21.463  19.682  -1.757
  338   1HB   TRP  47          HB2       TRP  47 -21.085  21.086  -3.856
  339   2HB   TRP  47          HB3       TRP  47 -19.855  19.989  -3.312
  340    HD1  TRP  47           HD1      TRP  47 -20.022  17.451  -4.800
  341    HE1  TRP  47           HE1      TRP  47 -19.310  17.439  -7.239
  342    HE3  TRP  47           HE3      TRP  47 -21.041  22.328  -5.926
  343    HZ2  TRP  47           HZ2      TRP  47 -18.682  19.462  -9.237
  344    HZ3  TRP  47           HZ3      TRP  47 -20.254  23.297  -8.058
  345    HH2  TRP  47           HH2      TRP  47 -18.994  21.878  -9.691
  346    H    THR  48           H        THR  48 -22.698  21.639  -2.272
  347    HA   THR  48           HA       THR  48 -25.528  20.930  -2.829
  348    HB   THR  48           HB       THR  48 -26.274  21.964  -0.777
  349    HG1  THR  48           HG1      THR  48 -23.550  22.473  -0.198
  350   1HG2  THR  48          1HG2      THR  48 -25.507  19.587  -0.545
  351   2HG2  THR  48          2HG2      THR  48 -23.961  20.199   0.068
  352   3HG2  THR  48          3HG2      THR  48 -25.455  20.562   0.948
  353    H    LYS  49           H        LYS  49 -26.936  22.646  -3.213
  354    HA   LYS  49           HA       LYS  49 -25.669  24.934  -4.593
  355   1HB   LYS  49          HB2       LYS  49 -27.375  23.242  -5.592
  356   2HB   LYS  49          HB3       LYS  49 -28.598  24.020  -4.628
  357   1HG   LYS  49          HG2       LYS  49 -28.013  26.222  -5.798
  358   2HG   LYS  49          HG3       LYS  49 -26.884  25.328  -6.803
  359   1HD   LYS  49          HD2       LYS  49 -28.694  23.884  -7.635
  360   2HD   LYS  49          HD3       LYS  49 -29.870  24.692  -6.599
  361   1HE   LYS  49          HE2       LYS  49 -28.265  26.068  -8.800
  362   2HE   LYS  49          HE3       LYS  49 -29.879  25.394  -9.019
  363   1HZ   LYS  49          HZ1       LYS  49 -30.541  26.893  -7.104
  364   2HZ   LYS  49          HZ2       LYS  49 -29.127  27.723  -7.383
  365   3HZ   LYS  49          HZ3       LYS  49 -30.277  27.603  -8.543
  366    H    ASP  50           H        ASP  50 -25.193  25.600  -2.240
  367    HA   ASP  50           HA       ASP  50 -25.428  26.943  -0.457
  368   1HB   ASP  50          HB2       ASP  50 -26.093  28.619  -2.179
  369   2HB   ASP  50          HB3       ASP  50 -27.778  28.248  -1.876
  370    H    GLY  51           H        GLY  51 -27.396  24.458  -0.924
  371   1HA   GLY  51          HA2       GLY  51 -28.028  24.140   1.786
  372   2HA   GLY  51          HA3       GLY  51 -29.475  24.809   1.058
  373    H    GLU  52           H        GLU  52 -29.349  23.465  -1.483
  374    HA   GLU  52           HA       GLU  52 -30.261  20.782  -0.605
  375   1HB   GLU  52          HB2       GLU  52 -31.579  20.726  -2.602
  376   2HB   GLU  52          HB3       GLU  52 -31.912  22.175  -1.662
  377   1HG   GLU  52          HG2       GLU  52 -30.479  23.472  -3.237
  378   2HG   GLU  52          HG3       GLU  52 -30.217  22.010  -4.208
  379    HA   PRO  53           HA       PRO  53 -26.854  18.777  -2.325
  380   1HB   PRO  53          HB2       PRO  53 -28.534  16.394  -3.060
  381   2HB   PRO  53          HB3       PRO  53 -27.138  16.512  -1.941
  382   1HG   PRO  53          HG2       PRO  53 -29.693  16.263  -1.055
  383   2HG   PRO  53          HG3       PRO  53 -28.537  17.372  -0.224
  384   1HD   PRO  53          HD2       PRO  53 -30.650  18.094  -2.275
  385   2HD   PRO  53          HD3       PRO  53 -30.322  18.811  -0.697
  386    H    ILE  54           H        ILE  54 -25.654  18.707  -4.043
  387    HA   ILE  54           HA       ILE  54 -26.664  18.255  -6.796
  388    HB   ILE  54           HB       ILE  54 -24.005  19.461  -5.890
  389   1HG1  ILE  54          2HG1      ILE  54 -26.331  21.166  -6.881
  390   2HG1  ILE  54          3HG1      ILE  54 -26.055  20.888  -5.172
  391   1HG2  ILE  54          1HG2      ILE  54 -24.041  18.617  -8.253
  392   2HG2  ILE  54          2HG2      ILE  54 -25.461  19.654  -8.581
  393   3HG2  ILE  54          3HG2      ILE  54 -23.899  20.376  -8.230
  394   1HD1  ILE  54          1HD1      ILE  54 -23.809  21.801  -5.303
  395   2HD1  ILE  54          2HD1      ILE  54 -24.012  22.117  -7.028
  396   3HD1  ILE  54          3HD1      ILE  54 -25.027  22.980  -5.900
  397    H    GLU  55           H        GLU  55 -26.623  16.144  -5.085
  398    HA   GLU  55           HA       GLU  55 -24.288  14.624  -4.898
  399   1HB   GLU  55          HB2       GLU  55 -25.850  12.674  -4.651
  400   2HB   GLU  55          HB3       GLU  55 -25.999  14.016  -3.502
  401   1HG   GLU  55          HG2       GLU  55 -27.981  14.838  -4.775
  402   2HG   GLU  55          HG3       GLU  55 -27.872  13.399  -5.801
  403    H    GLN  56           H        GLN  56 -23.025  14.391  -6.585
  404    HA   GLN  56           HA       GLN  56 -23.591  13.960  -9.243
  405   1HB   GLN  56          HB2       GLN  56 -21.254  12.922  -7.575
  406   2HB   GLN  56          HB3       GLN  56 -21.229  13.073  -9.326
  407   1HG   GLN  56          HG2       GLN  56 -21.568  15.483  -7.454
  408   2HG   GLN  56          HG3       GLN  56 -20.020  14.864  -7.996
  409   1HE2  GLN  56          1HE2      GLN  56 -20.132  16.988 -10.774
  410   2HE2  GLN  56          2HE2      GLN  56 -19.163  16.257  -9.490
  411    H    GLU  57           H        GLU  57 -24.120  11.553  -6.836
  412    HA   GLU  57           HA       GLU  57 -23.816   9.265  -8.690
  413   1HB   GLU  57          HB2       GLU  57 -24.416   9.461  -5.712
  414   2HB   GLU  57          HB3       GLU  57 -24.357   7.946  -6.577
  415   1HG   GLU  57          HG2       GLU  57 -21.981   9.833  -6.471
  416   2HG   GLU  57          HG3       GLU  57 -22.273   8.540  -5.307
  417    H    ASP  58           H        ASP  58 -26.329  11.390  -7.977
  418    HA   ASP  58           HA       ASP  58 -28.297   9.545  -9.133
  419   1HB   ASP  58          HB2       ASP  58 -28.279   8.957  -6.653
  420   2HB   ASP  58          HB3       ASP  58 -28.786  10.564  -6.301
  421    H    ASN  59           H        ASN  59 -27.463  12.808  -8.087
  422    HA   ASN  59           HA       ASN  59 -29.883  13.836  -9.571
  423   1HB   ASN  59          HB2       ASN  59 -27.909  15.256  -7.723
  424   2HB   ASN  59          HB3       ASN  59 -29.109  16.077  -8.715
  425   1HD2  ASN  59          1HD2      ASN  59 -30.788  15.850  -5.528
  426   2HD2  ASN  59          2HD2      ASN  59 -29.448  16.756  -6.241
  427    H    GLU  60           H        GLU  60 -29.719  14.432 -11.572
  428    HA   GLU  60           HA       GLU  60 -27.195  15.334 -12.893
  429   1HB   GLU  60          HB2       GLU  60 -28.837  12.896 -13.658
  430   2HB   GLU  60          HB3       GLU  60 -27.508  13.526 -14.616
  431   1HG   GLU  60          HG2       GLU  60 -25.920  12.968 -12.753
  432   2HG   GLU  60          HG3       GLU  60 -27.286  12.185 -11.917
  433    H    GLU  61           H        GLU  61 -30.216  16.152 -12.421
  434    HA   GLU  61           HA       GLU  61 -31.880  16.012 -14.513
  435   1HB   GLU  61          HB2       GLU  61 -33.053  17.890 -13.698
  436   2HB   GLU  61          HB3       GLU  61 -32.346  16.996 -12.371
  437   1HG   GLU  61          HG2       GLU  61 -30.512  18.681 -12.212
  438   2HG   GLU  61          HG3       GLU  61 -31.255  19.592 -13.519
  439    H    LYS  62           H        LYS  62 -29.163  18.224 -14.694
  440    HA   LYS  62           HA       LYS  62 -29.342  18.235 -17.564
  441   1HB   LYS  62          HB2       LYS  62 -29.501  20.627 -18.020
  442   2HB   LYS  62          HB3       LYS  62 -30.956  20.019 -17.233
  443   1HG   LYS  62          HG2       LYS  62 -29.993  20.945 -15.015
  444   2HG   LYS  62          HG3       LYS  62 -28.755  21.730 -15.991
  445   1HD   LYS  62          HD2       LYS  62 -30.632  22.789 -17.340
  446   2HD   LYS  62          HD3       LYS  62 -31.771  22.154 -16.127
  447   1HE   LYS  62          HE2       LYS  62 -30.548  23.408 -14.354
  448   2HE   LYS  62          HE3       LYS  62 -29.310  23.894 -15.537
  449   1HZ   LYS  62          HZ1       LYS  62 -32.132  24.803 -15.471
  450   2HZ   LYS  62          HZ2       LYS  62 -30.769  25.699 -15.235
  451   3HZ   LYS  62          HZ3       LYS  62 -31.092  25.106 -16.735
  452    H    TYR  63           H        TYR  63 -27.445  17.135 -16.008
  453    HA   TYR  63           HA       TYR  63 -25.098  18.553 -16.920
  454   1HB   TYR  63          HB2       TYR  63 -24.096  18.836 -14.670
  455   2HB   TYR  63          HB3       TYR  63 -25.404  19.911 -15.012
  456    HD1  TYR  63           HD1      TYR  63 -27.326  20.013 -13.630
  457    HD2  TYR  63           HD2      TYR  63 -24.394  16.902 -13.069
  458    HE1  TYR  63           HE1      TYR  63 -28.290  19.560 -11.397
  459    HE2  TYR  63           HE2      TYR  63 -25.310  16.469 -10.803
  460    HH   TYR  63           HH       TYR  63 -26.866  17.020  -9.256
  461    H    SER  64           H        SER  64 -23.039  17.635 -16.281
  462    HA   SER  64           HA       SER  64 -22.806  14.809 -15.568
  463   1HB   SER  64          HB2       SER  64 -22.406  15.766 -18.421
  464   2HB   SER  64          HB3       SER  64 -21.736  14.264 -17.798
  465    HG   SER  64           HG       SER  64 -24.455  14.683 -17.415
  466    H    PHE  65           H        PHE  65 -20.526  14.211 -15.255
  467    HA   PHE  65           HA       PHE  65 -18.575  16.416 -15.404
  468   1HB   PHE  65          HB2       PHE  65 -18.301  16.060 -13.009
  469   2HB   PHE  65          HB3       PHE  65 -19.999  16.326 -13.406
  470    HD1  PHE  65           HD1      PHE  65 -21.689  14.535 -13.146
  471    HD2  PHE  65           HD2      PHE  65 -17.523  13.856 -12.233
  472    HE1  PHE  65           HE1      PHE  65 -22.259  12.366 -12.081
  473    HE2  PHE  65           HE2      PHE  65 -18.119  11.710 -11.155
  474    HZ   PHE  65           HZ       PHE  65 -20.501  10.946 -11.104
  475    H    ASN  66           H        ASN  66 -16.508  15.527 -14.088
  476    HA   ASN  66           HA       ASN  66 -15.290  13.657 -16.001
  477   1HB   ASN  66          HB2       ASN  66 -13.250  14.788 -15.411
  478   2HB   ASN  66          HB3       ASN  66 -14.511  16.002 -15.660
  479   1HD2  ASN  66          1HD2      ASN  66 -12.672  16.965 -12.597
  480   2HD2  ASN  66          2HD2      ASN  66 -12.353  16.934 -14.334
  481    H    TYR  67           H        TYR  67 -13.075  12.712 -14.918
  482    HA   TYR  67           HA       TYR  67 -13.876  10.535 -13.213
  483   1HB   TYR  67          HB2       TYR  67 -11.516   9.862 -13.418
  484   2HB   TYR  67          HB3       TYR  67 -12.224  10.254 -14.973
  485    HD1  TYR  67           HD1      TYR  67 -11.380  12.050 -16.329
  486    HD2  TYR  67           HD2      TYR  67  -9.860  11.439 -12.325
  487    HE1  TYR  67           HE1      TYR  67  -9.579  13.700 -16.770
  488    HE2  TYR  67           HE2      TYR  67  -8.000  13.058 -12.798
  489    HH   TYR  67           HH       TYR  67  -7.712  14.763 -15.908
  490    H    ASP  68           H        ASP  68 -12.574  13.671 -12.442
  491    HA   ASP  68           HA       ASP  68 -11.553  12.999  -9.755
  492   1HB   ASP  68          HB2       ASP  68 -10.645  14.774 -11.278
  493   2HB   ASP  68          HB3       ASP  68 -12.168  15.659 -11.097
  494    H    GLY  69           H        GLY  69 -14.643  13.758 -11.177
  495   1HA   GLY  69          HA2       GLY  69 -16.744  13.628 -10.157
  496   2HA   GLY  69          HA3       GLY  69 -16.012  13.741  -8.556
  497    H    SER  70           H        SER  70 -14.768  16.159 -10.575
  498    HA   SER  70           HA       SER  70 -16.355  18.185  -9.094
  499   1HB   SER  70          HB2       SER  70 -14.298  19.540  -9.215
  500   2HB   SER  70          HB3       SER  70 -14.051  17.954  -8.423
  501    HG   SER  70           HG       SER  70 -12.603  17.552  -9.795
  502    H    GLU  71           H        GLU  71 -15.100  17.631 -12.417
  503    HA   GLU  71           HA       GLU  71 -15.814  20.376 -13.143
  504   1HB   GLU  71          HB2       GLU  71 -14.789  18.131 -14.820
  505   2HB   GLU  71          HB3       GLU  71 -15.227  19.720 -15.473
  506   1HG   GLU  71          HG2       GLU  71 -13.585  20.799 -13.993
  507   2HG   GLU  71          HG3       GLU  71 -13.133  19.256 -13.279
  508    H    LEU  72           H        LEU  72 -17.877  20.460 -12.482
  509    HA   LEU  72           HA       LEU  72 -20.038  18.855 -13.579
  510   1HB   LEU  72          HB2       LEU  72 -20.008  19.716 -11.291
  511   2HB   LEU  72          HB3       LEU  72 -19.899  21.384 -11.889
  512    HG   LEU  72           HG       LEU  72 -22.185  21.129 -12.899
  513   1HD1  LEU  72          1HD1      LEU  72 -22.182  18.522 -11.349
  514   2HD1  LEU  72          2HD1      LEU  72 -23.585  19.298 -12.147
  515   3HD1  LEU  72          3HD1      LEU  72 -22.260  18.670 -13.134
  516   1HD2  LEU  72          1HD2      LEU  72 -22.011  20.553  -9.929
  517   2HD2  LEU  72          2HD2      LEU  72 -21.840  22.165 -10.693
  518   3HD2  LEU  72          3HD2      LEU  72 -23.384  21.292 -10.780
  519    H    ILE  73           H        ILE  73 -20.428  19.067 -15.700
  520    HA   ILE  73           HA       ILE  73 -20.514  21.751 -17.000
  521    HB   ILE  73           HB       ILE  73 -21.055  19.061 -18.268
  522   1HG1  ILE  73          2HG1      ILE  73 -18.408  20.456 -18.679
  523   2HG1  ILE  73          3HG1      ILE  73 -18.591  19.406 -17.287
  524   1HG2  ILE  73          1HG2      ILE  73 -20.613  20.349 -20.346
  525   2HG2  ILE  73          2HG2      ILE  73 -21.884  21.138 -19.414
  526   3HG2  ILE  73          3HG2      ILE  73 -20.254  21.809 -19.361
  527   1HD1  ILE  73          1HD1      ILE  73 -19.109  18.499 -20.112
  528   2HD1  ILE  73          2HD1      ILE  73 -17.650  18.175 -19.160
  529   3HD1  ILE  73          3HD1      ILE  73 -19.201  17.515 -18.623
  530    H    ILE  74           H        ILE  74 -22.339  22.794 -16.951
  531    HA   ILE  74           HA       ILE  74 -24.931  21.368 -16.488
  532    HB   ILE  74           HB       ILE  74 -24.256  24.279 -15.939
  533   1HG1  ILE  74          2HG1      ILE  74 -24.498  21.979 -13.942
  534   2HG1  ILE  74          3HG1      ILE  74 -22.993  22.759 -14.408
  535   1HG2  ILE  74          1HG2      ILE  74 -26.669  22.610 -15.089
  536   2HG2  ILE  74          2HG2      ILE  74 -26.420  24.341 -14.801
  537   3HG2  ILE  74          3HG2      ILE  74 -26.672  23.768 -16.437
  538   1HD1  ILE  74          1HD1      ILE  74 -25.292  24.078 -12.904
  539   2HD1  ILE  74          2HD1      ILE  74 -23.700  23.624 -12.278
  540   3HD1  ILE  74          3HD1      ILE  74 -23.860  24.934 -13.497
  541    H    LYS  75           H        LYS  75 -26.185  21.279 -18.238
  542    HA   LYS  75           HA       LYS  75 -25.847  23.271 -20.465
  543   1HB   LYS  75          HB2       LYS  75 -26.923  21.719 -21.925
  544   2HB   LYS  75          HB3       LYS  75 -25.662  20.857 -21.040
  545   1HG   LYS  75          HG2       LYS  75 -27.415  19.939 -19.495
  546   2HG   LYS  75          HG3       LYS  75 -28.665  20.712 -20.497
  547   1HD   LYS  75          HD2       LYS  75 -26.656  18.595 -21.393
  548   2HD   LYS  75          HD3       LYS  75 -28.332  18.294 -20.981
  549   1HE   LYS  75          HE2       LYS  75 -29.050  19.862 -22.827
  550   2HE   LYS  75          HE3       LYS  75 -27.330  20.004 -23.304
  551   1HZ   LYS  75          HZ1       LYS  75 -27.313  17.604 -23.710
  552   2HZ   LYS  75          HZ2       LYS  75 -28.899  17.473 -23.286
  553   3HZ   LYS  75          HZ3       LYS  75 -28.455  18.321 -24.610
  554    H    LYS  76           H        LYS  76 -27.622  24.245 -21.323
  555    HA   LYS  76           HA       LYS  76 -29.543  25.558 -21.308
  556   1HB   LYS  76          HB2       LYS  76 -30.611  23.444 -21.722
  557   2HB   LYS  76          HB3       LYS  76 -30.680  23.029 -20.026
  558   1HG   LYS  76          HG2       LYS  76 -32.835  23.761 -21.168
  559   2HG   LYS  76          HG3       LYS  76 -32.470  24.483 -19.610
  560   1HD   LYS  76          HD2       LYS  76 -31.722  26.572 -20.707
  561   2HD   LYS  76          HD3       LYS  76 -31.934  25.808 -22.305
  562   1HE   LYS  76          HE2       LYS  76 -34.311  25.712 -22.030
  563   2HE   LYS  76          HE3       LYS  76 -34.207  26.039 -20.304
  564   1HZ   LYS  76          HZ1       LYS  76 -34.845  28.016 -21.618
  565   2HZ   LYS  76          HZ2       LYS  76 -33.460  28.260 -20.769
  566   3HZ   LYS  76          HZ3       LYS  76 -33.401  27.966 -22.391
  567    H    VAL  77           H        VAL  77 -27.868  26.544 -19.791
  568    HA   VAL  77           HA       VAL  77 -28.609  26.869 -16.983
  569    HB   VAL  77           HB       VAL  77 -26.663  28.452 -18.716
  570   1HG1  VAL  77          1HG1      VAL  77 -25.741  29.160 -16.471
  571   2HG1  VAL  77          2HG1      VAL  77 -27.337  29.805 -16.730
  572   3HG1  VAL  77          3HG1      VAL  77 -27.109  28.374 -15.678
  573   1HG2  VAL  77          1HG2      VAL  77 -26.034  26.059 -18.413
  574   2HG2  VAL  77          2HG2      VAL  77 -24.967  27.151 -17.496
  575   3HG2  VAL  77          3HG2      VAL  77 -26.244  26.222 -16.667
  576    H    ASP  78           H        ASP  78 -29.793  28.387 -16.022
  577    HA   ASP  78           HA       ASP  78 -30.468  30.902 -17.318
  578   1HB   ASP  78          HB2       ASP  78 -32.573  28.811 -16.718
  579   2HB   ASP  78          HB3       ASP  78 -32.998  30.507 -16.562
  580    H    LYS  79           H        LYS  79 -31.998  32.193 -15.526
  581    HA   LYS  79           HA       LYS  79 -30.136  32.720 -13.453
  582   1HB   LYS  79          HB2       LYS  79 -33.043  33.530 -13.771
  583   2HB   LYS  79          HB3       LYS  79 -32.000  34.133 -12.479
  584   1HG   LYS  79          HG2       LYS  79 -30.377  34.919 -14.317
  585   2HG   LYS  79          HG3       LYS  79 -31.690  34.590 -15.460
  586   1HD   LYS  79          HD2       LYS  79 -31.859  36.460 -13.044
  587   2HD   LYS  79          HD3       LYS  79 -31.544  36.995 -14.688
  588   1HE   LYS  79          HE2       LYS  79 -33.748  36.089 -15.428
  589   2HE   LYS  79          HE3       LYS  79 -34.068  35.536 -13.765
  590   1HZ   LYS  79          HZ1       LYS  79 -33.658  38.399 -14.538
  591   2HZ   LYS  79          HZ2       LYS  79 -35.100  37.696 -14.186
  592   3HZ   LYS  79          HZ3       LYS  79 -33.951  37.872 -13.019
  593    H    SER  80           H        SER  80 -32.628  30.300 -13.419
  594    HA   SER  80           HA       SER  80 -32.876  29.963 -10.570
  595   1HB   SER  80          HB2       SER  80 -33.759  27.724 -11.222
  596   2HB   SER  80          HB3       SER  80 -34.569  29.113 -11.998
  597    HG   SER  80           HG       SER  80 -34.094  27.419 -13.496
  598    H    ASP  81           H        ASP  81 -30.257  29.251 -12.687
  599    HA   ASP  81           HA       ASP  81 -29.132  27.112 -11.006
  600   1HB   ASP  81          HB2       ASP  81 -28.093  28.533 -13.475
  601   2HB   ASP  81          HB3       ASP  81 -27.276  27.212 -12.686
  602    H    GLU  82           H        GLU  82 -29.120  30.469 -10.671
  603    HA   GLU  82           HA       GLU  82 -26.549  31.115  -9.716
  604   1HB   GLU  82          HB2       GLU  82 -28.476  32.674  -9.997
  605   2HB   GLU  82          HB3       GLU  82 -29.278  31.922  -8.605
  606   1HG   GLU  82          HG2       GLU  82 -27.307  32.708  -7.191
  607   2HG   GLU  82          HG3       GLU  82 -26.657  33.484  -8.640
  608    H    ALA  83           H        ALA  83 -25.380  30.728  -7.856
  609    HA   ALA  83           HA       ALA  83 -26.501  29.127  -5.630
  610   1HB   ALA  83          HB1       ALA  83 -26.115  27.482  -7.485
  611   2HB   ALA  83          HB2       ALA  83 -24.405  27.941  -7.504
  612   3HB   ALA  83          HB3       ALA  83 -25.101  27.161  -6.057
  613    H    GLU  84           H        GLU  84 -24.961  28.670  -3.959
  614    HA   GLU  84           HA       GLU  84 -22.339  30.069  -4.010
  615   1HB   GLU  84          HB2       GLU  84 -24.033  31.512  -2.841
  616   2HB   GLU  84          HB3       GLU  84 -24.167  30.232  -1.613
  617   1HG   GLU  84          HG2       GLU  84 -21.695  30.412  -1.224
  618   2HG   GLU  84          HG3       GLU  84 -21.587  31.667  -2.441
  619    H    TYR  85           H        TYR  85 -22.050  27.916  -4.760
  620    HA   TYR  85           HA       TYR  85 -22.621  25.478  -3.656
  621   1HB   TYR  85          HB2       TYR  85 -20.068  26.296  -5.021
  622   2HB   TYR  85          HB3       TYR  85 -20.642  24.634  -4.833
  623    HD1  TYR  85           HD1      TYR  85 -23.035  24.154  -5.764
  624    HD2  TYR  85           HD2      TYR  85 -20.485  27.364  -7.121
  625    HE1  TYR  85           HE1      TYR  85 -24.181  24.149  -7.975
  626    HE2  TYR  85           HE2      TYR  85 -21.626  27.376  -9.304
  627    HH   TYR  85           HH       TYR  85 -23.335  26.456 -10.557
  628    H    ILE  86           H        ILE  86 -22.109  24.328  -1.938
  629    HA   ILE  86           HA       ILE  86 -19.495  24.824  -0.563
  630    HB   ILE  86           HB       ILE  86 -22.038  23.841   0.778
  631   1HG1  ILE  86          2HG1      ILE  86 -20.572  26.495   0.922
  632   2HG1  ILE  86          3HG1      ILE  86 -22.211  26.226   0.274
  633   1HG2  ILE  86          1HG2      ILE  86 -19.283  24.453   1.900
  634   2HG2  ILE  86          2HG2      ILE  86 -20.671  23.907   2.851
  635   3HG2  ILE  86          3HG2      ILE  86 -19.942  22.836   1.655
  636   1HD1  ILE  86          1HD1      ILE  86 -22.960  25.549   2.558
  637   2HD1  ILE  86          2HD1      ILE  86 -21.373  26.015   3.190
  638   3HD1  ILE  86          3HD1      ILE  86 -22.411  27.247   2.447
  639    H    CYS  87           H        CYS  87 -18.174  23.138  -0.609
  640    HA   CYS  87           HA       CYS  87 -19.140  20.490  -1.463
  641   1HB   CYS  87          HB2       CYS  87 -16.899  20.356  -2.729
  642   2HB   CYS  87          HB3       CYS  87 -18.186  21.267  -3.465
  643    H    ILE  88           H        ILE  88 -18.323  18.730  -0.580
  644    HA   ILE  88           HA       ILE  88 -16.391  18.988   1.680
  645    HB   ILE  88           HB       ILE  88 -19.140  17.682   1.665
  646   1HG1  ILE  88          2HG1      ILE  88 -18.200  20.203   3.104
  647   2HG1  ILE  88          3HG1      ILE  88 -19.373  20.147   1.777
  648   1HG2  ILE  88          1HG2      ILE  88 -18.739  17.285   4.128
  649   2HG2  ILE  88          2HG2      ILE  88 -17.570  16.455   3.129
  650   3HG2  ILE  88          3HG2      ILE  88 -17.101  17.980   3.920
  651   1HD1  ILE  88          1HD1      ILE  88 -20.587  20.487   3.789
  652   2HD1  ILE  88          2HD1      ILE  88 -20.896  18.806   3.298
  653   3HD1  ILE  88          3HD1      ILE  88 -19.772  19.213   4.642
  654    H    ALA  89           H        ALA  89 -15.158  17.163   2.048
  655    HA   ALA  89           HA       ALA  89 -15.706  14.711   0.499
  656   1HB   ALA  89          HB1       ALA  89 -13.077  16.256   0.349
  657   2HB   ALA  89          HB2       ALA  89 -13.430  14.697  -0.440
  658   3HB   ALA  89          HB3       ALA  89 -14.284  16.154  -0.954
  659    H    GLU  90           H        GLU  90 -14.543  12.891   1.126
  660    HA   GLU  90           HA       GLU  90 -13.124  12.822   3.734
  661   1HB   GLU  90          HB2       GLU  90 -15.576  12.877   4.197
  662   2HB   GLU  90          HB3       GLU  90 -15.799  11.458   3.179
  663   1HG   GLU  90          HG2       GLU  90 -14.305  10.160   4.737
  664   2HG   GLU  90          HG3       GLU  90 -14.182  11.587   5.753
  665    H    ASN  91           H        ASN  91 -11.864  10.963   3.941
  666    HA   ASN  91           HA       ASN  91 -12.451   8.588   2.377
  667   1HB   ASN  91          HB2       ASN  91 -10.605   8.381   1.024
  668   2HB   ASN  91          HB3       ASN  91 -11.011  10.067   0.855
  669   1HD2  ASN  91          1HD2      ASN  91  -7.335   9.860   1.112
  670   2HD2  ASN  91          2HD2      ASN  91  -8.544   9.217   0.011
  671    H    LYS  92           H        LYS  92 -10.335   7.002   2.887
  672    HA   LYS  92           HA       LYS  92 -10.526   6.310   5.640
  673   1HB   LYS  92          HB2       LYS  92  -8.485   4.850   5.043
  674   2HB   LYS  92          HB3       LYS  92 -10.035   4.504   4.310
  675   1HG   LYS  92          HG2       LYS  92  -8.099   6.235   2.793
  676   2HG   LYS  92          HG3       LYS  92  -7.796   4.512   2.933
  677   1HD   LYS  92          HD2       LYS  92 -10.398   5.624   1.800
  678   2HD   LYS  92          HD3       LYS  92  -9.024   5.229   0.828
  679   1HE   LYS  92          HE2       LYS  92  -9.106   2.880   1.604
  680   2HE   LYS  92          HE3       LYS  92 -10.456   3.253   2.661
  681   1HZ   LYS  92          HZ1       LYS  92 -11.276   2.323   0.575
  682   2HZ   LYS  92          HZ2       LYS  92 -11.756   3.888   0.683
  683   3HZ   LYS  92          HZ3       LYS  92 -10.514   3.470  -0.301
  684    H    ALA  93           H        ALA  93  -8.334   8.535   4.166
  685    HA   ALA  93           HA       ALA  93  -6.501   8.573   6.503
  686   1HB   ALA  93          HB1       ALA  93  -6.303   9.929   3.774
  687   2HB   ALA  93          HB2       ALA  93  -5.042   9.862   5.014
  688   3HB   ALA  93          HB3       ALA  93  -5.579   8.363   4.206
  689    H    GLY  94           H        GLY  94  -9.185  10.557   5.259
  690   1HA   GLY  94          HA2       GLY  94  -9.195  12.239   7.539
  691   2HA   GLY  94          HA3       GLY  94  -8.273  13.064   6.273
  692    H    GLU  95           H        GLU  95  -9.840  14.735   6.424
  693    HA   GLU  95           HA       GLU  95 -12.267  14.433   4.788
  694   1HB   GLU  95          HB2       GLU  95 -12.841  13.703   7.141
  695   2HB   GLU  95          HB3       GLU  95 -12.343  15.300   7.710
  696   1HG   GLU  95          HG2       GLU  95 -14.179  16.304   6.297
  697   2HG   GLU  95          HG3       GLU  95 -14.687  14.671   5.867
  698    H    GLN  96           H        GLN  96 -13.066  16.492   4.057
  699    HA   GLN  96           HA       GLN  96 -11.562  18.985   4.691
  700   1HB   GLN  96          HB2       GLN  96 -10.319  17.264   3.066
  701   2HB   GLN  96          HB3       GLN  96 -11.469  17.841   1.898
  702   1HG   GLN  96          HG2       GLN  96  -9.507  19.186   1.561
  703   2HG   GLN  96          HG3       GLN  96 -10.571  20.239   2.445
  704   1HE2  GLN  96          1HE2      GLN  96  -7.285  18.608   4.389
  705   2HE2  GLN  96          2HE2      GLN  96  -8.007  17.753   3.019
  706    H    ASP  97           H        ASP  97 -12.283  20.880   3.282
  707    HA   ASP  97           HA       ASP  97 -14.731  20.602   1.727
  708   1HB   ASP  97          HB2       ASP  97 -16.103  22.059   3.025
  709   2HB   ASP  97          HB3       ASP  97 -15.616  20.710   4.048
  710    H    ALA  98           H        ALA  98 -15.411  22.504   0.635
  711    HA   ALA  98           HA       ALA  98 -13.820  24.971   0.699
  712   1HB   ALA  98          HB1       ALA  98 -13.312  24.839  -1.819
  713   2HB   ALA  98          HB2       ALA  98 -12.422  23.726  -0.780
  714   3HB   ALA  98          HB3       ALA  98 -13.778  23.118  -1.706
  715    H    THR  99           H        THR  99 -14.677  26.489  -1.173
  716    HA   THR  99           HA       THR  99 -17.645  26.425  -1.386
  717    HB   THR  99           HB       THR  99 -16.012  28.624  -0.067
  718    HG1  THR  99           HG1      THR  99 -16.984  28.004   1.808
  719   1HG2  THR  99          1HG2      THR  99 -19.037  28.364  -0.467
  720   2HG2  THR  99          2HG2      THR  99 -18.257  29.537   0.626
  721   3HG2  THR  99          3HG2      THR  99 -17.977  29.648  -1.123
  722    H    ILE 100           H        ILE 100 -18.481  27.689  -3.047
  723    HA   ILE 100           HA       ILE 100 -16.757  29.422  -4.741
  724    HB   ILE 100           HB       ILE 100 -18.336  27.048  -5.842
  725   1HG1  ILE 100          2HG1      ILE 100 -15.333  27.445  -5.639
  726   2HG1  ILE 100          3HG1      ILE 100 -16.334  26.272  -4.767
  727   1HG2  ILE 100          1HG2      ILE 100 -18.463  28.890  -7.432
  728   2HG2  ILE 100          2HG2      ILE 100 -16.705  29.151  -7.321
  729   3HG2  ILE 100          3HG2      ILE 100 -17.383  27.691  -8.050
  730   1HD1  ILE 100          1HD1      ILE 100 -15.223  25.113  -6.464
  731   2HD1  ILE 100          2HD1      ILE 100 -16.948  25.200  -6.938
  732   3HD1  ILE 100          3HD1      ILE 100 -15.731  26.227  -7.732
  733    H    HIS 101           H        HIS 101 -18.132  30.841  -6.140
  734    HA   HIS 101           HA       HIS 101 -21.082  30.818  -5.602
  735   1HB   HIS 101          HB2       HIS 101 -20.049  32.585  -4.314
  736   2HB   HIS 101          HB3       HIS 101 -19.218  33.202  -5.737
  737    HD1  HIS 101           HD1      HIS 101 -23.026  32.380  -5.392
  738    HD2  HIS 101           HD2      HIS 101 -20.296  35.516  -6.069
  739    HE1  HIS 101           HE1      HIS 101 -24.410  34.425  -5.929
  740    H    LEU 102           H        LEU 102 -22.409  31.466  -7.339
  741    HA   LEU 102           HA       LEU 102 -21.123  31.867 -10.001
  742   1HB   LEU 102          HB2       LEU 102 -21.764  29.544  -9.884
  743   2HB   LEU 102          HB3       LEU 102 -23.319  29.936  -9.170
  744    HG   LEU 102           HG       LEU 102 -24.088  30.965 -11.254
  745   1HD1  LEU 102          1HD1      LEU 102 -21.466  30.019 -12.457
  746   2HD1  LEU 102          2HD1      LEU 102 -22.812  30.698 -13.368
  747   3HD1  LEU 102          3HD1      LEU 102 -21.928  31.709 -12.205
  748   1HD2  LEU 102          1HD2      LEU 102 -22.961  28.198 -11.718
  749   2HD2  LEU 102          2HD2      LEU 102 -24.444  28.565 -10.808
  750   3HD2  LEU 102          3HD2      LEU 102 -24.340  28.892 -12.550
  751    H    LYS 103           H        LYS 103 -21.616  33.786 -10.611
  752    HA   LYS 103           HA       LYS 103 -24.235  35.064 -10.044
  753   1HB   LYS 103          HB2       LYS 103 -21.691  36.127 -11.359
  754   2HB   LYS 103          HB3       LYS 103 -23.153  37.068 -11.083
  755   1HG   LYS 103          HG2       LYS 103 -22.960  36.582  -8.642
  756   2HG   LYS 103          HG3       LYS 103 -21.389  35.818  -8.938
  757   1HD   LYS 103          HD2       LYS 103 -20.572  38.017  -9.920
  758   2HD   LYS 103          HD3       LYS 103 -22.126  38.731  -9.475
  759   1HE   LYS 103          HE2       LYS 103 -20.096  37.501  -7.536
  760   2HE   LYS 103          HE3       LYS 103 -20.320  39.235  -7.825
  761   1HZ   LYS 103          HZ1       LYS 103 -22.352  37.396  -6.649
  762   2HZ   LYS 103          HZ2       LYS 103 -21.553  38.575  -5.863
  763   3HZ   LYS 103          HZ3       LYS 103 -22.638  38.965  -7.027
  764    H    VAL 104           H        VAL 104 -25.848  34.351 -11.354
  765    HA   VAL 104           HA       VAL 104 -25.332  34.121 -14.292
  766    HB   VAL 104           HB       VAL 104 -27.857  33.331 -12.809
  767   1HG1  VAL 104          1HG1      VAL 104 -26.741  32.711 -15.593
  768   2HG1  VAL 104          2HG1      VAL 104 -28.169  31.958 -14.869
  769   3HG1  VAL 104          3HG1      VAL 104 -28.167  33.690 -15.224
  770   1HG2  VAL 104          1HG2      VAL 104 -26.082  31.940 -11.947
  771   2HG2  VAL 104          2HG2      VAL 104 -27.058  30.997 -13.054
  772   3HG2  VAL 104          3HG2      VAL 104 -25.466  31.627 -13.574
  773    H    PHE 105           H        PHE 105 -25.999  35.701 -15.718
  774    HA   PHE 105           HA       PHE 105 -28.089  37.645 -14.843
  775   1HB   PHE 105          HB2       PHE 105 -26.799  39.196 -16.326
  776   2HB   PHE 105          HB3       PHE 105 -26.056  38.780 -14.802
  777    HD1  PHE 105           HD1      PHE 105 -25.913  38.080 -18.492
  778    HD2  PHE 105           HD2      PHE 105 -23.853  37.910 -14.707
  779    HE1  PHE 105           HE1      PHE 105 -23.806  37.545 -19.676
  780    HE2  PHE 105           HE2      PHE 105 -21.744  37.419 -15.877
  781    HZ   PHE 105           HZ       PHE 105 -21.691  37.263 -18.381
  782    H    ALA 106           H        ALA 106 -29.680  38.217 -16.290
  783    HA   ALA 106           HA       ALA 106 -30.004  36.483 -18.682
  784   1HB   ALA 106          HB1       ALA 106 -31.931  38.338 -17.229
  785   2HB   ALA 106          HB2       ALA 106 -32.352  37.275 -18.586
  786   3HB   ALA 106          HB3       ALA 106 -31.792  36.556 -17.046
  787    H    LYS 107           H        LYS 107 -28.000  38.182 -19.174
  788    HA   LYS 107           HA       LYS 107 -27.079  39.755 -20.520
  789   1HB   LYS 107          HB2       LYS 107 -29.706  39.792 -22.059
  790   2HB   LYS 107          HB3       LYS 107 -28.127  40.317 -22.634
  791   1HG   LYS 107          HG2       LYS 107 -27.233  37.991 -22.399
  792   2HG   LYS 107          HG3       LYS 107 -28.837  37.434 -21.921
  793   1HD   LYS 107          HD2       LYS 107 -28.067  38.649 -24.600
  794   2HD   LYS 107          HD3       LYS 107 -28.429  36.955 -24.254
  795   1HE   LYS 107          HE2       LYS 107 -30.371  39.314 -24.114
  796   2HE   LYS 107          HE3       LYS 107 -30.288  38.134 -25.426
  797   1HZ   LYS 107          HZ1       LYS 107 -30.940  37.445 -22.622
  798   2HZ   LYS 107          HZ2       LYS 107 -32.056  37.622 -23.797
  799   3HZ   LYS 107          HZ3       LYS 107 -30.987  36.395 -23.905
  Start of MODEL    7
    1   1H    GLY   1          H1        GLY   1  -4.523   1.455   9.125
    2   2H    GLY   1          H2        GLY   1  -2.876   1.570   9.323
    3   3H    GLY   1          H3        GLY   1  -3.779   2.919   8.997
    4   1HA   GLY   1          HA2       GLY   1  -3.306   0.644   7.176
    5   2HA   GLY   1          HA3       GLY   1  -4.340   2.031   6.812
    6    H    LYS   2           H        LYS   2  -2.237   1.455   5.105
    7    HA   LYS   2           HA       LYS   2  -0.818   3.949   5.062
    8   1HB   LYS   2          HB2       LYS   2   1.418   3.246   5.149
    9   2HB   LYS   2          HB3       LYS   2   0.657   2.675   6.609
   10   1HG   LYS   2          HG2       LYS   2   0.809   0.434   6.043
   11   2HG   LYS   2          HG3       LYS   2   0.771   0.736   4.312
   12   1HD   LYS   2          HD2       LYS   2   3.083   1.797   4.493
   13   2HD   LYS   2          HD3       LYS   2   3.136   1.276   6.151
   14   1HE   LYS   2          HE2       LYS   2   4.288  -0.451   5.202
   15   2HE   LYS   2          HE3       LYS   2   2.652  -1.123   5.115
   16   1HZ   LYS   2          HZ1       LYS   2   2.518  -0.274   2.811
   17   2HZ   LYS   2          HZ2       LYS   2   4.027   0.325   2.895
   18   3HZ   LYS   2          HZ3       LYS   2   3.807  -1.305   2.970
   19    H    ASP   3           H        ASP   3   1.003   3.608   3.154
   20    HA   ASP   3           HA       ASP   3  -0.552   2.904   0.712
   21   1HB   ASP   3          HB2       ASP   3   0.890   5.018   1.105
   22   2HB   ASP   3          HB3       ASP   3   2.292   3.955   0.989
   23    H    ILE   4           H        ILE   4   1.354   1.933  -0.996
   24    HA   ILE   4           HA       ILE   4   1.977  -0.796   0.032
   25    HB   ILE   4           HB       ILE   4   2.141   0.534  -2.726
   26   1HG1  ILE   4          2HG1      ILE   4   0.604  -1.270  -3.407
   27   2HG1  ILE   4          3HG1      ILE   4   0.589  -1.917  -1.782
   28   1HG2  ILE   4          1HG2      ILE   4   2.901  -1.634  -3.637
   29   2HG2  ILE   4          2HG2      ILE   4   4.097  -0.914  -2.571
   30   3HG2  ILE   4          3HG2      ILE   4   3.077  -2.260  -1.981
   31   1HD1  ILE   4          1HD1      ILE   4  -0.466   0.843  -2.577
   32   2HD1  ILE   4          2HD1      ILE   4  -1.456  -0.641  -2.450
   33   3HD1  ILE   4          3HD1      ILE   4  -0.695   0.019  -1.026
   34    H    GLN   5           H        GLN   5   3.560   2.242  -0.876
   35    HA   GLN   5           HA       GLN   5   6.282   1.216  -0.310
   36   1HB   GLN   5          HB2       GLN   5   5.224   4.069  -0.852
   37   2HB   GLN   5          HB3       GLN   5   6.907   3.592  -0.735
   38   1HG   GLN   5          HG2       GLN   5   4.964   2.679  -2.883
   39   2HG   GLN   5          HG3       GLN   5   6.313   3.816  -3.059
   40   1HE2  GLN   5          1HE2      GLN   5   7.225   0.179  -4.042
   41   2HE2  GLN   5          2HE2      GLN   5   5.724   1.045  -4.297
   42    H    VAL   6           H        VAL   6   7.503   3.094   1.166
   43    HA   VAL   6           HA       VAL   6   6.326   2.886   3.860
   44    HB   VAL   6           HB       VAL   6   9.017   4.120   3.167
   45   1HG1  VAL   6          1HG1      VAL   6   8.006   4.581   5.446
   46   2HG1  VAL   6          2HG1      VAL   6   7.867   2.810   5.688
   47   3HG1  VAL   6          3HG1      VAL   6   9.472   3.606   5.521
   48   1HG2  VAL   6          1HG2      VAL   6   9.149   1.845   2.342
   49   2HG2  VAL   6          2HG2      VAL   6   9.990   1.926   3.886
   50   3HG2  VAL   6          3HG2      VAL   6   8.355   1.210   3.794
   51    H    ILE   7           H        ILE   7   4.583   4.138   2.899
   52    HA   ILE   7           HA       ILE   7   4.660   7.059   3.352
   53    HB   ILE   7           HB       ILE   7   3.804   5.646   0.790
   54   1HG1  ILE   7          2HG1      ILE   7   6.187   6.144   0.732
   55   2HG1  ILE   7          3HG1      ILE   7   5.293   7.048  -0.464
   56   1HG2  ILE   7          1HG2      ILE   7   3.097   7.865  -0.092
   57   2HG2  ILE   7          2HG2      ILE   7   2.051   7.230   1.172
   58   3HG2  ILE   7          3HG2      ILE   7   3.224   8.509   1.552
   59   1HD1  ILE   7          1HD1      ILE   7   6.254   8.192   2.198
   60   2HD1  ILE   7          2HD1      ILE   7   7.039   8.455   0.637
   61   3HD1  ILE   7          3HD1      ILE   7   5.403   9.125   0.955
   62    H    VAL   8           H        VAL   8   2.384   7.877   3.600
   63    HA   VAL   8           HA       VAL   8   0.596   5.734   4.681
   64    HB   VAL   8           HB       VAL   8   1.197   8.416   5.933
   65   1HG1  VAL   8          1HG1      VAL   8  -0.617   6.148   6.876
   66   2HG1  VAL   8          2HG1      VAL   8  -0.162   7.595   7.833
   67   3HG1  VAL   8          3HG1      VAL   8  -1.128   7.769   6.370
   68   1HG2  VAL   8          1HG2      VAL   8   1.871   5.578   6.849
   69   2HG2  VAL   8          2HG2      VAL   8   3.038   6.810   6.323
   70   3HG2  VAL   8          3HG2      VAL   8   2.144   7.048   7.820
   71    H    ASN   9           H        ASN   9  -1.589   6.099   4.481
   72    HA   ASN   9           HA       ASN   9  -2.568   7.198   2.147
   73   1HB   ASN   9          HB2       ASN   9  -4.137   6.866   4.727
   74   2HB   ASN   9          HB3       ASN   9  -4.800   6.848   3.070
   75   1HD2  ASN   9          1HD2      ASN   9  -3.164   3.522   2.522
   76   2HD2  ASN   9          2HD2      ASN   9  -3.361   5.058   1.661
   77    H    VAL  10           H        VAL  10  -3.215   8.997   1.372
   78    HA   VAL  10           HA       VAL  10  -2.696  11.484   2.825
   79    HB   VAL  10           HB       VAL  10  -3.260  10.901  -0.085
   80   1HG1  VAL  10          1HG1      VAL  10  -3.884  13.188   0.332
   81   2HG1  VAL  10          2HG1      VAL  10  -2.383  13.497   1.247
   82   3HG1  VAL  10          3HG1      VAL  10  -2.372  13.207  -0.519
   83   1HG2  VAL  10          1HG2      VAL  10  -0.825  11.392  -0.380
   84   2HG2  VAL  10          2HG2      VAL  10  -0.665  11.504   1.389
   85   3HG2  VAL  10          3HG2      VAL  10  -1.095   9.969   0.623
   86    HA   PRO  11           HA       PRO  11  -7.136  12.206   3.567
   87   1HB   PRO  11          HB2       PRO  11  -6.048  15.022   3.864
   88   2HB   PRO  11          HB3       PRO  11  -7.233  14.155   4.886
   89   1HG   PRO  11          HG2       PRO  11  -4.671  14.388   5.720
   90   2HG   PRO  11          HG3       PRO  11  -5.506  12.804   5.854
   91   1HD   PRO  11          HD2       PRO  11  -3.598  13.737   3.685
   92   2HD   PRO  11          HD3       PRO  11  -3.609  12.194   4.575
   93    HA   PRO  12           HA       PRO  12  -8.699  13.945  -0.224
   94   1HB   PRO  12          HB2       PRO  12 -10.729  15.533   1.317
   95   2HB   PRO  12          HB3       PRO  12 -10.943  14.337   0.003
   96   1HG   PRO  12          HG2       PRO  12 -11.508  13.734   2.579
   97   2HG   PRO  12          HG3       PRO  12 -10.697  12.527   1.516
   98   1HD   PRO  12          HD2       PRO  12  -9.412  14.400   3.527
   99   2HD   PRO  12          HD3       PRO  12  -9.178  12.641   3.339
  100    H    SER  13           H        SER  13  -8.035  15.631  -1.441
  101    HA   SER  13           HA       SER  13  -7.262  18.249  -0.183
  102   1HB   SER  13          HB2       SER  13  -5.472  16.723  -1.134
  103   2HB   SER  13          HB3       SER  13  -6.173  16.976  -2.733
  104    HG   SER  13           HG       SER  13  -4.461  18.395  -2.329
  105    H    VAL  14           H        VAL  14  -9.897  18.086  -0.649
  106    HA   VAL  14           HA       VAL  14 -10.639  18.766  -3.357
  107    HB   VAL  14           HB       VAL  14 -12.178  17.633  -1.799
  108   1HG1  VAL  14          1HG1      VAL  14 -11.841  19.129   0.223
  109   2HG1  VAL  14          2HG1      VAL  14 -12.821  20.356  -0.612
  110   3HG1  VAL  14          3HG1      VAL  14 -13.521  18.792  -0.210
  111   1HG2  VAL  14          1HG2      VAL  14 -12.972  18.706  -3.880
  112   2HG2  VAL  14          2HG2      VAL  14 -14.206  18.734  -2.616
  113   3HG2  VAL  14          3HG2      VAL  14 -13.259  20.201  -2.985
  114    H    ARG  15           H        ARG  15 -10.897  20.684  -4.360
  115    HA   ARG  15           HA       ARG  15 -10.274  23.214  -2.820
  116   1HB   ARG  15          HB2       ARG  15  -8.836  21.933  -5.208
  117   2HB   ARG  15          HB3       ARG  15  -8.689  23.663  -4.858
  118   1HG   ARG  15          HG2       ARG  15  -7.700  23.266  -2.711
  119   2HG   ARG  15          HG3       ARG  15  -8.108  21.552  -2.738
  120   1HD   ARG  15          HD2       ARG  15  -6.660  21.304  -4.797
  121   2HD   ARG  15          HD3       ARG  15  -6.028  22.916  -4.466
  122    HE   ARG  15           HE       ARG  15  -5.803  20.461  -2.756
  123   1HH1  ARG  15          1HH1      ARG  15  -4.302  20.322  -1.237
  124   2HH1  ARG  15          2HH1      ARG  15  -3.132  21.618  -0.969
  125   1HH2  ARG  15          1HH2      ARG  15  -4.589  23.695  -3.308
  126   2HH2  ARG  15          2HH2      ARG  15  -3.322  23.518  -2.120
  127    H    ALA  16           H        ALA  16 -10.644  25.152  -4.017
  128    HA   ALA  16           HA       ALA  16 -12.943  25.010  -5.907
  129   1HB   ALA  16          HB1       ALA  16 -12.991  26.661  -4.085
  130   2HB   ALA  16          HB2       ALA  16 -11.473  27.380  -4.681
  131   3HB   ALA  16          HB3       ALA  16 -12.935  27.465  -5.669
  132    H    ARG  17           H        ARG  17 -12.495  24.627  -8.011
  133    HA   ARG  17           HA       ARG  17  -9.881  25.127  -9.192
  134   1HB   ARG  17          HB2       ARG  17 -11.552  23.371  -9.929
  135   2HB   ARG  17          HB3       ARG  17 -12.458  24.670 -10.717
  136   1HG   ARG  17          HG2       ARG  17 -10.516  25.218 -12.122
  137   2HG   ARG  17          HG3       ARG  17  -9.525  23.990 -11.300
  138   1HD   ARG  17          HD2       ARG  17 -12.097  23.392 -12.863
  139   2HD   ARG  17          HD3       ARG  17 -10.520  23.425 -13.627
  140    HE   ARG  17           HE       ARG  17 -11.671  21.221 -12.191
  141   1HH1  ARG  17          1HH1      ARG  17  -8.493  22.651 -12.728
  142   2HH1  ARG  17          2HH1      ARG  17  -7.717  21.090 -12.544
  143   1HH2  ARG  17          1HH2      ARG  17 -10.659  19.392 -12.019
  144   2HH2  ARG  17          2HH2      ARG  17  -8.901  19.278 -12.163
  145    H    GLN  18           H        GLN  18 -12.793  27.005  -8.908
  146    HA   GLN  18           HA       GLN  18 -11.415  29.522  -9.256
  147   1HB   GLN  18          HB2       GLN  18 -12.053  28.873 -11.656
  148   2HB   GLN  18          HB3       GLN  18 -13.743  28.910 -11.136
  149   1HG   GLN  18          HG2       GLN  18 -13.503  31.275 -10.469
  150   2HG   GLN  18          HG3       GLN  18 -11.799  31.234 -10.916
  151   1HE2  GLN  18          1HE2      GLN  18 -14.336  32.393 -13.694
  152   2HE2  GLN  18          2HE2      GLN  18 -14.598  32.468 -11.945
  153    H    SER  19           H        SER  19 -12.414  30.956  -7.843
  154    HA   SER  19           HA       SER  19 -14.379  29.712  -6.075
  155   1HB   SER  19          HB2       SER  19 -13.782  31.564  -4.542
  156   2HB   SER  19          HB3       SER  19 -12.372  30.648  -5.141
  157    HG   SER  19           HG       SER  19 -12.023  32.918  -5.216
  158    H    THR  20           H        THR  20 -14.654  32.002  -8.565
  159    HA   THR  20           HA       THR  20 -17.499  32.518  -7.900
  160    HB   THR  20           HB       THR  20 -15.514  34.752  -8.486
  161    HG1  THR  20           HG1      THR  20 -16.221  35.545  -6.539
  162   1HG2  THR  20          1HG2      THR  20 -18.533  34.873  -8.171
  163   2HG2  THR  20          2HG2      THR  20 -17.457  36.275  -8.283
  164   3HG2  THR  20          3HG2      THR  20 -17.654  35.210  -9.680
  165    H    MET  21           H        MET  21 -18.533  31.811  -9.521
  166    HA   MET  21           HA       MET  21 -17.611  32.115 -12.335
  167   1HB   MET  21          HB2       MET  21 -19.618  30.226 -11.019
  168   2HB   MET  21          HB3       MET  21 -19.334  30.311 -12.745
  169   1HG   MET  21          HG2       MET  21 -17.331  29.478 -10.622
  170   2HG   MET  21          HG3       MET  21 -18.208  28.434 -11.716
  171   1HE   MET  21          HE1       MET  21 -16.578  29.273 -15.235
  172   2HE   MET  21          HE2       MET  21 -17.884  28.428 -14.358
  173   3HE   MET  21          HE3       MET  21 -17.916  30.188 -14.547
  174    H    ASN  22           H        ASN  22 -19.244  32.734 -13.885
  175    HA   ASN  22           HA       ASN  22 -21.817  33.698 -12.986
  176   1HB   ASN  22          HB2       ASN  22 -20.254  35.652 -12.631
  177   2HB   ASN  22          HB3       ASN  22 -19.903  35.607 -14.357
  178   1HD2  ASN  22          1HD2      ASN  22 -22.415  38.117 -14.522
  179   2HD2  ASN  22          2HD2      ASN  22 -20.677  37.794 -14.529
  180    H    ALA  23           H        ALA  23 -23.321  34.052 -14.812
  181    HA   ALA  23           HA       ALA  23 -22.531  33.067 -17.471
  182   1HB   ALA  23          HB1       ALA  23 -22.557  30.988 -16.087
  183   2HB   ALA  23          HB2       ALA  23 -24.195  31.394 -15.508
  184   3HB   ALA  23          HB3       ALA  23 -23.902  31.000 -17.235
  185    H    THR  24           H        THR  24 -24.198  32.994 -18.998
  186    HA   THR  24           HA       THR  24 -26.173  35.105 -18.539
  187    HB   THR  24           HB       THR  24 -25.583  33.768 -21.180
  188    HG1  THR  24           HG1      THR  24 -23.872  35.035 -21.457
  189   1HG2  THR  24          1HG2      THR  24 -26.022  36.087 -22.008
  190   2HG2  THR  24          2HG2      THR  24 -27.435  35.369 -21.180
  191   3HG2  THR  24          3HG2      THR  24 -26.428  36.593 -20.362
  192    H    ALA  25           H        ALA  25 -28.244  34.759 -18.208
  193    HA   ALA  25           HA       ALA  25 -29.516  32.149 -18.780
  194   1HB   ALA  25          HB1       ALA  25 -30.507  34.685 -17.417
  195   2HB   ALA  25          HB2       ALA  25 -31.467  33.195 -17.584
  196   3HB   ALA  25          HB3       ALA  25 -29.969  33.184 -16.626
  197    H    ASN  26           H        ASN  26 -31.796  32.258 -19.702
  198    HA   ASN  26           HA       ASN  26 -33.217  32.465 -21.323
  199   1HB   ASN  26          HB2       ASN  26 -34.151  34.437 -21.524
  200   2HB   ASN  26          HB3       ASN  26 -32.856  35.064 -20.522
  201   1HD2  ASN  26          1HD2      ASN  26 -31.228  36.690 -23.308
  202   2HD2  ASN  26          2HD2      ASN  26 -30.819  35.727 -21.871
  203    H    LEU  27           H        LEU  27 -29.968  32.730 -22.206
  204    HA   LEU  27           HA       LEU  27 -30.485  32.363 -25.088
  205   1HB   LEU  27          HB2       LEU  27 -27.902  32.610 -23.510
  206   2HB   LEU  27          HB3       LEU  27 -28.000  32.508 -25.270
  207    HG   LEU  27           HG       LEU  27 -29.042  34.770 -23.508
  208   1HD1  LEU  27          1HD1      LEU  27 -26.892  34.728 -25.668
  209   2HD1  LEU  27          2HD1      LEU  27 -27.326  36.087 -24.614
  210   3HD1  LEU  27          3HD1      LEU  27 -26.569  34.632 -23.926
  211   1HD2  LEU  27          1HD2      LEU  27 -29.231  34.455 -26.533
  212   2HD2  LEU  27          2HD2      LEU  27 -30.598  34.571 -25.384
  213   3HD2  LEU  27          3HD2      LEU  27 -29.536  35.967 -25.640
  214    H    SER  28           H        SER  28 -30.344  30.254 -22.488
  215    HA   SER  28           HA       SER  28 -30.210  28.017 -22.278
  216   1HB   SER  28          HB2       SER  28 -30.520  27.923 -25.311
  217   2HB   SER  28          HB3       SER  28 -30.816  26.594 -24.171
  218    HG   SER  28           HG       SER  28 -32.701  27.773 -24.839
  219    H    GLN  29           H        GLN  29 -27.710  29.437 -22.429
  220    HA   GLN  29           HA       GLN  29 -25.844  27.932 -24.047
  221   1HB   GLN  29          HB2       GLN  29 -25.507  30.018 -21.860
  222   2HB   GLN  29          HB3       GLN  29 -24.133  29.288 -22.738
  223   1HG   GLN  29          HG2       GLN  29 -25.001  30.047 -24.871
  224   2HG   GLN  29          HG3       GLN  29 -26.395  30.801 -24.117
  225   1HE2  GLN  29          1HE2      GLN  29 -23.788  33.384 -24.742
  226   2HE2  GLN  29          2HE2      GLN  29 -24.669  32.252 -25.763
  227    H    SER  30           H        SER  30 -23.762  27.094 -23.021
  228    HA   SER  30           HA       SER  30 -24.360  25.311 -20.696
  229   1HB   SER  30          HB2       SER  30 -22.749  24.626 -23.183
  230   2HB   SER  30          HB3       SER  30 -22.959  23.590 -21.776
  231    HG   SER  30           HG       SER  30 -24.405  23.090 -23.465
  232    H    VAL  31           H        VAL  31 -22.699  24.891 -19.291
  233    HA   VAL  31           HA       VAL  31 -20.222  26.563 -19.450
  234    HB   VAL  31           HB       VAL  31 -22.342  26.925 -17.279
  235   1HG1  VAL  31          1HG1      VAL  31 -20.842  28.709 -16.376
  236   2HG1  VAL  31          2HG1      VAL  31 -20.161  27.103 -16.217
  237   3HG1  VAL  31          3HG1      VAL  31 -19.572  28.178 -17.513
  238   1HG2  VAL  31          1HG2      VAL  31 -22.319  29.322 -18.026
  239   2HG2  VAL  31          2HG2      VAL  31 -21.278  28.849 -19.416
  240   3HG2  VAL  31          3HG2      VAL  31 -22.943  28.235 -19.248
  241    H    THR  32           H        THR  32 -18.537  25.704 -18.267
  242    HA   THR  32           HA       THR  32 -19.058  23.373 -16.444
  243    HB   THR  32           HB       THR  32 -16.433  24.055 -17.788
  244    HG1  THR  32           HG1      THR  32 -17.932  23.526 -19.363
  245   1HG2  THR  32          1HG2      THR  32 -17.456  21.560 -16.349
  246   2HG2  THR  32          2HG2      THR  32 -15.996  21.616 -17.368
  247   3HG2  THR  32          3HG2      THR  32 -16.071  22.581 -15.900
  248    H    LEU  33           H        LEU  33 -18.070  23.269 -14.465
  249    HA   LEU  33           HA       LEU  33 -16.155  25.200 -13.482
  250   1HB   LEU  33          HB2       LEU  33 -17.560  26.122 -11.686
  251   2HB   LEU  33          HB3       LEU  33 -18.165  26.523 -13.274
  252    HG   LEU  33           HG       LEU  33 -19.786  24.441 -12.949
  253   1HD1  LEU  33          1HD1      LEU  33 -20.470  24.256 -10.538
  254   2HD1  LEU  33          2HD1      LEU  33 -18.889  23.591 -10.840
  255   3HD1  LEU  33          3HD1      LEU  33 -19.015  25.187 -10.085
  256   1HD2  LEU  33          1HD2      LEU  33 -20.194  27.050 -11.452
  257   2HD2  LEU  33          2HD2      LEU  33 -20.528  26.761 -13.183
  258   3HD2  LEU  33          3HD2      LEU  33 -21.441  25.864 -11.960
  259    H    ALA  34           H        ALA  34 -15.551  24.583 -11.103
  260    HA   ALA  34           HA       ALA  34 -16.298  21.838 -10.425
  261   1HB   ALA  34          HB1       ALA  34 -14.159  20.838 -10.875
  262   2HB   ALA  34          HB2       ALA  34 -14.568  21.682 -12.364
  263   3HB   ALA  34          HB3       ALA  34 -13.410  22.396 -11.225
  264    H    CYS  35           H        CYS  35 -15.797  21.124  -8.507
  265    HA   CYS  35           HA       CYS  35 -14.009  22.703  -6.709
  266   1HB   CYS  35          HB2       CYS  35 -16.356  22.799  -5.971
  267   2HB   CYS  35          HB3       CYS  35 -16.408  21.028  -5.902
  268    H    ASP  36           H        ASP  36 -12.235  21.541  -7.647
  269    HA   ASP  36           HA       ASP  36 -12.358  18.786  -8.328
  270   1HB   ASP  36          HB2       ASP  36 -10.127  18.947  -9.060
  271   2HB   ASP  36          HB3       ASP  36 -11.042  20.333  -9.612
  272    H    ALA  37           H        ALA  37 -12.243  17.073  -7.153
  273    HA   ALA  37           HA       ALA  37 -10.818  17.118  -4.554
  274   1HB   ALA  37          HB1       ALA  37 -13.223  16.361  -4.628
  275   2HB   ALA  37          HB2       ALA  37 -12.709  15.044  -5.706
  276   3HB   ALA  37          HB3       ALA  37 -12.118  15.112  -4.020
  277    H    ASP  38           H        ASP  38  -9.460  15.461  -3.899
  278    HA   ASP  38           HA       ASP  38  -8.290  13.482  -5.694
  279   1HB   ASP  38          HB2       ASP  38  -7.220  15.545  -6.480
  280   2HB   ASP  38          HB3       ASP  38  -6.790  15.984  -4.835
  281    H    GLY  39           H        GLY  39  -6.641  12.164  -4.488
  282   1HA   GLY  39          HA2       GLY  39  -5.799  12.420  -1.877
  283   2HA   GLY  39          HA3       GLY  39  -7.398  11.680  -1.717
  284    H    PHE  40           H        PHE  40  -5.371  10.199  -0.776
  285    HA   PHE  40           HA       PHE  40  -5.266   7.928  -2.679
  286   1HB   PHE  40          HB2       PHE  40  -2.798   8.937  -1.262
  287   2HB   PHE  40          HB3       PHE  40  -2.961   7.460  -2.197
  288    HD1  PHE  40           HD1      PHE  40  -3.180   7.474  -4.673
  289    HD2  PHE  40           HD2      PHE  40  -2.566  11.124  -2.410
  290    HE1  PHE  40           HE1      PHE  40  -2.543   8.659  -6.758
  291    HE2  PHE  40           HE2      PHE  40  -1.924  12.293  -4.508
  292    HZ   PHE  40           HZ       PHE  40  -1.916  11.071  -6.668
  293    HA   PRO  41           HA       PRO  41  -6.446   6.164  -2.544
  294   1HB   PRO  41          HB2       PRO  41  -8.825   5.140  -1.656
  295   2HB   PRO  41          HB3       PRO  41  -7.250   4.314  -1.413
  296   1HG   PRO  41          HG2       PRO  41  -8.725   6.132   0.530
  297   2HG   PRO  41          HG3       PRO  41  -8.125   4.450   0.810
  298   1HD   PRO  41          HD2       PRO  41  -6.683   6.674   1.521
  299   2HD   PRO  41          HD3       PRO  41  -5.860   5.217   0.831
  300    H    GLU  42           H        GLU  42  -8.008   6.811  -3.906
  301    HA   GLU  42           HA       GLU  42  -8.927   9.371  -4.225
  302   1HB   GLU  42          HB2       GLU  42 -10.353   6.830  -5.054
  303   2HB   GLU  42          HB3       GLU  42 -10.728   8.439  -5.667
  304   1HG   GLU  42          HG2       GLU  42  -8.458   8.647  -6.593
  305   2HG   GLU  42          HG3       GLU  42  -8.051   7.054  -5.992
  306    HA   PRO  43           HA       PRO  43 -11.845   9.776  -0.964
  307   1HB   PRO  43          HB2       PRO  43 -12.589  12.401  -1.191
  308   2HB   PRO  43          HB3       PRO  43 -10.893  11.911  -0.844
  309   1HG   PRO  43          HG2       PRO  43 -12.141  12.560  -3.547
  310   2HG   PRO  43          HG3       PRO  43 -10.651  13.259  -2.842
  311   1HD   PRO  43          HD2       PRO  43 -10.528  11.163  -4.565
  312   2HD   PRO  43          HD3       PRO  43  -9.418  11.302  -3.161
  313    H    THR  44           H        THR  44 -13.998  10.304  -0.360
  314    HA   THR  44           HA       THR  44 -16.091   9.886  -2.482
  315    HB   THR  44           HB       THR  44 -16.218   9.671   0.547
  316    HG1  THR  44           HG1      THR  44 -15.124   7.954  -0.439
  317   1HG2  THR  44          1HG2      THR  44 -18.434  10.292  -0.297
  318   2HG2  THR  44          2HG2      THR  44 -18.306   9.102  -1.599
  319   3HG2  THR  44          3HG2      THR  44 -18.454   8.578   0.086
  320    H    MET  45           H        MET  45 -17.773  11.574  -2.638
  321    HA   MET  45           HA       MET  45 -17.377  14.025  -1.032
  322   1HB   MET  45          HB2       MET  45 -16.876  15.421  -2.958
  323   2HB   MET  45          HB3       MET  45 -15.640  14.199  -2.729
  324   1HG   MET  45          HG2       MET  45 -16.629  12.833  -4.540
  325   2HG   MET  45          HG3       MET  45 -17.910  14.020  -4.748
  326   1HE   MET  45          HE1       MET  45 -17.563  16.461  -5.436
  327   2HE   MET  45          HE2       MET  45 -16.036  16.879  -4.597
  328   3HE   MET  45          HE3       MET  45 -16.181  17.053  -6.353
  329    H    THR  46           H        THR  46 -18.861  15.701  -1.388
  330    HA   THR  46           HA       THR  46 -21.090  15.457  -3.225
  331    HB   THR  46           HB       THR  46 -22.906  15.786  -1.594
  332    HG1  THR  46           HG1      THR  46 -22.526  15.406   0.582
  333   1HG2  THR  46          1HG2      THR  46 -23.280  13.611  -0.901
  334   2HG2  THR  46          2HG2      THR  46 -22.392  13.489  -2.418
  335   3HG2  THR  46          3HG2      THR  46 -21.537  13.202  -0.858
  336    H    TRP  47           H        TRP  47 -22.581  17.446  -2.905
  337    HA   TRP  47           HA       TRP  47 -21.418  19.734  -1.564
  338   1HB   TRP  47          HB2       TRP  47 -21.147  21.131  -3.626
  339   2HB   TRP  47          HB3       TRP  47 -19.939  19.955  -3.213
  340    HD1  TRP  47           HD1      TRP  47 -20.851  17.414  -4.856
  341    HE1  TRP  47           HE1      TRP  47 -19.940  17.424  -7.224
  342    HE3  TRP  47           HE3      TRP  47 -20.601  22.476  -5.614
  343    HZ2  TRP  47           HZ2      TRP  47 -18.908  19.347  -9.103
  344    HZ3  TRP  47           HZ3      TRP  47 -19.566  23.370  -7.686
  345    HH2  TRP  47           HH2      TRP  47 -18.759  21.795  -9.446
  346    H    THR  48           H        THR  48 -22.674  21.813  -1.947
  347    HA   THR  48           HA       THR  48 -25.558  21.117  -2.372
  348    HB   THR  48           HB       THR  48 -26.204  22.231  -0.378
  349    HG1  THR  48           HG1      THR  48 -24.604  23.063   1.061
  350   1HG2  THR  48          1HG2      THR  48 -23.867  20.476   0.453
  351   2HG2  THR  48          2HG2      THR  48 -25.340  20.848   1.368
  352   3HG2  THR  48          3HG2      THR  48 -25.469  19.861  -0.094
  353    H    LYS  49           H        LYS  49 -26.957  22.712  -2.896
  354    HA   LYS  49           HA       LYS  49 -25.803  24.998  -4.394
  355   1HB   LYS  49          HB2       LYS  49 -27.417  23.147  -5.284
  356   2HB   LYS  49          HB3       LYS  49 -28.686  23.968  -4.358
  357   1HG   LYS  49          HG2       LYS  49 -28.181  26.065  -5.639
  358   2HG   LYS  49          HG3       LYS  49 -26.972  25.141  -6.578
  359   1HD   LYS  49          HD2       LYS  49 -28.746  23.597  -7.348
  360   2HD   LYS  49          HD3       LYS  49 -29.963  24.480  -6.405
  361   1HE   LYS  49          HE2       LYS  49 -28.316  25.704  -8.687
  362   2HE   LYS  49          HE3       LYS  49 -29.919  25.048  -8.827
  363   1HZ   LYS  49          HZ1       LYS  49 -30.600  26.756  -7.069
  364   2HZ   LYS  49          HZ2       LYS  49 -29.160  27.508  -7.389
  365   3HZ   LYS  49          HZ3       LYS  49 -30.276  27.309  -8.551
  366    H    ASP  50           H        ASP  50 -25.408  25.626  -1.972
  367    HA   ASP  50           HA       ASP  50 -25.716  26.978  -0.205
  368   1HB   ASP  50          HB2       ASP  50 -26.370  28.618  -2.012
  369   2HB   ASP  50          HB3       ASP  50 -28.055  28.282  -1.664
  370    H    GLY  51           H        GLY  51 -27.634  24.476  -0.715
  371   1HA   GLY  51          HA2       GLY  51 -28.436  24.187   1.938
  372   2HA   GLY  51          HA3       GLY  51 -29.842  24.845   1.125
  373    H    GLU  52           H        GLU  52 -29.396  23.412  -1.393
  374    HA   GLU  52           HA       GLU  52 -30.408  20.741  -0.523
  375   1HB   GLU  52          HB2       GLU  52 -31.559  20.620  -2.674
  376   2HB   GLU  52          HB3       GLU  52 -32.052  22.015  -1.733
  377   1HG   GLU  52          HG2       GLU  52 -30.568  23.471  -3.137
  378   2HG   GLU  52          HG3       GLU  52 -30.087  22.054  -4.058
  379    HA   PRO  53           HA       PRO  53 -26.872  18.851  -1.983
  380   1HB   PRO  53          HB2       PRO  53 -27.543  16.256  -2.418
  381   2HB   PRO  53          HB3       PRO  53 -27.623  17.018  -0.800
  382   1HG   PRO  53          HG2       PRO  53 -29.889  16.670  -2.799
  383   2HG   PRO  53          HG3       PRO  53 -29.887  16.227  -1.047
  384   1HD   PRO  53          HD2       PRO  53 -30.938  18.590  -1.943
  385   2HD   PRO  53          HD3       PRO  53 -30.015  18.469  -0.415
  386    H    ILE  54           H        ILE  54 -25.663  18.806  -3.656
  387    HA   ILE  54           HA       ILE  54 -26.583  18.316  -6.456
  388    HB   ILE  54           HB       ILE  54 -23.960  19.469  -5.504
  389   1HG1  ILE  54          2HG1      ILE  54 -26.284  21.115  -6.615
  390   2HG1  ILE  54          3HG1      ILE  54 -26.044  20.913  -4.884
  391   1HG2  ILE  54          1HG2      ILE  54 -23.729  20.257  -7.835
  392   2HG2  ILE  54          2HG2      ILE  54 -23.967  18.521  -7.851
  393   3HG2  ILE  54          3HG2      ILE  54 -25.329  19.574  -8.242
  394   1HD1  ILE  54          1HD1      ILE  54 -23.798  21.868  -4.965
  395   2HD1  ILE  54          2HD1      ILE  54 -23.905  22.073  -6.709
  396   3HD1  ILE  54          3HD1      ILE  54 -24.987  22.996  -5.680
  397    H    GLU  55           H        GLU  55 -26.725  16.137  -4.961
  398    HA   GLU  55           HA       GLU  55 -24.412  14.442  -5.063
  399   1HB   GLU  55          HB2       GLU  55 -26.082  12.618  -4.807
  400   2HB   GLU  55          HB3       GLU  55 -26.056  13.817  -3.530
  401   1HG   GLU  55          HG2       GLU  55 -28.067  14.894  -4.456
  402   2HG   GLU  55          HG3       GLU  55 -28.154  13.641  -5.698
  403    H    GLN  56           H        GLN  56 -23.581  14.913  -7.098
  404    HA   GLN  56           HA       GLN  56 -24.716  14.941  -9.576
  405   1HB   GLN  56          HB2       GLN  56 -21.954  13.870  -8.923
  406   2HB   GLN  56          HB3       GLN  56 -22.455  14.575 -10.475
  407   1HG   GLN  56          HG2       GLN  56 -22.782  16.769  -9.382
  408   2HG   GLN  56          HG3       GLN  56 -22.231  16.095  -7.850
  409   1HE2  GLN  56          1HE2      GLN  56 -18.783  15.842  -8.862
  410   2HE2  GLN  56          2HE2      GLN  56 -19.988  15.047  -7.839
  411    H    GLU  57           H        GLU  57 -24.412  11.993  -7.849
  412    HA   GLU  57           HA       GLU  57 -24.416  10.230 -10.238
  413   1HB   GLU  57          HB2       GLU  57 -24.477   9.597  -7.263
  414   2HB   GLU  57          HB3       GLU  57 -24.327   8.422  -8.559
  415   1HG   GLU  57          HG2       GLU  57 -22.188   9.495  -9.287
  416   2HG   GLU  57          HG3       GLU  57 -22.289  10.559  -7.883
  417    H    ASP  58           H        ASP  58 -26.760  11.913  -8.531
  418    HA   ASP  58           HA       ASP  58 -28.912  10.256  -9.707
  419   1HB   ASP  58          HB2       ASP  58 -28.617   9.560  -7.291
  420   2HB   ASP  58          HB3       ASP  58 -28.903  11.226  -6.805
  421    H    ASN  59           H        ASN  59 -27.879  13.367  -8.400
  422    HA   ASN  59           HA       ASN  59 -30.234  14.766  -9.547
  423   1HB   ASN  59          HB2       ASN  59 -29.345  15.333  -7.243
  424   2HB   ASN  59          HB3       ASN  59 -27.874  15.956  -8.027
  425   1HD2  ASN  59          1HD2      ASN  59 -30.020  18.893  -7.589
  426   2HD2  ASN  59          2HD2      ASN  59 -29.033  17.857  -6.582
  427    H    GLU  60           H        GLU  60 -30.052  14.681 -11.708
  428    HA   GLU  60           HA       GLU  60 -27.544  15.551 -13.082
  429   1HB   GLU  60          HB2       GLU  60 -28.192  13.024 -12.692
  430   2HB   GLU  60          HB3       GLU  60 -29.399  13.312 -13.940
  431   1HG   GLU  60          HG2       GLU  60 -27.533  13.976 -15.485
  432   2HG   GLU  60          HG3       GLU  60 -26.405  13.694 -14.156
  433    H    GLU  61           H        GLU  61 -30.531  16.642 -12.646
  434    HA   GLU  61           HA       GLU  61 -32.145  16.497 -14.805
  435   1HB   GLU  61          HB2       GLU  61 -31.782  18.960 -13.077
  436   2HB   GLU  61          HB3       GLU  61 -33.163  18.661 -14.154
  437   1HG   GLU  61          HG2       GLU  61 -33.502  16.475 -12.874
  438   2HG   GLU  61          HG3       GLU  61 -32.382  17.109 -11.666
  439    H    LYS  62           H        LYS  62 -29.401  18.723 -14.802
  440    HA   LYS  62           HA       LYS  62 -29.353  18.659 -17.714
  441   1HB   LYS  62          HB2       LYS  62 -29.525  21.062 -18.174
  442   2HB   LYS  62          HB3       LYS  62 -31.021  20.412 -17.481
  443   1HG   LYS  62          HG2       LYS  62 -30.326  21.385 -15.253
  444   2HG   LYS  62          HG3       LYS  62 -28.920  22.093 -16.061
  445   1HD   LYS  62          HD2       LYS  62 -30.594  23.230 -17.668
  446   2HD   LYS  62          HD3       LYS  62 -31.880  22.687 -16.592
  447   1HE   LYS  62          HE2       LYS  62 -30.722  23.849 -14.688
  448   2HE   LYS  62          HE3       LYS  62 -29.420  24.313 -15.767
  449   1HZ   LYS  62          HZ1       LYS  62 -32.217  25.275 -15.892
  450   2HZ   LYS  62          HZ2       LYS  62 -30.831  26.121 -15.535
  451   3HZ   LYS  62          HZ3       LYS  62 -31.086  25.570 -17.058
  452    H    TYR  63           H        TYR  63 -27.623  17.598 -15.981
  453    HA   TYR  63           HA       TYR  63 -25.139  18.902 -16.616
  454   1HB   TYR  63          HB2       TYR  63 -24.660  19.048 -13.966
  455   2HB   TYR  63          HB3       TYR  63 -25.238  20.385 -14.904
  456    HD1  TYR  63           HD1      TYR  63 -26.428  17.651 -12.621
  457    HD2  TYR  63           HD2      TYR  63 -27.188  21.530 -14.342
  458    HE1  TYR  63           HE1      TYR  63 -28.357  17.978 -11.063
  459    HE2  TYR  63           HE2      TYR  63 -29.100  21.842 -12.802
  460    HH   TYR  63           HH       TYR  63 -30.359  20.930 -11.111
  461    H    SER  64           H        SER  64 -23.275  17.842 -15.946
  462    HA   SER  64           HA       SER  64 -23.209  15.312 -14.566
  463   1HB   SER  64          HB2       SER  64 -22.657  13.863 -16.450
  464   2HB   SER  64          HB3       SER  64 -24.280  14.535 -16.622
  465    HG   SER  64           HG       SER  64 -23.116  14.670 -18.571
  466    H    PHE  65           H        PHE  65 -21.006  14.294 -14.623
  467    HA   PHE  65           HA       PHE  65 -18.781  16.112 -15.263
  468   1HB   PHE  65          HB2       PHE  65 -18.250  16.167 -12.997
  469   2HB   PHE  65          HB3       PHE  65 -19.985  16.357 -12.997
  470    HD1  PHE  65           HD1      PHE  65 -17.298  14.633 -11.478
  471    HD2  PHE  65           HD2      PHE  65 -21.394  14.032 -12.702
  472    HE1  PHE  65           HE1      PHE  65 -17.453  12.701  -9.972
  473    HE2  PHE  65           HE2      PHE  65 -21.509  12.033 -11.271
  474    HZ   PHE  65           HZ       PHE  65 -19.562  11.370  -9.859
  475    H    ASN  66           H        ASN  66 -16.686  15.049 -14.406
  476    HA   ASN  66           HA       ASN  66 -16.499  12.189 -15.286
  477   1HB   ASN  66          HB2       ASN  66 -14.188  12.785 -16.023
  478   2HB   ASN  66          HB3       ASN  66 -15.459  13.600 -16.904
  479   1HD2  ASN  66          1HD2      ASN  66 -13.658  14.314 -13.832
  480   2HD2  ASN  66          2HD2      ASN  66 -13.211  15.943 -14.322
  481    H    TYR  67           H        TYR  67 -14.778  10.929 -14.356
  482    HA   TYR  67           HA       TYR  67 -14.434  11.298 -11.462
  483   1HB   TYR  67          HB2       TYR  67 -13.282   9.194 -13.348
  484   2HB   TYR  67          HB3       TYR  67 -13.354   9.096 -11.592
  485    HD1  TYR  67           HD1      TYR  67 -15.050   8.178 -14.565
  486    HD2  TYR  67           HD2      TYR  67 -15.724   9.266 -10.465
  487    HE1  TYR  67           HE1      TYR  67 -17.320   7.121 -14.664
  488    HE2  TYR  67           HE2      TYR  67 -17.958   8.169 -10.555
  489    HH   TYR  67           HH       TYR  67 -19.474   6.990 -11.803
  490    H    ASP  68           H        ASP  68 -12.129  10.703 -10.609
  491    HA   ASP  68           HA       ASP  68 -10.169  11.596 -10.031
  492   1HB   ASP  68          HB2       ASP  68  -9.589  10.215 -12.100
  493   2HB   ASP  68          HB3       ASP  68  -9.562  11.711 -13.020
  494    H    GLY  69           H        GLY  69 -12.318  13.428 -10.364
  495   1HA   GLY  69          HA2       GLY  69 -11.270  16.011  -9.996
  496   2HA   GLY  69          HA3       GLY  69 -11.736  15.867 -11.704
  497    H    SER  70           H        SER  70 -13.226  17.624 -10.882
  498    HA   SER  70           HA       SER  70 -15.845  16.518  -9.964
  499   1HB   SER  70          HB2       SER  70 -14.582  19.035  -8.874
  500   2HB   SER  70          HB3       SER  70 -16.034  18.253  -8.304
  501    HG   SER  70           HG       SER  70 -14.234  17.853  -6.981
  502    H    GLU  71           H        GLU  71 -14.918  17.395 -12.642
  503    HA   GLU  71           HA       GLU  71 -15.764  20.146 -13.046
  504   1HB   GLU  71          HB2       GLU  71 -14.917  17.965 -14.968
  505   2HB   GLU  71          HB3       GLU  71 -15.340  19.621 -15.450
  506   1HG   GLU  71          HG2       GLU  71 -12.942  19.418 -15.348
  507   2HG   GLU  71          HG3       GLU  71 -13.531  20.529 -14.105
  508    H    LEU  72           H        LEU  72 -17.765  20.438 -12.480
  509    HA   LEU  72           HA       LEU  72 -19.997  18.816 -13.453
  510   1HB   LEU  72          HB2       LEU  72 -19.957  19.673 -11.160
  511   2HB   LEU  72          HB3       LEU  72 -19.769  21.322 -11.711
  512    HG   LEU  72           HG       LEU  72 -22.055  21.214 -12.731
  513   1HD1  LEU  72          1HD1      LEU  72 -22.129  18.465 -11.432
  514   2HD1  LEU  72          2HD1      LEU  72 -23.557  19.320 -12.030
  515   3HD1  LEU  72          3HD1      LEU  72 -22.272  18.833 -13.166
  516   1HD2  LEU  72          1HD2      LEU  72 -21.996  20.447  -9.781
  517   2HD2  LEU  72          2HD2      LEU  72 -21.737  22.074 -10.447
  518   3HD2  LEU  72          3HD2      LEU  72 -23.319  21.259 -10.625
  519    H    ILE  73           H        ILE  73 -20.376  19.023 -15.530
  520    HA   ILE  73           HA       ILE  73 -20.342  21.658 -16.888
  521    HB   ILE  73           HB       ILE  73 -21.077  18.944 -18.002
  522   1HG1  ILE  73          2HG1      ILE  73 -18.368  20.173 -18.552
  523   2HG1  ILE  73          3HG1      ILE  73 -18.573  19.245 -17.073
  524   1HG2  ILE  73          1HG2      ILE  73 -21.890  20.846 -19.311
  525   2HG2  ILE  73          2HG2      ILE  73 -20.297  21.598 -19.299
  526   3HG2  ILE  73          3HG2      ILE  73 -20.540  20.093 -20.192
  527   1HD1  ILE  73          1HD1      ILE  73 -17.722  17.815 -18.843
  528   2HD1  ILE  73          2HD1      ILE  73 -19.331  17.276 -18.298
  529   3HD1  ILE  73          3HD1      ILE  73 -19.175  18.164 -19.848
  530    H    ILE  74           H        ILE  74 -22.162  22.787 -17.019
  531    HA   ILE  74           HA       ILE  74 -24.832  21.531 -16.610
  532    HB   ILE  74           HB       ILE  74 -24.003  24.435 -16.330
  533   1HG1  ILE  74          2HG1      ILE  74 -24.929  22.603 -14.063
  534   2HG1  ILE  74          3HG1      ILE  74 -23.218  22.829 -14.444
  535   1HG2  ILE  74          1HG2      ILE  74 -26.674  23.084 -15.884
  536   2HG2  ILE  74          2HG2      ILE  74 -26.304  24.744 -15.336
  537   3HG2  ILE  74          3HG2      ILE  74 -26.285  24.356 -17.053
  538   1HD1  ILE  74          1HD1      ILE  74 -25.183  24.938 -13.439
  539   2HD1  ILE  74          2HD1      ILE  74 -23.751  24.271 -12.624
  540   3HD1  ILE  74          3HD1      ILE  74 -23.536  25.317 -14.053
  541    H    LYS  75           H        LYS  75 -26.333  21.846 -18.115
  542    HA   LYS  75           HA       LYS  75 -25.658  23.449 -20.550
  543   1HB   LYS  75          HB2       LYS  75 -26.895  21.895 -21.945
  544   2HB   LYS  75          HB3       LYS  75 -25.436  21.189 -21.225
  545   1HG   LYS  75          HG2       LYS  75 -26.834  19.994 -19.546
  546   2HG   LYS  75          HG3       LYS  75 -28.273  20.755 -20.168
  547   1HD   LYS  75          HD2       LYS  75 -28.135  18.510 -20.948
  548   2HD   LYS  75          HD3       LYS  75 -27.943  19.583 -22.325
  549   1HE   LYS  75          HE2       LYS  75 -25.521  19.258 -22.300
  550   2HE   LYS  75          HE3       LYS  75 -25.634  18.252 -20.845
  551   1HZ   LYS  75          HZ1       LYS  75 -25.480  16.891 -22.870
  552   2HZ   LYS  75          HZ2       LYS  75 -26.929  16.648 -22.188
  553   3HZ   LYS  75          HZ3       LYS  75 -26.800  17.589 -23.502
  554    H    LYS  76           H        LYS  76 -27.345  24.507 -21.469
  555    HA   LYS  76           HA       LYS  76 -29.261  25.783 -21.596
  556   1HB   LYS  76          HB2       LYS  76 -30.186  23.474 -21.848
  557   2HB   LYS  76          HB3       LYS  76 -30.590  23.437 -20.133
  558   1HG   LYS  76          HG2       LYS  76 -32.162  25.293 -20.410
  559   2HG   LYS  76          HG3       LYS  76 -31.658  25.529 -22.110
  560   1HD   LYS  76          HD2       LYS  76 -32.521  23.251 -22.628
  561   2HD   LYS  76          HD3       LYS  76 -33.045  23.058 -20.939
  562   1HE   LYS  76          HE2       LYS  76 -34.521  25.057 -21.176
  563   2HE   LYS  76          HE3       LYS  76 -34.014  25.227 -22.860
  564   1HZ   LYS  76          HZ1       LYS  76 -36.109  24.024 -22.702
  565   2HZ   LYS  76          HZ2       LYS  76 -34.957  23.032 -23.316
  566   3HZ   LYS  76          HZ3       LYS  76 -35.428  22.861 -21.765
  567    H    VAL  77           H        VAL  77 -27.648  26.809 -19.938
  568    HA   VAL  77           HA       VAL  77 -28.447  27.065 -17.206
  569    HB   VAL  77           HB       VAL  77 -26.699  28.861 -18.961
  570   1HG1  VAL  77          1HG1      VAL  77 -27.152  28.929 -15.952
  571   2HG1  VAL  77          2HG1      VAL  77 -25.817  29.738 -16.780
  572   3HG1  VAL  77          3HG1      VAL  77 -27.465  30.248 -17.106
  573   1HG2  VAL  77          1HG2      VAL  77 -25.814  26.567 -18.549
  574   2HG2  VAL  77          2HG2      VAL  77 -24.854  27.801 -17.767
  575   3HG2  VAL  77          3HG2      VAL  77 -26.006  26.824 -16.800
  576    H    ASP  78           H        ASP  78 -29.668  28.506 -16.096
  577    HA   ASP  78           HA       ASP  78 -30.733  30.916 -17.306
  578   1HB   ASP  78          HB2       ASP  78 -32.265  28.823 -17.901
  579   2HB   ASP  78          HB3       ASP  78 -32.799  29.007 -16.226
  580    H    LYS  79           H        LYS  79 -32.572  31.709 -15.453
  581    HA   LYS  79           HA       LYS  79 -30.930  32.635 -13.297
  582   1HB   LYS  79          HB2       LYS  79 -33.970  32.609 -13.539
  583   2HB   LYS  79          HB3       LYS  79 -33.040  33.546 -12.374
  584   1HG   LYS  79          HG2       LYS  79 -31.846  34.657 -14.337
  585   2HG   LYS  79          HG3       LYS  79 -32.993  33.849 -15.408
  586   1HD   LYS  79          HD2       LYS  79 -33.719  35.833 -13.217
  587   2HD   LYS  79          HD3       LYS  79 -33.700  36.145 -14.946
  588   1HE   LYS  79          HE2       LYS  79 -35.463  34.458 -15.306
  589   2HE   LYS  79          HE3       LYS  79 -35.531  34.153 -13.564
  590   1HZ   LYS  79          HZ1       LYS  79 -36.074  36.786 -14.820
  591   2HZ   LYS  79          HZ2       LYS  79 -37.232  35.757 -14.312
  592   3HZ   LYS  79          HZ3       LYS  79 -36.203  36.446 -13.232
  593    H    SER  80           H        SER  80 -32.735  29.662 -13.541
  594    HA   SER  80           HA       SER  80 -33.026  29.102 -10.730
  595   1HB   SER  80          HB2       SER  80 -33.491  26.792 -11.582
  596   2HB   SER  80          HB3       SER  80 -34.486  28.080 -12.307
  597    HG   SER  80           HG       SER  80 -33.731  26.670 -13.905
  598    H    ASP  81           H        ASP  81 -30.244  28.941 -12.821
  599    HA   ASP  81           HA       ASP  81 -28.927  26.809 -11.287
  600   1HB   ASP  81          HB2       ASP  81 -27.958  28.613 -13.563
  601   2HB   ASP  81          HB3       ASP  81 -27.016  27.326 -12.829
  602    H    GLU  82           H        GLU  82 -29.213  30.174 -10.737
  603    HA   GLU  82           HA       GLU  82 -26.644  30.801  -9.732
  604   1HB   GLU  82          HB2       GLU  82 -28.377  32.421 -10.267
  605   2HB   GLU  82          HB3       GLU  82 -29.382  31.847  -8.925
  606   1HG   GLU  82          HG2       GLU  82 -27.939  32.784  -7.287
  607   2HG   GLU  82          HG3       GLU  82 -26.586  32.906  -8.421
  608    H    ALA  83           H        ALA  83 -25.563  30.519  -7.777
  609    HA   ALA  83           HA       ALA  83 -26.813  29.251  -5.463
  610   1HB   ALA  83          HB1       ALA  83 -26.559  27.376  -7.167
  611   2HB   ALA  83          HB2       ALA  83 -24.826  27.708  -7.215
  612   3HB   ALA  83          HB3       ALA  83 -25.565  27.111  -5.728
  613    H    GLU  84           H        GLU  84 -25.268  28.672  -3.782
  614    HA   GLU  84           HA       GLU  84 -22.570  29.917  -3.970
  615   1HB   GLU  84          HB2       GLU  84 -24.046  31.386  -2.584
  616   2HB   GLU  84          HB3       GLU  84 -24.346  30.018  -1.497
  617   1HG   GLU  84          HG2       GLU  84 -21.944  29.874  -1.002
  618   2HG   GLU  84          HG3       GLU  84 -21.603  31.172  -2.160
  619    H    TYR  85           H        TYR  85 -21.702  27.991  -4.537
  620    HA   TYR  85           HA       TYR  85 -22.571  25.473  -3.541
  621   1HB   TYR  85          HB2       TYR  85 -20.015  26.239  -4.978
  622   2HB   TYR  85          HB3       TYR  85 -20.544  24.617  -4.711
  623    HD1  TYR  85           HD1      TYR  85 -20.235  26.881  -7.248
  624    HD2  TYR  85           HD2      TYR  85 -23.202  24.298  -5.510
  625    HE1  TYR  85           HE1      TYR  85 -21.309  26.557  -9.488
  626    HE2  TYR  85           HE2      TYR  85 -24.268  23.999  -7.743
  627    HH   TYR  85           HH       TYR  85 -24.166  24.450  -9.943
  628    H    ILE  86           H        ILE  86 -21.934  24.359  -1.819
  629    HA   ILE  86           HA       ILE  86 -19.276  24.910  -0.547
  630    HB   ILE  86           HB       ILE  86 -21.818  24.058   0.883
  631   1HG1  ILE  86          2HG1      ILE  86 -20.393  26.767   0.856
  632   2HG1  ILE  86          3HG1      ILE  86 -21.983  26.424   0.202
  633   1HG2  ILE  86          1HG2      ILE  86 -19.035  24.791   1.969
  634   2HG2  ILE  86          2HG2      ILE  86 -20.424  24.196   2.913
  635   3HG2  ILE  86          3HG2      ILE  86 -19.659  23.127   1.790
  636   1HD1  ILE  86          1HD1      ILE  86 -21.236  26.389   3.141
  637   2HD1  ILE  86          2HD1      ILE  86 -22.277  27.544   2.302
  638   3HD1  ILE  86          3HD1      ILE  86 -22.817  25.844   2.509
  639    H    CYS  87           H        CYS  87 -18.001  23.202  -0.655
  640    HA   CYS  87           HA       CYS  87 -19.152  20.571  -1.429
  641   1HB   CYS  87          HB2       CYS  87 -17.100  20.401  -2.957
  642   2HB   CYS  87          HB3       CYS  87 -18.409  21.449  -3.483
  643    H    ILE  88           H        ILE  88 -18.438  18.811  -0.634
  644    HA   ILE  88           HA       ILE  88 -16.358  18.941   1.523
  645    HB   ILE  88           HB       ILE  88 -18.945  17.335   1.456
  646   1HG1  ILE  88          2HG1      ILE  88 -19.626  19.636   1.680
  647   2HG1  ILE  88          3HG1      ILE  88 -19.825  18.793   3.203
  648   1HG2  ILE  88          1HG2      ILE  88 -17.319  16.225   2.813
  649   2HG2  ILE  88          2HG2      ILE  88 -16.895  17.730   3.666
  650   3HG2  ILE  88          3HG2      ILE  88 -18.488  16.974   3.876
  651   1HD1  ILE  88          1HD1      ILE  88 -19.045  21.022   3.582
  652   2HD1  ILE  88          2HD1      ILE  88 -17.767  19.894   4.070
  653   3HD1  ILE  88          3HD1      ILE  88 -17.639  20.783   2.532
  654    H    ALA  89           H        ALA  89 -14.935  17.229   1.656
  655    HA   ALA  89           HA       ALA  89 -15.564  14.782   0.132
  656   1HB   ALA  89          HB1       ALA  89 -13.314  14.685  -0.798
  657   2HB   ALA  89          HB2       ALA  89 -14.121  16.172  -1.329
  658   3HB   ALA  89          HB3       ALA  89 -12.896  16.213  -0.033
  659    H    GLU  90           H        GLU  90 -14.633  12.906   0.945
  660    HA   GLU  90           HA       GLU  90 -13.262  12.967   3.598
  661   1HB   GLU  90          HB2       GLU  90 -15.673  13.088   4.027
  662   2HB   GLU  90          HB3       GLU  90 -15.944  11.676   3.001
  663   1HG   GLU  90          HG2       GLU  90 -14.561  10.308   4.611
  664   2HG   GLU  90          HG3       GLU  90 -14.308  11.743   5.580
  665    H    ASN  91           H        ASN  91 -12.002  11.133   3.956
  666    HA   ASN  91           HA       ASN  91 -12.528   8.687   2.509
  667   1HB   ASN  91          HB2       ASN  91 -10.500   8.296   1.444
  668   2HB   ASN  91          HB3       ASN  91 -10.995   9.924   0.978
  669   1HD2  ASN  91          1HD2      ASN  91  -7.424  10.282   1.485
  670   2HD2  ASN  91          2HD2      ASN  91  -8.526   9.523   0.338
  671    H    LYS  92           H        LYS  92 -10.138   7.315   3.262
  672    HA   LYS  92           HA       LYS  92 -10.866   6.715   6.024
  673   1HB   LYS  92          HB2       LYS  92  -8.543   5.225   5.236
  674   2HB   LYS  92          HB3       LYS  92 -10.161   4.643   5.509
  675   1HG   LYS  92          HG2       LYS  92  -9.066   5.682   2.864
  676   2HG   LYS  92          HG3       LYS  92  -9.189   3.987   3.369
  677   1HD   LYS  92          HD2       LYS  92 -11.740   4.463   3.675
  678   2HD   LYS  92          HD3       LYS  92 -11.432   5.851   2.584
  679   1HE   LYS  92          HE2       LYS  92 -10.461   4.330   0.896
  680   2HE   LYS  92          HE3       LYS  92 -10.730   2.946   1.951
  681   1HZ   LYS  92          HZ1       LYS  92 -13.116   3.385   1.832
  682   2HZ   LYS  92          HZ2       LYS  92 -12.873   4.679   0.831
  683   3HZ   LYS  92          HZ3       LYS  92 -12.517   3.158   0.338
  684    H    ALA  93           H        ALA  93  -8.521   8.744   4.654
  685    HA   ALA  93           HA       ALA  93  -6.714   8.721   7.014
  686   1HB   ALA  93          HB1       ALA  93  -5.776   8.621   4.736
  687   2HB   ALA  93          HB2       ALA  93  -6.518  10.172   4.321
  688   3HB   ALA  93          HB3       ALA  93  -5.270  10.073   5.595
  689    H    GLY  94           H        GLY  94  -9.230  10.767   5.468
  690   1HA   GLY  94          HA2       GLY  94  -9.524  12.448   7.749
  691   2HA   GLY  94          HA3       GLY  94  -8.462  13.252   6.598
  692    H    GLU  95           H        GLU  95 -10.040  14.912   6.556
  693    HA   GLU  95           HA       GLU  95 -12.229  14.614   4.600
  694   1HB   GLU  95          HB2       GLU  95 -13.194  13.902   6.798
  695   2HB   GLU  95          HB3       GLU  95 -12.662  15.435   7.511
  696   1HG   GLU  95          HG2       GLU  95 -14.161  16.610   5.852
  697   2HG   GLU  95          HG3       GLU  95 -14.766  15.032   5.332
  698    H    GLN  96           H        GLN  96 -12.763  16.607   3.634
  699    HA   GLN  96           HA       GLN  96 -11.653  19.106   4.681
  700   1HB   GLN  96          HB2       GLN  96  -9.798  17.788   3.533
  701   2HB   GLN  96          HB3       GLN  96 -10.600  18.143   1.998
  702   1HG   GLN  96          HG2       GLN  96 -10.216  20.487   2.244
  703   2HG   GLN  96          HG3       GLN  96  -9.886  20.341   3.951
  704   1HE2  GLN  96          1HE2      GLN  96  -7.842  18.938   4.516
  705   2HE2  GLN  96          2HE2      GLN  96  -6.467  19.190   3.448
  706    H    ASP  97           H        ASP  97 -12.022  20.968   3.006
  707    HA   ASP  97           HA       ASP  97 -14.425  20.632   1.326
  708   1HB   ASP  97          HB2       ASP  97 -15.765  22.182   2.614
  709   2HB   ASP  97          HB3       ASP  97 -15.297  20.824   3.610
  710    H    ALA  98           H        ALA  98 -15.020  22.483   0.112
  711    HA   ALA  98           HA       ALA  98 -13.465  24.976   0.300
  712   1HB   ALA  98          HB1       ALA  98 -12.197  23.611  -1.307
  713   2HB   ALA  98          HB2       ALA  98 -13.632  23.425  -2.318
  714   3HB   ALA  98          HB3       ALA  98 -12.922  25.028  -2.113
  715    H    THR  99           H        THR  99 -14.448  26.559  -1.574
  716    HA   THR  99           HA       THR  99 -17.438  26.469  -1.526
  717    HB   THR  99           HB       THR  99 -15.698  28.681  -0.353
  718    HG1  THR  99           HG1      THR  99 -16.636  28.086   1.579
  719   1HG2  THR  99          1HG2      THR  99 -17.842  29.690   0.400
  720   2HG2  THR  99          2HG2      THR  99 -17.715  29.639  -1.353
  721   3HG2  THR  99          3HG2      THR  99 -18.725  28.469  -0.524
  722    H    ILE 100           H        ILE 100 -18.371  27.582  -3.242
  723    HA   ILE 100           HA       ILE 100 -16.736  29.327  -5.005
  724    HB   ILE 100           HB       ILE 100 -18.230  26.855  -5.989
  725   1HG1  ILE 100          2HG1      ILE 100 -15.236  27.403  -5.956
  726   2HG1  ILE 100          3HG1      ILE 100 -16.095  26.210  -4.971
  727   1HG2  ILE 100          1HG2      ILE 100 -17.327  27.509  -8.259
  728   2HG2  ILE 100          2HG2      ILE 100 -18.477  28.645  -7.586
  729   3HG2  ILE 100          3HG2      ILE 100 -16.740  29.029  -7.527
  730   1HD1  ILE 100          1HD1      ILE 100 -16.814  25.045  -7.028
  731   2HD1  ILE 100          2HD1      ILE 100 -15.674  26.074  -7.962
  732   3HD1  ILE 100          3HD1      ILE 100 -15.094  25.000  -6.678
  733    H    HIS 101           H        HIS 101 -17.957  31.022  -5.794
  734    HA   HIS 101           HA       HIS 101 -20.894  30.992  -5.386
  735   1HB   HIS 101          HB2       HIS 101 -19.243  33.203  -6.628
  736   2HB   HIS 101          HB3       HIS 101 -20.837  33.330  -5.903
  737    HD1  HIS 101           HD1      HIS 101 -17.192  33.553  -5.082
  738    HD2  HIS 101           HD2      HIS 101 -20.879  33.130  -3.102
  739    HE1  HIS 101           HE1      HIS 101 -16.754  34.085  -2.635
  740    H    LEU 102           H        LEU 102 -22.428  30.964  -7.093
  741    HA   LEU 102           HA       LEU 102 -21.416  31.240  -9.850
  742   1HB   LEU 102          HB2       LEU 102 -21.802  28.854  -9.550
  743   2HB   LEU 102          HB3       LEU 102 -23.381  29.159  -8.806
  744    HG   LEU 102           HG       LEU 102 -24.276  30.032 -10.928
  745   1HD1  LEU 102          1HD1      LEU 102 -21.560  29.315 -12.100
  746   2HD1  LEU 102          2HD1      LEU 102 -23.005  29.792 -13.020
  747   3HD1  LEU 102          3HD1      LEU 102 -22.239  30.952 -11.935
  748   1HD2  LEU 102          1HD2      LEU 102 -24.418  27.924 -12.087
  749   2HD2  LEU 102          2HD2      LEU 102 -22.944  27.336 -11.264
  750   3HD2  LEU 102          3HD2      LEU 102 -24.395  27.636 -10.349
  751    H    LYS 103           H        LYS 103 -22.026  33.257 -10.184
  752    HA   LYS 103           HA       LYS 103 -24.793  34.117  -9.536
  753   1HB   LYS 103          HB2       LYS 103 -22.537  35.614 -10.926
  754   2HB   LYS 103          HB3       LYS 103 -24.057  36.309 -10.326
  755   1HG   LYS 103          HG2       LYS 103 -21.771  35.179  -8.677
  756   2HG   LYS 103          HG3       LYS 103 -22.227  36.862  -8.815
  757   1HD   LYS 103          HD2       LYS 103 -23.824  34.605  -7.494
  758   2HD   LYS 103          HD3       LYS 103 -22.972  35.870  -6.641
  759   1HE   LYS 103          HE2       LYS 103 -25.373  36.311  -8.483
  760   2HE   LYS 103          HE3       LYS 103 -25.467  36.143  -6.749
  761   1HZ   LYS 103          HZ1       LYS 103 -23.993  38.314  -8.133
  762   2HZ   LYS 103          HZ2       LYS 103 -25.414  38.491  -7.371
  763   3HZ   LYS 103          HZ3       LYS 103 -24.085  38.129  -6.519
  764    H    VAL 104           H        VAL 104 -26.178  35.055 -11.163
  765    HA   VAL 104           HA       VAL 104 -25.680  34.252 -13.990
  766    HB   VAL 104           HB       VAL 104 -28.175  33.559 -12.378
  767   1HG1  VAL 104          1HG1      VAL 104 -27.590  33.193 -15.339
  768   2HG1  VAL 104          2HG1      VAL 104 -28.932  32.414 -14.498
  769   3HG1  VAL 104          3HG1      VAL 104 -28.875  34.180 -14.631
  770   1HG2  VAL 104          1HG2      VAL 104 -26.478  31.889 -11.950
  771   2HG2  VAL 104          2HG2      VAL 104 -27.657  31.195 -13.041
  772   3HG2  VAL 104          3HG2      VAL 104 -26.111  31.741 -13.680
  773    H    PHE 105           H        PHE 105 -26.306  35.858 -15.444
  774    HA   PHE 105           HA       PHE 105 -28.261  37.874 -14.541
  775   1HB   PHE 105          HB2       PHE 105 -27.047  39.408 -15.891
  776   2HB   PHE 105          HB3       PHE 105 -25.971  38.718 -14.686
  777    HD1  PHE 105           HD1      PHE 105 -24.352  36.838 -15.485
  778    HD2  PHE 105           HD2      PHE 105 -26.410  39.525 -18.169
  779    HE1  PHE 105           HE1      PHE 105 -22.683  36.344 -17.226
  780    HE2  PHE 105           HE2      PHE 105 -24.688  39.065 -19.909
  781    HZ   PHE 105           HZ       PHE 105 -22.830  37.472 -19.440
  782    H    ALA 106           H        ALA 106 -29.800  38.526 -15.973
  783    HA   ALA 106           HA       ALA 106 -30.342  36.780 -18.345
  784   1HB   ALA 106          HB1       ALA 106 -32.667  37.469 -18.029
  785   2HB   ALA 106          HB2       ALA 106 -31.985  36.768 -16.545
  786   3HB   ALA 106          HB3       ALA 106 -32.199  38.538 -16.692
  787    H    LYS 107           H        LYS 107 -28.392  38.476 -18.963
  788    HA   LYS 107           HA       LYS 107 -27.615  40.184 -20.221
  789   1HB   LYS 107          HB2       LYS 107 -30.281  39.848 -21.618
  790   2HB   LYS 107          HB3       LYS 107 -28.989  40.854 -22.255
  791   1HG   LYS 107          HG2       LYS 107 -28.644  37.891 -21.665
  792   2HG   LYS 107          HG3       LYS 107 -29.176  38.525 -23.206
  793   1HD   LYS 107          HD2       LYS 107 -26.485  39.152 -21.916
  794   2HD   LYS 107          HD3       LYS 107 -26.812  37.953 -23.184
  795   1HE   LYS 107          HE2       LYS 107 -27.685  39.785 -24.651
  796   2HE   LYS 107          HE3       LYS 107 -27.233  40.959 -23.417
  797   1HZ   LYS 107          HZ1       LYS 107 -24.889  40.277 -23.685
  798   2HZ   LYS 107          HZ2       LYS 107 -25.313  39.179 -24.830
  799   3HZ   LYS 107          HZ3       LYS 107 -25.505  40.759 -25.110
  Start of MODEL    8
    1   1H    GLY   1          H1        GLY   1   4.293  11.286   2.602
    2   2H    GLY   1          H2        GLY   1   5.776  10.645   2.867
    3   3H    GLY   1          H3        GLY   1   5.211  10.729   1.343
    4   1HA   GLY   1          HA2       GLY   1   5.046   8.475   2.162
    5   2HA   GLY   1          HA3       GLY   1   4.034   9.068   3.484
    6    H    LYS   2           H        LYS   2   3.480   7.141   1.243
    7    HA   LYS   2           HA       LYS   2   0.839   8.048   0.450
    8   1HB   LYS   2          HB2       LYS   2   2.556   9.097  -1.197
    9   2HB   LYS   2          HB3       LYS   2   2.854   7.463  -1.773
   10   1HG   LYS   2          HG2       LYS   2   0.425   7.280  -2.400
   11   2HG   LYS   2          HG3       LYS   2   0.170   8.937  -1.820
   12   1HD   LYS   2          HD2       LYS   2   1.821   9.729  -3.515
   13   2HD   LYS   2          HD3       LYS   2   2.113   8.049  -4.026
   14   1HE   LYS   2          HE2       LYS   2  -0.296   7.860  -4.657
   15   2HE   LYS   2          HE3       LYS   2  -0.561   9.509  -4.122
   16   1HZ   LYS   2          HZ1       LYS   2  -0.278   9.455  -6.498
   17   2HZ   LYS   2          HZ2       LYS   2   0.960  10.293  -5.828
   18   3HZ   LYS   2          HZ3       LYS   2   1.209   8.753  -6.349
   19    H    ASP   3           H        ASP   3  -0.339   6.345  -0.733
   20    HA   ASP   3           HA       ASP   3   0.208   3.785   0.433
   21   1HB   ASP   3          HB2       ASP   3  -1.938   3.205  -0.142
   22   2HB   ASP   3          HB3       ASP   3  -2.045   4.936   0.124
   23    H    ILE   4           H        ILE   4   1.633   4.958  -2.272
   24    HA   ILE   4           HA       ILE   4   1.206   2.903  -4.229
   25    HB   ILE   4           HB       ILE   4   3.432   4.925  -3.888
   26   1HG1  ILE   4          2HG1      ILE   4   1.184   5.920  -4.237
   27   2HG1  ILE   4          3HG1      ILE   4   2.315   6.217  -5.556
   28   1HG2  ILE   4          1HG2      ILE   4   2.826   3.061  -6.244
   29   2HG2  ILE   4          2HG2      ILE   4   3.870   4.518  -6.368
   30   3HG2  ILE   4          3HG2      ILE   4   4.330   3.192  -5.295
   31   1HD1  ILE   4          1HD1      ILE   4   0.041   4.176  -5.641
   32   2HD1  ILE   4          2HD1      ILE   4   0.056   5.790  -6.372
   33   3HD1  ILE   4          3HD1      ILE   4   1.145   4.547  -6.986
   34    H    GLN   5           H        GLN   5   3.552   3.125  -1.628
   35    HA   GLN   5           HA       GLN   5   4.203   0.288  -1.789
   36   1HB   GLN   5          HB2       GLN   5   6.584   0.537  -2.273
   37   2HB   GLN   5          HB3       GLN   5   5.637   1.189  -3.594
   38   1HG   GLN   5          HG2       GLN   5   5.995   3.511  -2.760
   39   2HG   GLN   5          HG3       GLN   5   6.907   2.875  -1.402
   40   1HE2  GLN   5          1HE2      GLN   5   9.912   2.675  -3.302
   41   2HE2  GLN   5          2HE2      GLN   5   9.166   2.441  -1.723
   42    H    VAL   6           H        VAL   6   3.212   2.139   0.136
   43    HA   VAL   6           HA       VAL   6   4.690   1.291   2.525
   44    HB   VAL   6           HB       VAL   6   4.079   4.268   2.341
   45   1HG1  VAL   6          1HG1      VAL   6   4.502   3.327   4.585
   46   2HG1  VAL   6          2HG1      VAL   6   6.040   2.631   4.025
   47   3HG1  VAL   6          3HG1      VAL   6   5.806   4.381   4.116
   48   1HG2  VAL   6          1HG2      VAL   6   6.458   4.774   1.921
   49   2HG2  VAL   6          2HG2      VAL   6   6.753   3.060   1.560
   50   3HG2  VAL   6          3HG2      VAL   6   5.680   4.017   0.505
   51    H    ILE   7           H        ILE   7   3.280   1.517   4.427
   52    HA   ILE   7           HA       ILE   7   0.384   1.723   3.781
   53    HB   ILE   7           HB       ILE   7   1.610   1.014   6.465
   54   1HG1  ILE   7          2HG1      ILE   7   0.676  -0.845   4.237
   55   2HG1  ILE   7          3HG1      ILE   7   2.327  -0.610   4.744
   56   1HG2  ILE   7          1HG2      ILE   7  -0.693   0.161   6.883
   57   2HG2  ILE   7          2HG2      ILE   7  -0.756   1.856   6.449
   58   3HG2  ILE   7          3HG2      ILE   7  -1.185   0.632   5.251
   59   1HD1  ILE   7          1HD1      ILE   7   0.161  -1.872   6.426
   60   2HD1  ILE   7          2HD1      ILE   7   1.584  -2.660   5.737
   61   3HD1  ILE   7          3HD1      ILE   7   1.795  -1.462   7.031
   62    H    VAL   8           H        VAL   8   0.296   3.885   3.240
   63    HA   VAL   8           HA       VAL   8  -0.040   5.732   5.504
   64    HB   VAL   8           HB       VAL   8   1.701   6.528   3.142
   65   1HG1  VAL   8          1HG1      VAL   8   2.038   8.606   4.502
   66   2HG1  VAL   8          2HG1      VAL   8   0.362   8.422   3.994
   67   3HG1  VAL   8          3HG1      VAL   8   0.810   8.025   5.670
   68   1HG2  VAL   8          1HG2      VAL   8   3.521   6.779   4.735
   69   2HG2  VAL   8          2HG2      VAL   8   2.505   6.118   6.049
   70   3HG2  VAL   8          3HG2      VAL   8   2.989   5.116   4.664
   71    H    ASN   9           H        ASN   9  -2.140   5.660   5.181
   72    HA   ASN   9           HA       ASN   9  -3.385   6.345   2.595
   73   1HB   ASN   9          HB2       ASN   9  -5.532   6.179   3.886
   74   2HB   ASN   9          HB3       ASN   9  -4.570   4.723   3.789
   75   1HD2  ASN   9          1HD2      ASN   9  -4.005   4.501   7.293
   76   2HD2  ASN   9          2HD2      ASN   9  -3.544   3.896   5.717
   77    H    VAL  10           H        VAL  10  -3.722   8.227   1.931
   78    HA   VAL  10           HA       VAL  10  -2.942  10.636   3.453
   79    HB   VAL  10           HB       VAL  10  -3.522  10.128   0.506
   80   1HG1  VAL  10          1HG1      VAL  10  -2.282  12.268   0.110
   81   2HG1  VAL  10          2HG1      VAL  10  -3.842  12.509   0.901
   82   3HG1  VAL  10          3HG1      VAL  10  -2.350  12.586   1.863
   83   1HG2  VAL  10          1HG2      VAL  10  -1.107  10.285   0.221
   84   2HG2  VAL  10          2HG2      VAL  10  -0.869  10.487   1.958
   85   3HG2  VAL  10          3HG2      VAL  10  -1.491   8.974   1.320
   86    HA   PRO  11           HA       PRO  11  -7.294  11.831   4.031
   87   1HB   PRO  11          HB2       PRO  11  -5.997  14.571   4.279
   88   2HB   PRO  11          HB3       PRO  11  -7.293  13.811   5.266
   89   1HG   PRO  11          HG2       PRO  11  -4.731  13.812   6.185
   90   2HG   PRO  11          HG3       PRO  11  -5.731  12.332   6.324
   91   1HD   PRO  11          HD2       PRO  11  -3.640  12.997   4.212
   92   2HD   PRO  11          HD3       PRO  11  -3.871  11.491   5.164
   93    HA   PRO  12           HA       PRO  12  -8.535  13.705   0.207
   94   1HB   PRO  12          HB2       PRO  12 -10.666  15.307   1.563
   95   2HB   PRO  12          HB3       PRO  12 -10.806  14.074   0.259
   96   1HG   PRO  12          HG2       PRO  12 -11.525  13.517   2.818
   97   2HG   PRO  12          HG3       PRO  12 -10.709  12.307   1.802
   98   1HD   PRO  12          HD2       PRO  12  -9.461  14.162   3.876
   99   2HD   PRO  12          HD3       PRO  12  -9.272  12.382   3.693
  100    H    SER  13           H        SER  13  -8.387  15.594  -0.980
  101    HA   SER  13           HA       SER  13  -7.474  18.135   0.316
  102   1HB   SER  13          HB2       SER  13  -6.176  16.659  -1.991
  103   2HB   SER  13          HB3       SER  13  -5.758  18.308  -1.455
  104    HG   SER  13           HG       SER  13  -4.381  16.717  -0.538
  105    H    VAL  14           H        VAL  14 -10.117  18.040  -0.378
  106    HA   VAL  14           HA       VAL  14 -10.517  18.788  -3.119
  107    HB   VAL  14           HB       VAL  14 -12.239  17.685  -1.761
  108   1HG1  VAL  14          1HG1      VAL  14 -12.110  19.208   0.269
  109   2HG1  VAL  14          2HG1      VAL  14 -12.948  20.453  -0.687
  110   3HG1  VAL  14          3HG1      VAL  14 -13.732  18.887  -0.352
  111   1HG2  VAL  14          1HG2      VAL  14 -14.150  18.853  -2.777
  112   2HG2  VAL  14          2HG2      VAL  14 -13.174  20.278  -3.082
  113   3HG2  VAL  14          3HG2      VAL  14 -12.811  18.739  -3.911
  114    H    ARG  15           H        ARG  15 -10.612  20.650  -4.095
  115    HA   ARG  15           HA       ARG  15 -10.218  23.233  -2.587
  116   1HB   ARG  15          HB2       ARG  15  -8.421  21.841  -4.605
  117   2HB   ARG  15          HB3       ARG  15  -8.432  23.619  -4.537
  118   1HG   ARG  15          HG2       ARG  15  -7.632  23.732  -2.364
  119   2HG   ARG  15          HG3       ARG  15  -8.028  22.036  -1.972
  120   1HD   ARG  15          HD2       ARG  15  -5.975  22.864  -4.062
  121   2HD   ARG  15          HD3       ARG  15  -5.590  22.489  -2.353
  122    HE   ARG  15           HE       ARG  15  -7.031  20.280  -3.231
  123   1HH1  ARG  15          1HH1      ARG  15  -6.368  18.479  -4.101
  124   2HH1  ARG  15          2HH1      ARG  15  -4.779  18.355  -4.813
  125   1HH2  ARG  15          1HH2      ARG  15  -3.973  21.658  -4.228
  126   2HH2  ARG  15          2HH2      ARG  15  -3.413  20.133  -4.851
  127    H    ALA  16           H        ALA  16 -10.880  25.067  -3.630
  128    HA   ALA  16           HA       ALA  16 -12.892  24.706  -5.757
  129   1HB   ALA  16          HB1       ALA  16 -12.040  27.161  -4.197
  130   2HB   ALA  16          HB2       ALA  16 -13.403  27.057  -5.341
  131   3HB   ALA  16          HB3       ALA  16 -13.437  26.120  -3.851
  132    H    ARG  17           H        ARG  17 -12.108  24.437  -7.722
  133    HA   ARG  17           HA       ARG  17  -9.585  25.536  -8.626
  134   1HB   ARG  17          HB2       ARG  17 -10.776  23.343  -9.392
  135   2HB   ARG  17          HB3       ARG  17 -11.699  24.386 -10.489
  136   1HG   ARG  17          HG2       ARG  17  -9.485  25.273 -11.405
  137   2HG   ARG  17          HG3       ARG  17  -8.673  24.166 -10.301
  138   1HD   ARG  17          HD2       ARG  17  -8.630  23.147 -12.451
  139   2HD   ARG  17          HD3       ARG  17  -9.728  22.238 -11.453
  140    HE   ARG  17           HE       ARG  17 -11.294  22.595 -13.120
  141   1HH1  ARG  17          1HH1      ARG  17  -9.091  25.323 -13.361
  142   2HH1  ARG  17          2HH1      ARG  17  -9.926  25.957 -14.746
  143   1HH2  ARG  17          1HH2      ARG  17 -12.238  23.429 -14.898
  144   2HH2  ARG  17          2HH2      ARG  17 -11.573  24.875 -15.654
  145    H    GLN  18           H        GLN  18 -12.912  26.432  -9.058
  146    HA   GLN  18           HA       GLN  18 -12.155  29.055 -10.323
  147   1HB   GLN  18          HB2       GLN  18 -14.804  27.565 -10.132
  148   2HB   GLN  18          HB3       GLN  18 -14.660  29.192 -10.735
  149   1HG   GLN  18          HG2       GLN  18 -13.271  26.788 -11.984
  150   2HG   GLN  18          HG3       GLN  18 -14.797  27.460 -12.528
  151   1HE2  GLN  18          1HE2      GLN  18 -12.494  28.963 -14.869
  152   2HE2  GLN  18          2HE2      GLN  18 -13.273  27.422 -14.568
  153    H    SER  19           H        SER  19 -14.073  30.703  -9.387
  154    HA   SER  19           HA       SER  19 -14.335  30.425  -6.445
  155   1HB   SER  19          HB2       SER  19 -13.336  32.596  -5.955
  156   2HB   SER  19          HB3       SER  19 -12.141  31.463  -6.644
  157    HG   SER  19           HG       SER  19 -12.028  33.573  -7.583
  158    H    THR  20           H        THR  20 -15.084  32.524  -9.229
  159    HA   THR  20           HA       THR  20 -17.891  32.655  -8.347
  160    HB   THR  20           HB       THR  20 -16.313  35.219  -8.697
  161    HG1  THR  20           HG1      THR  20 -16.678  33.760  -6.582
  162   1HG2  THR  20          1HG2      THR  20 -18.499  36.271  -8.011
  163   2HG2  THR  20          2HG2      THR  20 -18.549  35.528  -9.604
  164   3HG2  THR  20          3HG2      THR  20 -19.278  34.678  -8.211
  165    H    MET  21           H        MET  21 -18.822  31.907 -10.030
  166    HA   MET  21           HA       MET  21 -17.939  32.459 -12.809
  167   1HB   MET  21          HB2       MET  21 -19.976  30.545 -11.590
  168   2HB   MET  21          HB3       MET  21 -19.545  30.617 -13.306
  169   1HG   MET  21          HG2       MET  21 -17.705  29.890 -10.996
  170   2HG   MET  21          HG3       MET  21 -18.456  28.783 -12.100
  171   1HE   MET  21          HE1       MET  21 -16.546  29.330 -15.459
  172   2HE   MET  21          HE2       MET  21 -17.932  28.585 -14.624
  173   3HE   MET  21          HE3       MET  21 -17.971  30.307 -15.074
  174    H    ASN  22           H        ASN  22 -19.647  32.838 -14.450
  175    HA   ASN  22           HA       ASN  22 -22.132  34.122 -13.517
  176   1HB   ASN  22          HB2       ASN  22 -20.063  35.520 -15.271
  177   2HB   ASN  22          HB3       ASN  22 -21.733  36.042 -15.136
  178   1HD2  ASN  22          1HD2      ASN  22 -21.321  37.269 -11.755
  179   2HD2  ASN  22          2HD2      ASN  22 -22.462  36.271 -12.661
  180    H    ALA  23           H        ALA  23 -23.702  34.500 -15.229
  181    HA   ALA  23           HA       ALA  23 -23.321  33.424 -17.875
  182   1HB   ALA  23          HB1       ALA  23 -25.063  31.661 -17.667
  183   2HB   ALA  23          HB2       ALA  23 -23.632  31.276 -16.657
  184   3HB   ALA  23          HB3       ALA  23 -25.107  31.919 -15.909
  185    H    THR  24           H        THR  24 -25.017  33.867 -19.294
  186    HA   THR  24           HA       THR  24 -27.056  35.856 -18.411
  187    HB   THR  24           HB       THR  24 -26.357  35.095 -21.258
  188    HG1  THR  24           HG1      THR  24 -25.024  36.841 -21.296
  189   1HG2  THR  24          1HG2      THR  24 -27.641  37.586 -20.008
  190   2HG2  THR  24          2HG2      THR  24 -27.292  37.352 -21.725
  191   3HG2  THR  24          3HG2      THR  24 -28.515  36.336 -20.944
  192    H    ALA  25           H        ALA  25 -28.663  34.636 -17.507
  193    HA   ALA  25           HA       ALA  25 -29.496  32.067 -18.175
  194   1HB   ALA  25          HB1       ALA  25 -31.670  32.857 -17.049
  195   2HB   ALA  25          HB2       ALA  25 -30.153  33.058 -16.153
  196   3HB   ALA  25          HB3       ALA  25 -30.917  34.452 -16.956
  197    H    ASN  26           H        ASN  26 -31.052  31.098 -19.293
  198    HA   ASN  26           HA       ASN  26 -32.737  30.631 -20.672
  199   1HB   ASN  26          HB2       ASN  26 -33.677  32.727 -19.477
  200   2HB   ASN  26          HB3       ASN  26 -33.448  33.544 -21.034
  201   1HD2  ASN  26          1HD2      ASN  26 -36.326  30.632 -20.633
  202   2HD2  ASN  26          2HD2      ASN  26 -34.950  30.684 -19.525
  203    H    LEU  27           H        LEU  27 -29.973  31.957 -21.755
  204    HA   LEU  27           HA       LEU  27 -30.690  32.142 -24.616
  205   1HB   LEU  27          HB2       LEU  27 -27.980  32.216 -23.229
  206   2HB   LEU  27          HB3       LEU  27 -28.277  32.511 -24.932
  207    HG   LEU  27           HG       LEU  27 -29.185  34.261 -22.612
  208   1HD1  LEU  27          1HD1      LEU  27 -27.696  35.899 -23.639
  209   2HD1  LEU  27          2HD1      LEU  27 -26.772  34.401 -23.421
  210   3HD1  LEU  27          3HD1      LEU  27 -27.389  34.817 -25.022
  211   1HD2  LEU  27          1HD2      LEU  27 -29.768  34.653 -25.583
  212   2HD2  LEU  27          2HD2      LEU  27 -30.947  34.316 -24.288
  213   3HD2  LEU  27          3HD2      LEU  27 -30.030  35.844 -24.298
  214    H    SER  28           H        SER  28 -30.307  29.538 -22.583
  215    HA   SER  28           HA       SER  28 -30.173  27.320 -22.888
  216   1HB   SER  28          HB2       SER  28 -30.570  27.894 -25.851
  217   2HB   SER  28          HB3       SER  28 -30.820  26.348 -25.023
  218    HG   SER  28           HG       SER  28 -32.218  28.794 -24.536
  219    H    GLN  29           H        GLN  29 -27.688  28.870 -22.972
  220    HA   GLN  29           HA       GLN  29 -25.806  27.323 -24.622
  221   1HB   GLN  29          HB2       GLN  29 -24.167  28.791 -23.863
  222   2HB   GLN  29          HB3       GLN  29 -25.581  29.779 -24.175
  223   1HG   GLN  29          HG2       GLN  29 -24.857  28.848 -21.329
  224   2HG   GLN  29          HG3       GLN  29 -24.097  30.227 -22.084
  225   1HE2  GLN  29          1HE2      GLN  29 -26.698  32.312 -20.944
  226   2HE2  GLN  29          2HE2      GLN  29 -24.981  32.128 -21.327
  227    H    SER  30           H        SER  30 -23.679  26.660 -23.299
  228    HA   SER  30           HA       SER  30 -24.426  25.216 -20.826
  229   1HB   SER  30          HB2       SER  30 -22.777  23.460 -21.418
  230   2HB   SER  30          HB3       SER  30 -24.099  23.548 -22.600
  231    HG   SER  30           HG       SER  30 -22.118  23.410 -23.670
  232    H    VAL  31           H        VAL  31 -22.876  25.038 -19.298
  233    HA   VAL  31           HA       VAL  31 -20.572  26.953 -19.351
  234    HB   VAL  31           HB       VAL  31 -22.823  26.822 -17.288
  235   1HG1  VAL  31          1HG1      VAL  31 -20.841  27.103 -15.998
  236   2HG1  VAL  31          2HG1      VAL  31 -20.168  28.316 -17.106
  237   3HG1  VAL  31          3HG1      VAL  31 -21.618  28.664 -16.114
  238   1HG2  VAL  31          1HG2      VAL  31 -21.815  29.066 -19.085
  239   2HG2  VAL  31          2HG2      VAL  31 -23.378  28.219 -19.207
  240   3HG2  VAL  31          3HG2      VAL  31 -23.055  29.244 -17.816
  241    H    THR  32           H        THR  32 -18.724  26.190 -18.287
  242    HA   THR  32           HA       THR  32 -19.046  23.728 -16.592
  243    HB   THR  32           HB       THR  32 -16.521  24.583 -18.053
  244    HG1  THR  32           HG1      THR  32 -18.091  23.972 -19.556
  245   1HG2  THR  32          1HG2      THR  32 -15.908  22.155 -17.635
  246   2HG2  THR  32          2HG2      THR  32 -16.037  23.071 -16.144
  247   3HG2  THR  32          3HG2      THR  32 -17.342  21.992 -16.611
  248    H    LEU  33           H        LEU  33 -18.035  23.659 -14.632
  249    HA   LEU  33           HA       LEU  33 -16.290  25.777 -13.601
  250   1HB   LEU  33          HB2       LEU  33 -17.710  26.403 -11.777
  251   2HB   LEU  33          HB3       LEU  33 -18.495  26.794 -13.272
  252    HG   LEU  33           HG       LEU  33 -19.203  24.160 -11.930
  253   1HD1  LEU  33          1HD1      LEU  33 -19.254  25.763 -10.112
  254   2HD1  LEU  33          2HD1      LEU  33 -20.279  26.855 -11.081
  255   3HD1  LEU  33          3HD1      LEU  33 -20.882  25.265 -10.584
  256   1HD2  LEU  33          1HD2      LEU  33 -20.868  26.229 -13.470
  257   2HD2  LEU  33          2HD2      LEU  33 -20.264  24.703 -14.121
  258   3HD2  LEU  33          3HD2      LEU  33 -21.450  24.694 -12.804
  259    H    ALA  34           H        ALA  34 -15.648  25.172 -11.201
  260    HA   ALA  34           HA       ALA  34 -15.873  22.313 -10.698
  261   1HB   ALA  34          HB1       ALA  34 -13.445  21.891 -11.184
  262   2HB   ALA  34          HB2       ALA  34 -14.429  22.320 -12.613
  263   3HB   ALA  34          HB3       ALA  34 -13.353  23.505 -11.888
  264    H    CYS  35           H        CYS  35 -15.134  21.488  -8.957
  265    HA   CYS  35           HA       CYS  35 -13.256  22.832  -7.130
  266   1HB   CYS  35          HB2       CYS  35 -15.587  23.313  -6.220
  267   2HB   CYS  35          HB3       CYS  35 -15.869  21.573  -6.166
  268    H    ASP  36           H        ASP  36 -11.578  21.388  -7.342
  269    HA   ASP  36           HA       ASP  36 -12.201  18.603  -8.056
  270   1HB   ASP  36          HB2       ASP  36  -9.973  18.426  -8.816
  271   2HB   ASP  36          HB3       ASP  36 -10.613  19.955  -9.400
  272    H    ALA  37           H        ALA  37 -11.945  16.834  -6.875
  273    HA   ALA  37           HA       ALA  37 -10.673  17.087  -4.198
  274   1HB   ALA  37          HB1       ALA  37 -11.996  15.093  -3.631
  275   2HB   ALA  37          HB2       ALA  37 -13.077  16.358  -4.240
  276   3HB   ALA  37          HB3       ALA  37 -12.634  15.018  -5.282
  277    H    ASP  38           H        ASP  38  -9.313  15.435  -3.469
  278    HA   ASP  38           HA       ASP  38  -8.165  13.444  -5.271
  279   1HB   ASP  38          HB2       ASP  38  -7.059  15.575  -5.955
  280   2HB   ASP  38          HB3       ASP  38  -6.600  15.866  -4.283
  281    H    GLY  39           H        GLY  39  -6.500  12.110  -4.048
  282   1HA   GLY  39          HA2       GLY  39  -5.790  12.104  -1.392
  283   2HA   GLY  39          HA3       GLY  39  -7.444  11.456  -1.378
  284    H    PHE  40           H        PHE  40  -5.444   9.804  -0.522
  285    HA   PHE  40           HA       PHE  40  -5.287   7.702  -2.602
  286   1HB   PHE  40          HB2       PHE  40  -2.804   8.741  -1.253
  287   2HB   PHE  40          HB3       PHE  40  -2.933   7.323  -2.272
  288    HD1  PHE  40           HD1      PHE  40  -2.652  10.961  -2.190
  289    HD2  PHE  40           HD2      PHE  40  -3.533   7.585  -4.725
  290    HE1  PHE  40           HE1      PHE  40  -2.306  12.390  -4.190
  291    HE2  PHE  40           HE2      PHE  40  -3.200   9.025  -6.743
  292    HZ   PHE  40           HZ       PHE  40  -2.608  11.432  -6.464
  293    HA   PRO  41           HA       PRO  41  -6.354   5.696  -2.490
  294   1HB   PRO  41          HB2       PRO  41  -8.605   5.074  -0.588
  295   2HB   PRO  41          HB3       PRO  41  -8.020   4.125  -1.999
  296   1HG   PRO  41          HG2       PRO  41  -7.291   3.403   0.509
  297   2HG   PRO  41          HG3       PRO  41  -6.066   3.460  -0.778
  298   1HD   PRO  41          HD2       PRO  41  -6.655   5.566   1.333
  299   2HD   PRO  41          HD3       PRO  41  -5.092   4.888   0.832
  300    H    GLU  42           H        GLU  42  -7.975   6.442  -3.811
  301    HA   GLU  42           HA       GLU  42  -8.592   9.095  -3.774
  302   1HB   GLU  42          HB2       GLU  42 -10.104   8.692  -5.655
  303   2HB   GLU  42          HB3       GLU  42  -8.600   7.767  -5.774
  304   1HG   GLU  42          HG2       GLU  42  -9.879   5.746  -4.945
  305   2HG   GLU  42          HG3       GLU  42 -11.356   6.712  -4.969
  306    HA   PRO  43           HA       PRO  43 -11.913   9.508  -0.978
  307   1HB   PRO  43          HB2       PRO  43 -12.461  12.144  -1.128
  308   2HB   PRO  43          HB3       PRO  43 -10.798  11.592  -0.729
  309   1HG   PRO  43          HG2       PRO  43 -11.886  12.395  -3.435
  310   2HG   PRO  43          HG3       PRO  43 -10.438  13.030  -2.601
  311   1HD   PRO  43          HD2       PRO  43 -10.348  10.961  -4.451
  312   2HD   PRO  43          HD3       PRO  43  -9.235  11.029  -3.045
  313    H    THR  44           H        THR  44 -14.064  10.227  -0.605
  314    HA   THR  44           HA       THR  44 -15.967  10.047  -2.954
  315    HB   THR  44           HB       THR  44 -16.447   9.690   0.054
  316    HG1  THR  44           HG1      THR  44 -15.382   7.946  -0.943
  317   1HG2  THR  44          1HG2      THR  44 -18.482  10.584  -1.060
  318   2HG2  THR  44          2HG2      THR  44 -18.359   9.297  -2.281
  319   3HG2  THR  44          3HG2      THR  44 -18.677   8.880  -0.564
  320    H    MET  45           H        MET  45 -17.024  11.960  -3.521
  321    HA   MET  45           HA       MET  45 -16.882  14.246  -1.632
  322   1HB   MET  45          HB2       MET  45 -15.816  15.646  -3.156
  323   2HB   MET  45          HB3       MET  45 -14.898  14.149  -3.150
  324   1HG   MET  45          HG2       MET  45 -14.982  14.553  -5.404
  325   2HG   MET  45          HG3       MET  45 -16.402  13.536  -5.246
  326   1HE   MET  45          HE1       MET  45 -14.893  16.904  -6.257
  327   2HE   MET  45          HE2       MET  45 -16.228  18.055  -6.140
  328   3HE   MET  45          HE3       MET  45 -15.494  17.371  -4.656
  329    H    THR  46           H        THR  46 -18.217  16.028  -2.059
  330    HA   THR  46           HA       THR  46 -20.421  15.836  -4.011
  331    HB   THR  46           HB       THR  46 -22.155  16.149  -2.217
  332    HG1  THR  46           HG1      THR  46 -20.173  15.123  -0.457
  333   1HG2  THR  46          1HG2      THR  46 -20.818  13.437  -1.935
  334   2HG2  THR  46          2HG2      THR  46 -22.487  13.895  -1.579
  335   3HG2  THR  46          3HG2      THR  46 -21.891  13.931  -3.240
  336    H    TRP  47           H        TRP  47 -21.882  17.738  -3.830
  337    HA   TRP  47           HA       TRP  47 -21.006  19.971  -2.237
  338   1HB   TRP  47          HB2       TRP  47 -20.662  21.516  -4.218
  339   2HB   TRP  47          HB3       TRP  47 -19.388  20.458  -3.735
  340    HD1  TRP  47           HD1      TRP  47 -18.971  18.179  -5.236
  341    HE1  TRP  47           HE1      TRP  47 -18.218  18.374  -7.655
  342    HE3  TRP  47           HE3      TRP  47 -21.215  22.637  -6.379
  343    HZ2  TRP  47           HZ2      TRP  47 -18.308  20.360  -9.736
  344    HZ3  TRP  47           HZ3      TRP  47 -20.802  23.686  -8.601
  345    HH2  TRP  47           HH2      TRP  47 -19.341  22.599 -10.243
  346    H    THR  48           H        THR  48 -22.372  21.886  -2.435
  347    HA   THR  48           HA       THR  48 -25.182  21.062  -3.027
  348    HB   THR  48           HB       THR  48 -25.870  22.298  -1.083
  349    HG1  THR  48           HG1      THR  48 -24.318  23.218   0.269
  350   1HG2  THR  48          1HG2      THR  48 -23.452  20.631  -0.274
  351   2HG2  THR  48          2HG2      THR  48 -24.860  20.991   0.718
  352   3HG2  THR  48          3HG2      THR  48 -25.059  19.948  -0.697
  353    H    LYS  49           H        LYS  49 -26.716  22.634  -3.487
  354    HA   LYS  49           HA       LYS  49 -25.709  24.909  -5.091
  355   1HB   LYS  49          HB2       LYS  49 -27.163  22.917  -5.971
  356   2HB   LYS  49          HB3       LYS  49 -28.502  23.725  -5.205
  357   1HG   LYS  49          HG2       LYS  49 -28.093  25.727  -6.596
  358   2HG   LYS  49          HG3       LYS  49 -26.598  25.025  -7.231
  359   1HD   LYS  49          HD2       LYS  49 -27.916  23.148  -8.221
  360   2HD   LYS  49          HD3       LYS  49 -29.410  23.976  -7.687
  361   1HE   LYS  49          HE2       LYS  49 -28.836  25.949  -9.040
  362   2HE   LYS  49          HE3       LYS  49 -27.347  25.172  -9.572
  363   1HZ   LYS  49          HZ1       LYS  49 -30.054  24.138 -10.139
  364   2HZ   LYS  49          HZ2       LYS  49 -29.059  24.835 -11.239
  365   3HZ   LYS  49          HZ3       LYS  49 -28.670  23.406 -10.570
  366    H    ASP  50           H        ASP  50 -25.379  25.746  -2.771
  367    HA   ASP  50           HA       ASP  50 -25.723  27.386  -1.263
  368   1HB   ASP  50          HB2       ASP  50 -26.958  28.632  -3.046
  369   2HB   ASP  50          HB3       ASP  50 -28.457  27.942  -2.488
  370    H    GLY  51           H        GLY  51 -27.503  24.557  -1.428
  371   1HA   GLY  51          HA2       GLY  51 -27.578  24.203   1.379
  372   2HA   GLY  51          HA3       GLY  51 -29.178  24.740   0.914
  373    H    GLU  52           H        GLU  52 -29.177  23.311  -1.703
  374    HA   GLU  52           HA       GLU  52 -29.828  20.607  -0.690
  375   1HB   GLU  52          HB2       GLU  52 -31.178  20.364  -2.666
  376   2HB   GLU  52          HB3       GLU  52 -31.600  21.812  -1.777
  377   1HG   GLU  52          HG2       GLU  52 -30.231  23.162  -3.405
  378   2HG   GLU  52          HG3       GLU  52 -29.960  21.678  -4.325
  379    HA   PRO  53           HA       PRO  53 -26.257  18.982  -2.555
  380   1HB   PRO  53          HB2       PRO  53 -26.776  16.316  -2.898
  381   2HB   PRO  53          HB3       PRO  53 -26.707  17.091  -1.285
  382   1HG   PRO  53          HG2       PRO  53 -29.167  16.489  -2.968
  383   2HG   PRO  53          HG3       PRO  53 -28.895  16.092  -1.253
  384   1HD   PRO  53          HD2       PRO  53 -30.252  18.328  -1.990
  385   2HD   PRO  53          HD3       PRO  53 -29.158  18.336  -0.567
  386    H    ILE  54           H        ILE  54 -25.163  18.553  -4.368
  387    HA   ILE  54           HA       ILE  54 -26.558  18.168  -6.962
  388    HB   ILE  54           HB       ILE  54 -23.792  19.348  -6.514
  389   1HG1  ILE  54          2HG1      ILE  54 -26.199  21.109  -7.107
  390   2HG1  ILE  54          3HG1      ILE  54 -25.749  20.780  -5.437
  391   1HG2  ILE  54          1HG2      ILE  54 -24.121  20.405  -8.761
  392   2HG2  ILE  54          2HG2      ILE  54 -24.234  18.650  -8.888
  393   3HG2  ILE  54          3HG2      ILE  54 -25.707  19.617  -8.893
  394   1HD1  ILE  54          1HD1      ILE  54 -23.569  21.715  -5.706
  395   2HD1  ILE  54          2HD1      ILE  54 -23.823  21.994  -7.440
  396   3HD1  ILE  54          3HD1      ILE  54 -24.776  22.884  -6.250
  397    H    GLU  55           H        GLU  55 -26.071  16.016  -5.223
  398    HA   GLU  55           HA       GLU  55 -23.518  14.779  -5.901
  399   1HB   GLU  55          HB2       GLU  55 -24.126  12.981  -4.439
  400   2HB   GLU  55          HB3       GLU  55 -24.369  14.547  -3.665
  401   1HG   GLU  55          HG2       GLU  55 -26.803  14.326  -4.019
  402   2HG   GLU  55          HG3       GLU  55 -26.544  12.728  -4.758
  403    H    GLN  56           H        GLN  56 -23.098  13.779  -7.720
  404    HA   GLN  56           HA       GLN  56 -25.053  13.348  -9.686
  405   1HB   GLN  56          HB2       GLN  56 -22.115  12.753  -9.463
  406   2HB   GLN  56          HB3       GLN  56 -22.990  12.396 -10.943
  407   1HG   GLN  56          HG2       GLN  56 -23.508  15.138  -9.887
  408   2HG   GLN  56          HG3       GLN  56 -21.833  14.838 -10.299
  409   1HE2  GLN  56          1HE2      GLN  56 -24.609  15.105 -13.311
  410   2HE2  GLN  56          2HE2      GLN  56 -25.140  15.056 -11.624
  411    H    GLU  57           H        GLU  57 -24.669  11.297  -7.173
  412    HA   GLU  57           HA       GLU  57 -25.163   8.734  -8.564
  413   1HB   GLU  57          HB2       GLU  57 -25.348   9.551  -5.648
  414   2HB   GLU  57          HB3       GLU  57 -25.593   7.924  -6.224
  415   1HG   GLU  57          HG2       GLU  57 -22.995   9.505  -6.479
  416   2HG   GLU  57          HG3       GLU  57 -23.344   8.258  -5.294
  417    H    ASP  58           H        ASP  58 -26.966  11.497  -7.685
  418    HA   ASP  58           HA       ASP  58 -29.559  10.193  -8.359
  419   1HB   ASP  58          HB2       ASP  58 -29.102   9.937  -5.891
  420   2HB   ASP  58          HB3       ASP  58 -29.052  11.708  -5.772
  421    H    ASN  59           H        ASN  59 -27.540  12.829  -8.809
  422    HA   ASN  59           HA       ASN  59 -29.765  14.679  -9.539
  423   1HB   ASN  59          HB2       ASN  59 -27.284  15.468  -7.997
  424   2HB   ASN  59          HB3       ASN  59 -28.515  16.571  -8.557
  425   1HD2  ASN  59          1HD2      ASN  59 -29.120  14.394  -5.182
  426   2HD2  ASN  59          2HD2      ASN  59 -27.725  14.092  -6.224
  427    H    GLU  60           H        GLU  60 -29.605  14.692 -11.655
  428    HA   GLU  60           HA       GLU  60 -27.127  15.410 -13.112
  429   1HB   GLU  60          HB2       GLU  60 -27.720  12.846 -12.671
  430   2HB   GLU  60          HB3       GLU  60 -28.996  13.132 -13.851
  431   1HG   GLU  60          HG2       GLU  60 -27.161  13.869 -15.449
  432   2HG   GLU  60          HG3       GLU  60 -25.994  13.440 -14.211
  433    H    GLU  61           H        GLU  61 -29.993  16.453 -12.472
  434    HA   GLU  61           HA       GLU  61 -31.896  16.473 -14.336
  435   1HB   GLU  61          HB2       GLU  61 -30.907  18.971 -12.928
  436   2HB   GLU  61          HB3       GLU  61 -32.530  18.742 -13.594
  437   1HG   GLU  61          HG2       GLU  61 -31.301  17.187 -11.277
  438   2HG   GLU  61          HG3       GLU  61 -32.513  18.457 -11.177
  439    H    LYS  62           H        LYS  62 -29.028  18.500 -14.734
  440    HA   LYS  62           HA       LYS  62 -29.199  18.387 -17.611
  441   1HB   LYS  62          HB2       LYS  62 -29.349  20.803 -18.048
  442   2HB   LYS  62          HB3       LYS  62 -30.803  20.219 -17.292
  443   1HG   LYS  62          HG2       LYS  62 -29.807  21.068 -15.055
  444   2HG   LYS  62          HG3       LYS  62 -28.604  21.909 -16.049
  445   1HD   LYS  62          HD2       LYS  62 -30.604  22.934 -17.321
  446   2HD   LYS  62          HD3       LYS  62 -31.587  22.334 -15.965
  447   1HE   LYS  62          HE2       LYS  62 -30.187  23.577 -14.377
  448   2HE   LYS  62          HE3       LYS  62 -29.093  24.077 -15.671
  449   1HZ   LYS  62          HZ1       LYS  62 -31.924  24.930 -15.352
  450   2HZ   LYS  62          HZ2       LYS  62 -30.545  25.832 -15.184
  451   3HZ   LYS  62          HZ3       LYS  62 -30.967  25.291 -16.674
  452    H    TYR  63           H        TYR  63 -27.329  17.334 -15.947
  453    HA   TYR  63           HA       TYR  63 -24.907  18.733 -16.630
  454   1HB   TYR  63          HB2       TYR  63 -24.238  19.238 -14.216
  455   2HB   TYR  63          HB3       TYR  63 -25.341  20.304 -14.998
  456    HD1  TYR  63           HD1      TYR  63 -27.489  20.805 -14.159
  457    HD2  TYR  63           HD2      TYR  63 -25.174  17.592 -12.469
  458    HE1  TYR  63           HE1      TYR  63 -29.086  20.654 -12.268
  459    HE2  TYR  63           HE2      TYR  63 -26.746  17.487 -10.535
  460    HH   TYR  63           HH       TYR  63 -28.633  18.405  -9.541
  461    H    SER  64           H        SER  64 -22.992  17.865 -16.183
  462    HA   SER  64           HA       SER  64 -22.810  15.105 -15.084
  463   1HB   SER  64          HB2       SER  64 -22.012  15.823 -17.923
  464   2HB   SER  64          HB3       SER  64 -21.851  14.241 -17.161
  465    HG   SER  64           HG       SER  64 -24.182  14.183 -16.988
  466    H    PHE  65           H        PHE  65 -20.728  14.682 -14.258
  467    HA   PHE  65           HA       PHE  65 -18.452  16.327 -15.147
  468   1HB   PHE  65          HB2       PHE  65 -17.943  16.818 -12.987
  469   2HB   PHE  65          HB3       PHE  65 -19.672  17.038 -13.112
  470    HD1  PHE  65           HD1      PHE  65 -19.465  13.539 -12.558
  471    HD2  PHE  65           HD2      PHE  65 -18.757  17.329 -10.594
  472    HE1  PHE  65           HE1      PHE  65 -19.547  12.424 -10.349
  473    HE2  PHE  65           HE2      PHE  65 -18.961  16.206  -8.390
  474    HZ   PHE  65           HZ       PHE  65 -19.290  13.741  -8.277
  475    H    ASN  66           H        ASN  66 -16.434  15.447 -13.720
  476    HA   ASN  66           HA       ASN  66 -15.828  12.868 -15.089
  477   1HB   ASN  66          HB2       ASN  66 -13.556  13.683 -15.158
  478   2HB   ASN  66          HB3       ASN  66 -14.633  14.952 -15.735
  479   1HD2  ASN  66          1HD2      ASN  66 -12.417  16.771 -13.526
  480   2HD2  ASN  66          2HD2      ASN  66 -12.465  16.139 -15.186
  481    H    TYR  67           H        TYR  67 -13.619  11.976 -13.936
  482    HA   TYR  67           HA       TYR  67 -14.614  10.547 -11.627
  483   1HB   TYR  67          HB2       TYR  67 -11.851  10.462 -12.914
  484   2HB   TYR  67          HB3       TYR  67 -12.605   9.245 -11.905
  485    HD1  TYR  67           HD1      TYR  67 -14.937   8.283 -12.797
  486    HD2  TYR  67           HD2      TYR  67 -11.997  10.247 -15.276
  487    HE1  TYR  67           HE1      TYR  67 -15.951   7.271 -14.827
  488    HE2  TYR  67           HE2      TYR  67 -12.952   9.146 -17.292
  489    HH   TYR  67           HH       TYR  67 -14.584   7.744 -18.104
  490    H    ASP  68           H        ASP  68 -12.634  13.423 -11.862
  491    HA   ASP  68           HA       ASP  68 -11.557  13.232  -9.100
  492   1HB   ASP  68          HB2       ASP  68 -11.522  15.458 -11.178
  493   2HB   ASP  68          HB3       ASP  68 -10.642  15.475  -9.649
  494    H    GLY  69           H        GLY  69 -14.521  13.923 -10.512
  495   1HA   GLY  69          HA2       GLY  69 -16.458  14.905  -9.812
  496   2HA   GLY  69          HA3       GLY  69 -15.754  15.080  -8.198
  497    H    SER  70           H        SER  70 -14.078  16.529 -10.945
  498    HA   SER  70           HA       SER  70 -14.353  19.104  -9.581
  499   1HB   SER  70          HB2       SER  70 -12.407  19.740 -10.970
  500   2HB   SER  70          HB3       SER  70 -12.157  18.243 -10.052
  501    HG   SER  70           HG       SER  70 -11.410  18.178 -12.217
  502    H    GLU  71           H        GLU  71 -14.106  18.348 -13.046
  503    HA   GLU  71           HA       GLU  71 -15.406  20.753 -13.837
  504   1HB   GLU  71          HB2       GLU  71 -14.803  18.327 -15.572
  505   2HB   GLU  71          HB3       GLU  71 -15.110  19.972 -16.143
  506   1HG   GLU  71          HG2       GLU  71 -12.720  18.887 -14.648
  507   2HG   GLU  71          HG3       GLU  71 -12.773  19.563 -16.258
  508    H    LEU  72           H        LEU  72 -17.454  20.724 -12.786
  509    HA   LEU  72           HA       LEU  72 -19.565  18.963 -13.878
  510   1HB   LEU  72          HB2       LEU  72 -19.641  19.759 -11.523
  511   2HB   LEU  72          HB3       LEU  72 -19.800  21.426 -12.120
  512    HG   LEU  72           HG       LEU  72 -21.942  20.748 -13.238
  513   1HD1  LEU  72          1HD1      LEU  72 -21.681  18.365 -13.471
  514   2HD1  LEU  72          2HD1      LEU  72 -21.454  18.153 -11.705
  515   3HD1  LEU  72          3HD1      LEU  72 -23.032  18.633 -12.352
  516   1HD2  LEU  72          1HD2      LEU  72 -23.290  20.641 -11.171
  517   2HD2  LEU  72          2HD2      LEU  72 -21.836  20.292 -10.229
  518   3HD2  LEU  72          3HD2      LEU  72 -22.016  21.838 -11.053
  519    H    ILE  73           H        ILE  73 -20.289  19.241 -15.777
  520    HA   ILE  73           HA       ILE  73 -20.372  21.919 -17.081
  521    HB   ILE  73           HB       ILE  73 -20.925  19.173 -18.245
  522   1HG1  ILE  73          2HG1      ILE  73 -18.342  20.600 -18.870
  523   2HG1  ILE  73          3HG1      ILE  73 -18.412  19.710 -17.363
  524   1HG2  ILE  73          1HG2      ILE  73 -20.384  21.904 -19.498
  525   2HG2  ILE  73          2HG2      ILE  73 -20.559  20.385 -20.409
  526   3HG2  ILE  73          3HG2      ILE  73 -21.926  21.043 -19.473
  527   1HD1  ILE  73          1HD1      ILE  73 -19.090  18.486 -20.045
  528   2HD1  ILE  73          2HD1      ILE  73 -17.533  18.314 -19.205
  529   3HD1  ILE  73          3HD1      ILE  73 -19.008  17.656 -18.465
  530    H    ILE  74           H        ILE  74 -22.232  22.961 -17.123
  531    HA   ILE  74           HA       ILE  74 -24.838  21.558 -16.602
  532    HB   ILE  74           HB       ILE  74 -24.053  24.433 -16.039
  533   1HG1  ILE  74          2HG1      ILE  74 -24.370  22.110 -14.052
  534   2HG1  ILE  74          3HG1      ILE  74 -22.878  22.964 -14.442
  535   1HG2  ILE  74          1HG2      ILE  74 -26.546  22.883 -15.174
  536   2HG2  ILE  74          2HG2      ILE  74 -26.228  24.633 -14.948
  537   3HG2  ILE  74          3HG2      ILE  74 -26.497  24.013 -16.555
  538   1HD1  ILE  74          1HD1      ILE  74 -23.609  23.796 -12.350
  539   2HD1  ILE  74          2HD1      ILE  74 -23.893  25.078 -13.526
  540   3HD1  ILE  74          3HD1      ILE  74 -25.256  24.086 -12.941
  541    H    LYS  75           H        LYS  75 -26.183  21.545 -18.286
  542    HA   LYS  75           HA       LYS  75 -25.857  23.621 -20.452
  543   1HB   LYS  75          HB2       LYS  75 -27.065  22.127 -21.912
  544   2HB   LYS  75          HB3       LYS  75 -25.742  21.234 -21.152
  545   1HG   LYS  75          HG2       LYS  75 -27.425  20.269 -19.503
  546   2HG   LYS  75          HG3       LYS  75 -28.710  21.086 -20.440
  547   1HD   LYS  75          HD2       LYS  75 -27.988  19.868 -22.461
  548   2HD   LYS  75          HD3       LYS  75 -26.785  18.992 -21.482
  549   1HE   LYS  75          HE2       LYS  75 -28.561  18.053 -20.081
  550   2HE   LYS  75          HE3       LYS  75 -29.786  18.974 -20.980
  551   1HZ   LYS  75          HZ1       LYS  75 -28.056  16.882 -22.175
  552   2HZ   LYS  75          HZ2       LYS  75 -29.627  16.664 -21.797
  553   3HZ   LYS  75          HZ3       LYS  75 -29.211  17.709 -22.975
  554    H    LYS  76           H        LYS  76 -27.684  24.614 -21.250
  555    HA   LYS  76           HA       LYS  76 -29.750  25.644 -21.306
  556   1HB   LYS  76          HB2       LYS  76 -30.473  23.230 -21.329
  557   2HB   LYS  76          HB3       LYS  76 -30.753  23.340 -19.591
  558   1HG   LYS  76          HG2       LYS  76 -32.809  23.508 -20.684
  559   2HG   LYS  76          HG3       LYS  76 -32.483  25.142 -20.082
  560   1HD   LYS  76          HD2       LYS  76 -31.801  25.870 -22.352
  561   2HD   LYS  76          HD3       LYS  76 -32.038  24.220 -22.968
  562   1HE   LYS  76          HE2       LYS  76 -34.425  24.375 -22.307
  563   2HE   LYS  76          HE3       LYS  76 -34.175  26.025 -21.740
  564   1HZ   LYS  76          HZ1       LYS  76 -33.518  26.573 -24.068
  565   2HZ   LYS  76          HZ2       LYS  76 -33.818  25.042 -24.548
  566   3HZ   LYS  76          HZ3       LYS  76 -35.053  25.984 -24.029
  567    H    VAL  77           H        VAL  77 -28.081  26.876 -19.767
  568    HA   VAL  77           HA       VAL  77 -28.665  27.020 -16.972
  569    HB   VAL  77           HB       VAL  77 -27.048  28.865 -18.753
  570   1HG1  VAL  77          1HG1      VAL  77 -25.944  29.582 -16.642
  571   2HG1  VAL  77          2HG1      VAL  77 -27.627  30.101 -16.739
  572   3HG1  VAL  77          3HG1      VAL  77 -27.188  28.717 -15.703
  573   1HG2  VAL  77          1HG2      VAL  77 -26.310  26.513 -16.938
  574   2HG2  VAL  77          2HG2      VAL  77 -26.142  26.588 -18.716
  575   3HG2  VAL  77          3HG2      VAL  77 -25.128  27.600 -17.685
  576    H    ASP  78           H        ASP  78 -29.750  28.406 -15.733
  577    HA   ASP  78           HA       ASP  78 -31.124  30.751 -16.826
  578   1HB   ASP  78          HB2       ASP  78 -32.524  28.451 -16.993
  579   2HB   ASP  78          HB3       ASP  78 -32.908  28.877 -15.322
  580    H    LYS  79           H        LYS  79 -32.622  31.664 -14.893
  581    HA   LYS  79           HA       LYS  79 -30.788  32.646 -12.912
  582   1HB   LYS  79          HB2       LYS  79 -33.819  32.791 -13.038
  583   2HB   LYS  79          HB3       LYS  79 -32.810  33.724 -11.913
  584   1HG   LYS  79          HG2       LYS  79 -31.674  34.831 -13.822
  585   2HG   LYS  79          HG3       LYS  79 -32.653  33.890 -14.951
  586   1HD   LYS  79          HD2       LYS  79 -33.565  36.061 -14.816
  587   2HD   LYS  79          HD3       LYS  79 -34.716  34.923 -14.107
  588   1HE   LYS  79          HE2       LYS  79 -33.942  35.554 -11.822
  589   2HE   LYS  79          HE3       LYS  79 -32.795  36.717 -12.516
  590   1HZ   LYS  79          HZ1       LYS  79 -34.870  37.763 -11.824
  591   2HZ   LYS  79          HZ2       LYS  79 -34.714  37.914 -13.440
  592   3HZ   LYS  79          HZ3       LYS  79 -35.775  36.837 -12.821
  593    H    SER  80           H        SER  80 -32.699  29.768 -12.813
  594    HA   SER  80           HA       SER  80 -32.634  29.393  -9.930
  595   1HB   SER  80          HB2       SER  80 -33.417  27.093 -10.591
  596   2HB   SER  80          HB3       SER  80 -34.411  28.437 -11.180
  597    HG   SER  80           HG       SER  80 -33.969  26.792 -12.786
  598    H    ASP  81           H        ASP  81 -30.195  29.149 -12.318
  599    HA   ASP  81           HA       ASP  81 -28.641  27.139 -10.805
  600   1HB   ASP  81          HB2       ASP  81 -27.958  28.681 -13.323
  601   2HB   ASP  81          HB3       ASP  81 -26.999  27.386 -12.583
  602    H    GLU  82           H        GLU  82 -29.125  30.412 -10.300
  603    HA   GLU  82           HA       GLU  82 -26.512  31.265  -9.475
  604   1HB   GLU  82          HB2       GLU  82 -28.391  32.772  -9.785
  605   2HB   GLU  82          HB3       GLU  82 -29.286  32.030  -8.444
  606   1HG   GLU  82          HG2       GLU  82 -27.801  32.886  -6.797
  607   2HG   GLU  82          HG3       GLU  82 -26.529  33.177  -7.955
  608    H    ALA  83           H        ALA  83 -25.257  30.573  -7.786
  609    HA   ALA  83           HA       ALA  83 -26.415  29.111  -5.500
  610   1HB   ALA  83          HB1       ALA  83 -26.386  27.450  -7.338
  611   2HB   ALA  83          HB2       ALA  83 -24.676  27.841  -7.643
  612   3HB   ALA  83          HB3       ALA  83 -25.162  27.022  -6.130
  613    H    GLU  84           H        GLU  84 -25.044  28.662  -3.838
  614    HA   GLU  84           HA       GLU  84 -22.249  29.716  -3.927
  615   1HB   GLU  84          HB2       GLU  84 -23.689  30.869  -2.257
  616   2HB   GLU  84          HB3       GLU  84 -23.967  29.282  -1.460
  617   1HG   GLU  84          HG2       GLU  84 -21.584  29.039  -1.006
  618   2HG   GLU  84          HG3       GLU  84 -21.199  30.491  -1.914
  619    H    TYR  85           H        TYR  85 -21.213  27.991  -4.710
  620    HA   TYR  85           HA       TYR  85 -22.092  25.274  -4.260
  621   1HB   TYR  85          HB2       TYR  85 -19.991  26.564  -5.951
  622   2HB   TYR  85          HB3       TYR  85 -20.214  24.826  -5.905
  623    HD1  TYR  85           HD1      TYR  85 -20.821  27.487  -7.945
  624    HD2  TYR  85           HD2      TYR  85 -22.919  24.197  -6.109
  625    HE1  TYR  85           HE1      TYR  85 -22.427  27.417  -9.846
  626    HE2  TYR  85           HE2      TYR  85 -24.484  24.103  -8.094
  627    HH   TYR  85           HH       TYR  85 -24.270  26.378 -10.769
  628    H    ILE  86           H        ILE  86 -21.671  25.268  -1.914
  629    HA   ILE  86           HA       ILE  86 -18.881  25.088  -0.996
  630    HB   ILE  86           HB       ILE  86 -21.420  24.158   0.349
  631   1HG1  ILE  86          2HG1      ILE  86 -19.914  26.796   0.526
  632   2HG1  ILE  86          3HG1      ILE  86 -21.543  26.563  -0.109
  633   1HG2  ILE  86          1HG2      ILE  86 -18.647  24.683   1.495
  634   2HG2  ILE  86          2HG2      ILE  86 -20.078  24.142   2.422
  635   3HG2  ILE  86          3HG2      ILE  86 -19.337  23.078   1.243
  636   1HD1  ILE  86          1HD1      ILE  86 -22.259  25.864   2.208
  637   2HD1  ILE  86          2HD1      ILE  86 -20.639  26.342   2.788
  638   3HD1  ILE  86          3HD1      ILE  86 -21.689  27.543   2.092
  639    H    CYS  87           H        CYS  87 -17.585  23.419  -1.122
  640    HA   CYS  87           HA       CYS  87 -18.633  20.749  -1.946
  641   1HB   CYS  87          HB2       CYS  87 -16.304  20.564  -3.107
  642   2HB   CYS  87          HB3       CYS  87 -17.554  21.499  -3.902
  643    H    ILE  88           H        ILE  88 -17.821  18.949  -1.184
  644    HA   ILE  88           HA       ILE  88 -16.037  19.037   1.201
  645    HB   ILE  88           HB       ILE  88 -18.742  17.641   1.046
  646   1HG1  ILE  88          2HG1      ILE  88 -19.141  19.340   3.075
  647   2HG1  ILE  88          3HG1      ILE  88 -18.067  20.361   2.144
  648   1HG2  ILE  88          1HG2      ILE  88 -16.758  18.052   3.367
  649   2HG2  ILE  88          2HG2      ILE  88 -18.375  17.306   3.506
  650   3HG2  ILE  88          3HG2      ILE  88 -17.129  16.507   2.555
  651   1HD1  ILE  88          1HD1      ILE  88 -20.438  20.782   1.628
  652   2HD1  ILE  88          2HD1      ILE  88 -19.653  20.153   0.197
  653   3HD1  ILE  88          3HD1      ILE  88 -20.688  19.084   1.177
  654    H    ALA  89           H        ALA  89 -14.813  17.167   1.519
  655    HA   ALA  89           HA       ALA  89 -15.444  14.770  -0.125
  656   1HB   ALA  89          HB1       ALA  89 -13.857  16.033  -1.451
  657   2HB   ALA  89          HB2       ALA  89 -12.723  16.138  -0.063
  658   3HB   ALA  89          HB3       ALA  89 -13.094  14.559  -0.807
  659    H    GLU  90           H        GLU  90 -14.717  12.843   0.751
  660    HA   GLU  90           HA       GLU  90 -13.476  12.807   3.470
  661   1HB   GLU  90          HB2       GLU  90 -15.962  13.033   3.698
  662   2HB   GLU  90          HB3       GLU  90 -16.147  11.539   2.755
  663   1HG   GLU  90          HG2       GLU  90 -14.944  10.278   4.515
  664   2HG   GLU  90          HG3       GLU  90 -14.651  11.783   5.398
  665    H    ASN  91           H        ASN  91 -12.318  10.956   3.888
  666    HA   ASN  91           HA       ASN  91 -12.872   8.521   2.357
  667   1HB   ASN  91          HB2       ASN  91 -10.823   8.133   1.374
  668   2HB   ASN  91          HB3       ASN  91 -11.180   9.794   0.992
  669   1HD2  ASN  91          1HD2      ASN  91  -7.603   9.682   1.802
  670   2HD2  ASN  91          2HD2      ASN  91  -8.627   8.959   0.588
  671    H    LYS  92           H        LYS  92 -10.900   6.851   3.252
  672    HA   LYS  92           HA       LYS  92 -11.580   6.354   5.990
  673   1HB   LYS  92          HB2       LYS  92  -9.754   4.623   5.844
  674   2HB   LYS  92          HB3       LYS  92 -11.086   4.461   4.701
  675   1HG   LYS  92          HG2       LYS  92  -8.552   5.885   3.823
  676   2HG   LYS  92          HG3       LYS  92  -8.496   4.147   4.045
  677   1HD   LYS  92          HD2       LYS  92 -10.519   5.505   2.195
  678   2HD   LYS  92          HD3       LYS  92  -8.973   4.867   1.667
  679   1HE   LYS  92          HE2       LYS  92  -9.595   2.594   2.484
  680   2HE   LYS  92          HE3       LYS  92 -11.125   3.205   3.052
  681   1HZ   LYS  92          HZ1       LYS  92 -11.357   2.156   0.883
  682   2HZ   LYS  92          HZ2       LYS  92 -11.686   3.748   0.700
  683   3HZ   LYS  92          HZ3       LYS  92 -10.239   3.138   0.208
  684    H    ALA  93           H        ALA  93  -9.051   8.265   4.659
  685    HA   ALA  93           HA       ALA  93  -7.405   8.289   7.106
  686   1HB   ALA  93          HB1       ALA  93  -7.096   9.690   4.454
  687   2HB   ALA  93          HB2       ALA  93  -5.878   9.631   5.746
  688   3HB   ALA  93          HB3       ALA  93  -6.397   8.141   4.878
  689    H    GLY  94           H        GLY  94  -9.790  10.440   5.563
  690   1HA   GLY  94          HA2       GLY  94 -10.175  12.029   7.865
  691   2HA   GLY  94          HA3       GLY  94  -8.999  12.859   6.842
  692    H    GLU  95           H        GLU  95 -10.471  14.606   6.717
  693    HA   GLU  95           HA       GLU  95 -12.586  14.430   4.638
  694   1HB   GLU  95          HB2       GLU  95 -13.593  13.923   6.894
  695   2HB   GLU  95          HB3       GLU  95 -13.073  15.492   7.438
  696   1HG   GLU  95          HG2       GLU  95 -14.470  16.552   5.621
  697   2HG   GLU  95          HG3       GLU  95 -15.025  14.937   5.189
  698    H    GLN  96           H        GLN  96 -12.976  16.458   3.634
  699    HA   GLN  96           HA       GLN  96 -11.512  18.882   4.540
  700   1HB   GLN  96          HB2       GLN  96 -10.149  17.134   3.020
  701   2HB   GLN  96          HB3       GLN  96 -11.037  17.884   1.711
  702   1HG   GLN  96          HG2       GLN  96  -8.971  18.994   1.858
  703   2HG   GLN  96          HG3       GLN  96 -10.129  20.138   2.551
  704   1HE2  GLN  96          1HE2      GLN  96  -7.360  18.181   4.974
  705   2HE2  GLN  96          2HE2      GLN  96  -7.835  17.517   3.429
  706    H    ASP  97           H        ASP  97 -11.982  20.802   3.053
  707    HA   ASP  97           HA       ASP  97 -14.377  20.655   1.360
  708   1HB   ASP  97          HB2       ASP  97 -15.782  22.051   2.701
  709   2HB   ASP  97          HB3       ASP  97 -15.306  20.668   3.676
  710    H    ALA  98           H        ALA  98 -14.905  22.567   0.263
  711    HA   ALA  98           HA       ALA  98 -13.345  25.037   0.520
  712   1HB   ALA  98          HB1       ALA  98 -11.892  23.691  -0.938
  713   2HB   ALA  98          HB2       ALA  98 -13.246  23.336  -2.033
  714   3HB   ALA  98          HB3       ALA  98 -12.636  25.006  -1.871
  715    H    THR  99           H        THR  99 -14.269  26.508  -1.587
  716    HA   THR  99           HA       THR  99 -17.181  26.053  -1.993
  717    HB   THR  99           HB       THR  99 -16.022  28.404  -0.514
  718    HG1  THR  99           HG1      THR  99 -16.843  26.156   0.315
  719   1HG2  THR  99          1HG2      THR  99 -18.425  29.182  -0.301
  720   2HG2  THR  99          2HG2      THR  99 -17.766  29.317  -1.937
  721   3HG2  THR  99          3HG2      THR  99 -18.878  27.988  -1.524
  722    H    ILE 100           H        ILE 100 -17.858  26.765  -3.893
  723    HA   ILE 100           HA       ILE 100 -16.381  28.875  -5.428
  724    HB   ILE 100           HB       ILE 100 -18.298  27.376  -7.042
  725   1HG1  ILE 100          2HG1      ILE 100 -15.891  25.686  -6.357
  726   2HG1  ILE 100          3HG1      ILE 100 -17.485  25.407  -5.655
  727   1HG2  ILE 100          1HG2      ILE 100 -16.543  29.013  -7.798
  728   2HG2  ILE 100          2HG2      ILE 100 -15.324  27.783  -7.443
  729   3HG2  ILE 100          3HG2      ILE 100 -16.592  27.497  -8.682
  730   1HD1  ILE 100          1HD1      ILE 100 -16.838  25.277  -8.596
  731   2HD1  ILE 100          2HD1      ILE 100 -17.270  23.934  -7.501
  732   3HD1  ILE 100          3HD1      ILE 100 -18.493  25.159  -7.884
  733    H    HIS 101           H        HIS 101 -18.151  29.913  -7.079
  734    HA   HIS 101           HA       HIS 101 -20.840  30.183  -5.906
  735   1HB   HIS 101          HB2       HIS 101 -19.318  31.799  -4.718
  736   2HB   HIS 101          HB3       HIS 101 -18.972  32.558  -6.259
  737    HD1  HIS 101           HD1      HIS 101 -22.651  31.709  -5.369
  738    HD2  HIS 101           HD2      HIS 101 -19.849  34.881  -5.423
  739    HE1  HIS 101           HE1      HIS 101 -23.952  33.837  -4.873
  740    H    LEU 102           H        LEU 102 -22.322  31.164  -7.408
  741    HA   LEU 102           HA       LEU 102 -21.440  31.903 -10.119
  742   1HB   LEU 102          HB2       LEU 102 -21.805  29.584 -10.345
  743   2HB   LEU 102          HB3       LEU 102 -23.279  29.632  -9.373
  744    HG   LEU 102           HG       LEU 102 -24.517  30.746 -11.116
  745   1HD1  LEU 102          1HD1      LEU 102 -23.571  31.166 -13.357
  746   2HD1  LEU 102          2HD1      LEU 102 -22.838  32.202 -12.129
  747   3HD1  LEU 102          3HD1      LEU 102 -21.962  30.779 -12.749
  748   1HD2  LEU 102          1HD2      LEU 102 -24.482  28.995 -12.823
  749   2HD2  LEU 102          2HD2      LEU 102 -22.829  28.506 -12.346
  750   3HD2  LEU 102          3HD2      LEU 102 -24.212  28.289 -11.235
  751    H    LYS 103           H        LYS 103 -22.286  33.874 -10.432
  752    HA   LYS 103           HA       LYS 103 -24.976  34.551  -9.322
  753   1HB   LYS 103          HB2       LYS 103 -22.655  36.347 -10.120
  754   2HB   LYS 103          HB3       LYS 103 -24.241  36.920  -9.642
  755   1HG   LYS 103          HG2       LYS 103 -23.914  35.825  -7.398
  756   2HG   LYS 103          HG3       LYS 103 -22.316  35.300  -7.934
  757   1HD   LYS 103          HD2       LYS 103 -22.061  37.231  -6.562
  758   2HD   LYS 103          HD3       LYS 103 -21.589  37.628  -8.198
  759   1HE   LYS 103          HE2       LYS 103 -22.809  39.467  -7.158
  760   2HE   LYS 103          HE3       LYS 103 -23.726  38.808  -8.531
  761   1HZ   LYS 103          HZ1       LYS 103 -24.275  38.174  -5.675
  762   2HZ   LYS 103          HZ2       LYS 103 -25.105  39.245  -6.551
  763   3HZ   LYS 103          HZ3       LYS 103 -25.154  37.667  -6.979
  764    H    VAL 104           H        VAL 104 -26.623  34.903 -10.688
  765    HA   VAL 104           HA       VAL 104 -26.016  34.712 -13.625
  766    HB   VAL 104           HB       VAL 104 -28.378  33.623 -12.093
  767   1HG1  VAL 104          1HG1      VAL 104 -27.634  33.396 -15.041
  768   2HG1  VAL 104          2HG1      VAL 104 -28.938  32.510 -14.236
  769   3HG1  VAL 104          3HG1      VAL 104 -29.035  34.264 -14.370
  770   1HG2  VAL 104          1HG2      VAL 104 -26.061  32.183 -13.460
  771   2HG2  VAL 104          2HG2      VAL 104 -26.311  32.315 -11.711
  772   3HG2  VAL 104          3HG2      VAL 104 -27.449  31.405 -12.682
  773    H    PHE 105           H        PHE 105 -26.748  36.226 -14.948
  774    HA   PHE 105           HA       PHE 105 -28.899  38.089 -14.126
  775   1HB   PHE 105          HB2       PHE 105 -27.591  39.689 -15.662
  776   2HB   PHE 105          HB3       PHE 105 -27.029  39.421 -14.028
  777    HD1  PHE 105           HD1      PHE 105 -24.748  38.811 -13.650
  778    HD2  PHE 105           HD2      PHE 105 -26.411  38.434 -17.614
  779    HE1  PHE 105           HE1      PHE 105 -22.488  38.400 -14.575
  780    HE2  PHE 105           HE2      PHE 105 -24.158  37.999 -18.538
  781    HZ   PHE 105           HZ       PHE 105 -22.173  38.003 -17.030
  782    H    ALA 106           H        ALA 106 -29.724  39.208 -16.310
  783    HA   ALA 106           HA       ALA 106 -30.072  37.149 -18.430
  784   1HB   ALA 106          HB1       ALA 106 -31.767  36.745 -16.580
  785   2HB   ALA 106          HB2       ALA 106 -32.402  38.383 -16.864
  786   3HB   ALA 106          HB3       ALA 106 -32.511  37.139 -18.128
  787    H    LYS 107           H        LYS 107 -28.715  39.548 -18.533
  788    HA   LYS 107           HA       LYS 107 -29.679  40.787 -20.926
  789   1HB   LYS 107          HB2       LYS 107 -29.944  43.106 -20.085
  790   2HB   LYS 107          HB3       LYS 107 -31.219  42.010 -19.543
  791   1HG   LYS 107          HG2       LYS 107 -30.153  41.800 -17.320
  792   2HG   LYS 107          HG3       LYS 107 -28.770  42.755 -17.856
  793   1HD   LYS 107          HD2       LYS 107 -30.284  44.153 -16.504
  794   2HD   LYS 107          HD3       LYS 107 -30.131  44.743 -18.156
  795   1HE   LYS 107          HE2       LYS 107 -32.423  44.945 -17.458
  796   2HE   LYS 107          HE3       LYS 107 -32.338  43.698 -18.713
  797   1HZ   LYS 107          HZ1       LYS 107 -33.734  42.948 -16.879
  798   2HZ   LYS 107          HZ2       LYS 107 -32.419  42.001 -16.943
  799   3HZ   LYS 107          HZ3       LYS 107 -32.524  43.169 -15.795
  Start of MODEL    9
    1   1H    GLY   1          H1        GLY   1  -6.303   1.788  11.557
    2   2H    GLY   1          H2        GLY   1  -6.910   3.135  10.887
    3   3H    GLY   1          H3        GLY   1  -7.708   1.709  10.736
    4   1HA   GLY   1          HA2       GLY   1  -5.997   0.754   9.382
    5   2HA   GLY   1          HA3       GLY   1  -6.564   2.284   8.672
    6    H    LYS   2           H        LYS   2  -4.427   2.006   7.596
    7    HA   LYS   2           HA       LYS   2  -2.308   3.624   8.747
    8   1HB   LYS   2          HB2       LYS   2  -0.588   1.877   8.732
    9   2HB   LYS   2          HB3       LYS   2  -1.811   1.548   9.965
   10   1HG   LYS   2          HG2       LYS   2  -2.851  -0.181   8.620
   11   2HG   LYS   2          HG3       LYS   2  -1.842   0.219   7.204
   12   1HD   LYS   2          HD2       LYS   2   0.161  -0.478   8.429
   13   2HD   LYS   2          HD3       LYS   2  -0.785  -0.817   9.886
   14   1HE   LYS   2          HE2       LYS   2  -1.904  -2.654   8.873
   15   2HE   LYS   2          HE3       LYS   2  -1.419  -2.158   7.237
   16   1HZ   LYS   2          HZ1       LYS   2  -0.096  -4.044   8.080
   17   2HZ   LYS   2          HZ2       LYS   2   0.819  -2.749   7.714
   18   3HZ   LYS   2          HZ3       LYS   2   0.507  -3.093   9.303
   19    H    ASP   3           H        ASP   3  -0.522   3.953   7.247
   20    HA   ASP   3           HA       ASP   3  -1.169   3.405   4.403
   21   1HB   ASP   3          HB2       ASP   3   0.424   5.126   3.891
   22   2HB   ASP   3          HB3       ASP   3  -0.655   5.733   5.146
   23    H    ILE   4           H        ILE   4   0.640   1.940   6.848
   24    HA   ILE   4           HA       ILE   4   2.868   1.037   5.164
   25    HB   ILE   4           HB       ILE   4   2.312   0.160   8.010
   26   1HG1  ILE   4          2HG1      ILE   4   3.914   2.572   7.027
   27   2HG1  ILE   4          3HG1      ILE   4   2.426   2.633   7.951
   28   1HG2  ILE   4          1HG2      ILE   4   4.712  -0.376   7.992
   29   2HG2  ILE   4          2HG2      ILE   4   3.934  -1.211   6.657
   30   3HG2  ILE   4          3HG2      ILE   4   4.857   0.254   6.340
   31   1HD1  ILE   4          1HD1      ILE   4   4.248   3.078   9.430
   32   2HD1  ILE   4          2HD1      ILE   4   3.563   1.492   9.862
   33   3HD1  ILE   4          3HD1      ILE   4   5.082   1.587   8.976
   34    H    GLN   5           H        GLN   5   1.242   0.172   3.663
   35    HA   GLN   5           HA       GLN   5   1.026  -2.678   3.604
   36   1HB   GLN   5          HB2       GLN   5  -1.437  -2.874   3.612
   37   2HB   GLN   5          HB3       GLN   5  -0.785  -2.379   5.173
   38   1HG   GLN   5          HG2       GLN   5  -1.465  -0.059   4.790
   39   2HG   GLN   5          HG3       GLN   5  -1.985  -0.438   3.158
   40   1HE2  GLN   5          1HE2      GLN   5  -4.925  -0.409   5.568
   41   2HE2  GLN   5          2HE2      GLN   5  -3.600   0.730   5.312
   42    H    VAL   6           H        VAL   6  -0.705  -3.145   1.584
   43    HA   VAL   6           HA       VAL   6   0.407  -1.586  -0.633
   44    HB   VAL   6           HB       VAL   6  -1.516  -3.898  -0.921
   45   1HG1  VAL   6          1HG1      VAL   6  -0.860  -2.754  -3.013
   46   2HG1  VAL   6          2HG1      VAL   6   0.850  -2.983  -2.609
   47   3HG1  VAL   6          3HG1      VAL   6  -0.182  -4.376  -2.954
   48   1HG2  VAL   6          1HG2      VAL   6   0.221  -4.777   0.585
   49   2HG2  VAL   6          2HG2      VAL   6   0.455  -5.438  -1.033
   50   3HG2  VAL   6          3HG2      VAL   6   1.503  -4.110  -0.474
   51    H    ILE   7           H        ILE   7  -1.438  -0.360   1.128
   52    HA   ILE   7           HA       ILE   7  -3.229   1.019  -0.774
   53    HB   ILE   7           HB       ILE   7  -4.087  -0.068   1.932
   54   1HG1  ILE   7          2HG1      ILE   7  -4.225  -1.816   0.197
   55   2HG1  ILE   7          3HG1      ILE   7  -5.769  -1.377   0.858
   56   1HG2  ILE   7          1HG2      ILE   7  -5.538   1.746  -0.038
   57   2HG2  ILE   7          2HG2      ILE   7  -6.342   0.936   1.320
   58   3HG2  ILE   7          3HG2      ILE   7  -5.084   2.156   1.605
   59   1HD1  ILE   7          1HD1      ILE   7  -5.838  -1.750  -1.604
   60   2HD1  ILE   7          2HD1      ILE   7  -6.322  -0.088  -1.183
   61   3HD1  ILE   7          3HD1      ILE   7  -4.703  -0.422  -1.838
   62    H    VAL   8           H        VAL   8  -1.991   2.861  -0.733
   63    HA   VAL   8           HA       VAL   8  -0.735   3.699   1.791
   64    HB   VAL   8           HB       VAL   8  -0.373   4.934  -0.958
   65   1HG1  VAL   8          1HG1      VAL   8   0.332   6.360   0.965
   66   2HG1  VAL   8          2HG1      VAL   8   1.313   5.008   1.585
   67   3HG1  VAL   8          3HG1      VAL   8   1.712   5.782   0.014
   68   1HG2  VAL   8          1HG2      VAL   8   1.206   2.728   0.452
   69   2HG2  VAL   8          2HG2      VAL   8   0.287   2.585  -1.047
   70   3HG2  VAL   8          3HG2      VAL   8   1.724   3.589  -1.015
   71    H    ASN   9           H        ASN   9  -2.719   4.168   2.854
   72    HA   ASN   9           HA       ASN   9  -4.672   5.976   2.051
   73   1HB   ASN   9          HB2       ASN   9  -3.736   5.091   4.801
   74   2HB   ASN   9          HB3       ASN   9  -5.120   6.121   4.586
   75   1HD2  ASN   9          1HD2      ASN   9  -5.541   2.218   3.882
   76   2HD2  ASN   9          2HD2      ASN   9  -4.134   2.899   4.681
   77    H    VAL  10           H        VAL  10  -4.423   7.884   1.364
   78    HA   VAL  10           HA       VAL  10  -3.038  10.036   2.889
   79    HB   VAL  10           HB       VAL  10  -3.578   9.615  -0.059
   80   1HG1  VAL  10          1HG1      VAL  10  -4.119  11.941   0.196
   81   2HG1  VAL  10          2HG1      VAL  10  -2.715  12.211   1.255
   82   3HG1  VAL  10          3HG1      VAL  10  -2.498  11.833  -0.456
   83   1HG2  VAL  10          1HG2      VAL  10  -1.513   8.614   0.866
   84   2HG2  VAL  10          2HG2      VAL  10  -1.160   9.922  -0.281
   85   3HG2  VAL  10          3HG2      VAL  10  -1.015  10.209   1.473
   86    HA   PRO  11           HA       PRO  11  -7.229  11.576   3.701
   87   1HB   PRO  11          HB2       PRO  11  -5.620  14.159   3.845
   88   2HB   PRO  11          HB3       PRO  11  -6.950  13.613   4.919
   89   1HG   PRO  11          HG2       PRO  11  -4.416  13.315   5.756
   90   2HG   PRO  11          HG3       PRO  11  -5.548  11.925   5.923
   91   1HD   PRO  11          HD2       PRO  11  -3.498  12.401   3.750
   92   2HD   PRO  11          HD3       PRO  11  -3.857  10.912   4.687
   93    HA   PRO  12           HA       PRO  12  -8.374  13.444  -0.211
   94   1HB   PRO  12          HB2       PRO  12 -10.871  14.313   0.221
   95   2HB   PRO  12          HB3       PRO  12 -10.507  12.584   0.421
   96   1HG   PRO  12          HG2       PRO  12 -10.705  14.693   2.593
   97   2HG   PRO  12          HG3       PRO  12 -11.401  13.047   2.536
   98   1HD   PRO  12          HD2       PRO  12  -9.008  13.659   3.767
   99   2HD   PRO  12          HD3       PRO  12  -9.442  12.047   3.156
  100    H    SER  13           H        SER  13  -8.329  15.463  -1.230
  101    HA   SER  13           HA       SER  13  -8.075  17.945   0.443
  102   1HB   SER  13          HB2       SER  13  -6.050  16.865  -1.570
  103   2HB   SER  13          HB3       SER  13  -6.046  18.483  -0.880
  104    HG   SER  13           HG       SER  13  -4.662  16.995   0.212
  105    H    VAL  14           H        VAL  14 -10.177  18.450  -0.366
  106    HA   VAL  14           HA       VAL  14 -10.303  19.189  -3.216
  107    HB   VAL  14           HB       VAL  14 -12.284  18.242  -2.214
  108   1HG1  VAL  14          1HG1      VAL  14 -12.514  20.788  -0.578
  109   2HG1  VAL  14          2HG1      VAL  14 -13.715  19.519  -0.700
  110   3HG1  VAL  14          3HG1      VAL  14 -12.160  19.168   0.079
  111   1HG2  VAL  14          1HG2      VAL  14 -12.849  21.130  -2.963
  112   2HG2  VAL  14          2HG2      VAL  14 -12.393  19.869  -4.125
  113   3HG2  VAL  14          3HG2      VAL  14 -13.894  19.697  -3.194
  114    H    ARG  15           H        ARG  15 -10.390  21.228  -4.014
  115    HA   ARG  15           HA       ARG  15 -10.208  23.595  -2.274
  116   1HB   ARG  15          HB2       ARG  15  -8.258  24.469  -3.369
  117   2HB   ARG  15          HB3       ARG  15  -7.883  22.884  -2.701
  118   1HG   ARG  15          HG2       ARG  15  -8.626  22.219  -5.280
  119   2HG   ARG  15          HG3       ARG  15  -7.976  23.836  -5.510
  120   1HD   ARG  15          HD2       ARG  15  -6.091  22.471  -5.840
  121   2HD   ARG  15          HD3       ARG  15  -5.917  22.982  -4.186
  122    HE   ARG  15           HE       ARG  15  -6.634  20.782  -3.437
  123   1HH1  ARG  15          1HH1      ARG  15  -6.133  17.962  -5.334
  124   2HH1  ARG  15          2HH1      ARG  15  -6.609  18.561  -3.761
  125   1HH2  ARG  15          1HH2      ARG  15  -6.513  20.782  -6.959
  126   2HH2  ARG  15          2HH2      ARG  15  -6.074  19.081  -6.959
  127    H    ALA  16           H        ALA  16 -10.496  25.651  -3.705
  128    HA   ALA  16           HA       ALA  16 -12.632  25.137  -5.722
  129   1HB   ALA  16          HB1       ALA  16 -12.914  27.589  -5.603
  130   2HB   ALA  16          HB2       ALA  16 -13.030  26.858  -3.987
  131   3HB   ALA  16          HB3       ALA  16 -11.558  27.708  -4.491
  132    H    ARG  17           H        ARG  17 -12.328  25.275  -7.871
  133    HA   ARG  17           HA       ARG  17  -9.689  25.769  -9.017
  134   1HB   ARG  17          HB2       ARG  17 -11.331  24.160  -9.954
  135   2HB   ARG  17          HB3       ARG  17 -12.351  25.512 -10.456
  136   1HG   ARG  17          HG2       ARG  17 -10.666  26.366 -11.945
  137   2HG   ARG  17          HG3       ARG  17  -9.479  25.194 -11.389
  138   1HD   ARG  17          HD2       ARG  17 -12.099  24.454 -12.764
  139   2HD   ARG  17          HD3       ARG  17 -10.565  24.687 -13.609
  140    HE   ARG  17           HE       ARG  17 -11.390  22.365 -12.073
  141   1HH1  ARG  17          1HH1      ARG  17 -10.083  20.574 -12.019
  142   2HH1  ARG  17          2HH1      ARG  17  -8.422  20.718 -12.487
  143   1HH2  ARG  17          1HH2      ARG  17  -8.510  24.063 -13.164
  144   2HH2  ARG  17          2HH2      ARG  17  -7.558  22.604 -13.116
  145    H    GLN  18           H        GLN  18 -12.471  27.758  -8.457
  146    HA   GLN  18           HA       GLN  18 -11.028  30.182  -8.431
  147   1HB   GLN  18          HB2       GLN  18 -12.138  31.446 -10.192
  148   2HB   GLN  18          HB3       GLN  18 -11.106  30.185 -10.815
  149   1HG   GLN  18          HG2       GLN  18 -13.057  28.745 -11.322
  150   2HG   GLN  18          HG3       GLN  18 -14.138  30.014 -10.695
  151   1HE2  GLN  18          1HE2      GLN  18 -13.674  32.171 -13.520
  152   2HE2  GLN  18          2HE2      GLN  18 -14.230  32.116 -11.862
  153    H    SER  19           H        SER  19 -12.360  31.977  -7.579
  154    HA   SER  19           HA       SER  19 -14.308  30.802  -5.720
  155   1HB   SER  19          HB2       SER  19 -14.113  33.007  -4.608
  156   2HB   SER  19          HB3       SER  19 -12.547  32.231  -4.878
  157    HG   SER  19           HG       SER  19 -12.505  34.429  -5.474
  158    H    THR  20           H        THR  20 -14.575  32.753  -8.594
  159    HA   THR  20           HA       THR  20 -17.537  32.947  -8.201
  160    HB   THR  20           HB       THR  20 -15.809  35.182  -9.328
  161    HG1  THR  20           HG1      THR  20 -15.539  35.034  -7.096
  162   1HG2  THR  20          1HG2      THR  20 -18.069  35.230 -10.231
  163   2HG2  THR  20          2HG2      THR  20 -18.779  34.968  -8.610
  164   3HG2  THR  20          3HG2      THR  20 -17.955  36.492  -8.999
  165    H    MET  21           H        MET  21 -18.651  32.322  -9.852
  166    HA   MET  21           HA       MET  21 -17.531  32.139 -12.621
  167   1HB   MET  21          HB2       MET  21 -19.609  30.468 -11.148
  168   2HB   MET  21          HB3       MET  21 -19.355  30.380 -12.889
  169   1HG   MET  21          HG2       MET  21 -17.337  29.711 -10.702
  170   2HG   MET  21          HG3       MET  21 -18.239  28.582 -11.676
  171   1HE   MET  21          HE1       MET  21 -18.031  28.540 -14.444
  172   2HE   MET  21          HE2       MET  21 -17.804  30.275 -14.719
  173   3HE   MET  21          HE3       MET  21 -16.590  29.142 -15.283
  174    H    ASN  22           H        ASN  22 -19.196  32.453 -14.294
  175    HA   ASN  22           HA       ASN  22 -21.518  34.213 -13.629
  176   1HB   ASN  22          HB2       ASN  22 -19.178  34.860 -15.475
  177   2HB   ASN  22          HB3       ASN  22 -20.690  35.743 -15.465
  178   1HD2  ASN  22          1HD2      ASN  22 -17.905  36.613 -12.698
  179   2HD2  ASN  22          2HD2      ASN  22 -17.601  35.393 -13.922
  180    H    ALA  23           H        ALA  23 -23.162  34.131 -15.282
  181    HA   ALA  23           HA       ALA  23 -22.679  32.807 -17.835
  182   1HB   ALA  23          HB1       ALA  23 -24.266  30.967 -17.456
  183   2HB   ALA  23          HB2       ALA  23 -22.998  30.885 -16.229
  184   3HB   ALA  23          HB3       ALA  23 -24.579  31.543 -15.821
  185    H    THR  24           H        THR  24 -24.461  32.961 -19.304
  186    HA   THR  24           HA       THR  24 -26.267  35.232 -18.675
  187    HB   THR  24           HB       THR  24 -25.688  34.151 -21.441
  188    HG1  THR  24           HG1      THR  24 -23.781  34.944 -20.427
  189   1HG2  THR  24          1HG2      THR  24 -27.711  35.522 -21.250
  190   2HG2  THR  24          2HG2      THR  24 -26.792  36.802 -20.433
  191   3HG2  THR  24          3HG2      THR  24 -26.465  36.400 -22.126
  192    H    ALA  25           H        ALA  25 -28.263  34.811 -18.206
  193    HA   ALA  25           HA       ALA  25 -29.493  32.167 -18.588
  194   1HB   ALA  25          HB1       ALA  25 -31.207  33.168 -17.147
  195   2HB   ALA  25          HB2       ALA  25 -29.597  33.493 -16.520
  196   3HB   ALA  25          HB3       ALA  25 -30.489  34.782 -17.379
  197    H    ASN  26           H        ASN  26 -31.929  32.259 -19.121
  198    HA   ASN  26           HA       ASN  26 -33.433  32.101 -20.682
  199   1HB   ASN  26          HB2       ASN  26 -33.575  34.565 -20.054
  200   2HB   ASN  26          HB3       ASN  26 -32.649  34.931 -21.512
  201   1HD2  ASN  26          1HD2      ASN  26 -36.558  33.643 -21.815
  202   2HD2  ASN  26          2HD2      ASN  26 -35.593  33.205 -20.407
  203    H    LEU  27           H        LEU  27 -30.305  32.221 -21.736
  204    HA   LEU  27           HA       LEU  27 -30.953  31.642 -24.582
  205   1HB   LEU  27          HB2       LEU  27 -28.327  32.094 -23.137
  206   2HB   LEU  27          HB3       LEU  27 -28.490  31.841 -24.873
  207    HG   LEU  27           HG       LEU  27 -29.540  34.216 -23.283
  208   1HD1  LEU  27          1HD1      LEU  27 -27.289  34.012 -25.348
  209   2HD1  LEU  27          2HD1      LEU  27 -27.856  35.489 -24.523
  210   3HD1  LEU  27          3HD1      LEU  27 -27.093  34.171 -23.585
  211   1HD2  LEU  27          1HD2      LEU  27 -31.035  33.776 -25.186
  212   2HD2  LEU  27          2HD2      LEU  27 -30.073  35.198 -25.521
  213   3HD2  LEU  27          3HD2      LEU  27 -29.646  33.641 -26.282
  214    H    SER  28           H        SER  28 -30.605  29.775 -21.817
  215    HA   SER  28           HA       SER  28 -30.262  27.589 -21.393
  216   1HB   SER  28          HB2       SER  28 -30.973  25.926 -22.938
  217   2HB   SER  28          HB3       SER  28 -32.027  27.340 -23.082
  218    HG   SER  28           HG       SER  28 -30.372  27.852 -24.882
  219    H    GLN  29           H        GLN  29 -27.924  29.086 -21.709
  220    HA   GLN  29           HA       GLN  29 -25.877  27.881 -23.260
  221   1HB   GLN  29          HB2       GLN  29 -25.867  29.495 -20.659
  222   2HB   GLN  29          HB3       GLN  29 -24.362  28.950 -21.420
  223   1HG   GLN  29          HG2       GLN  29 -25.050  30.125 -23.526
  224   2HG   GLN  29          HG3       GLN  29 -26.445  30.814 -22.654
  225   1HE2  GLN  29          1HE2      GLN  29 -23.512  33.217 -22.616
  226   2HE2  GLN  29          2HE2      GLN  29 -24.364  32.398 -23.933
  227    H    SER  30           H        SER  30 -23.979  26.793 -22.560
  228    HA   SER  30           HA       SER  30 -24.393  24.812 -20.350
  229   1HB   SER  30          HB2       SER  30 -22.769  24.475 -22.909
  230   2HB   SER  30          HB3       SER  30 -22.795  23.340 -21.512
  231    HG   SER  30           HG       SER  30 -24.988  24.093 -23.150
  232    H    VAL  31           H        VAL  31 -22.903  24.735 -18.818
  233    HA   VAL  31           HA       VAL  31 -20.520  26.590 -18.914
  234    HB   VAL  31           HB       VAL  31 -22.685  26.474 -16.755
  235   1HG1  VAL  31          1HG1      VAL  31 -20.150  28.198 -16.949
  236   2HG1  VAL  31          2HG1      VAL  31 -21.458  28.448 -15.760
  237   3HG1  VAL  31          3HG1      VAL  31 -20.480  26.979 -15.704
  238   1HG2  VAL  31          1HG2      VAL  31 -23.453  27.791 -18.695
  239   2HG2  VAL  31          2HG2      VAL  31 -23.075  28.842 -17.329
  240   3HG2  VAL  31          3HG2      VAL  31 -21.926  28.726 -18.664
  241    H    THR  32           H        THR  32 -18.696  25.751 -18.032
  242    HA   THR  32           HA       THR  32 -18.868  23.358 -16.252
  243    HB   THR  32           HB       THR  32 -16.479  24.443 -17.789
  244    HG1  THR  32           HG1      THR  32 -16.933  22.938 -19.256
  245   1HG2  THR  32          1HG2      THR  32 -15.778  23.036 -15.887
  246   2HG2  THR  32          2HG2      THR  32 -17.001  21.806 -16.330
  247   3HG2  THR  32          3HG2      THR  32 -15.613  22.129 -17.405
  248    H    LEU  33           H        LEU  33 -18.097  23.461 -14.231
  249    HA   LEU  33           HA       LEU  33 -16.101  25.383 -13.384
  250   1HB   LEU  33          HB2       LEU  33 -17.245  26.477 -11.668
  251   2HB   LEU  33          HB3       LEU  33 -18.174  26.719 -13.147
  252    HG   LEU  33           HG       LEU  33 -19.360  24.424 -11.999
  253   1HD1  LEU  33          1HD1      LEU  33 -18.811  26.483  -9.814
  254   2HD1  LEU  33          2HD1      LEU  33 -19.879  25.082  -9.702
  255   3HD1  LEU  33          3HD1      LEU  33 -18.136  24.852  -9.856
  256   1HD2  LEU  33          1HD2      LEU  33 -20.242  27.337 -11.770
  257   2HD2  LEU  33          2HD2      LEU  33 -20.567  26.234 -13.134
  258   3HD2  LEU  33          3HD2      LEU  33 -21.250  25.876 -11.554
  259    H    ALA  34           H        ALA  34 -15.405  24.903 -11.008
  260    HA   ALA  34           HA       ALA  34 -15.924  22.093 -10.282
  261   1HB   ALA  34          HB1       ALA  34 -13.186  23.038 -11.203
  262   2HB   ALA  34          HB2       ALA  34 -13.671  21.367 -10.863
  263   3HB   ALA  34          HB3       ALA  34 -14.326  22.212 -12.287
  264    H    CYS  35           H        CYS  35 -15.175  21.325  -8.455
  265    HA   CYS  35           HA       CYS  35 -13.402  22.964  -6.659
  266   1HB   CYS  35          HB2       CYS  35 -15.604  20.979  -5.985
  267   2HB   CYS  35          HB3       CYS  35 -14.345  21.501  -4.851
  268    H    ASP  36           H        ASP  36 -11.360  22.142  -7.268
  269    HA   ASP  36           HA       ASP  36 -11.194  19.459  -8.345
  270   1HB   ASP  36          HB2       ASP  36  -8.919  19.949  -8.869
  271   2HB   ASP  36          HB3       ASP  36 -10.082  21.091  -9.522
  272    H    ALA  37           H        ALA  37 -11.561  17.922  -6.954
  273    HA   ALA  37           HA       ALA  37  -9.997  17.723  -4.456
  274   1HB   ALA  37          HB1       ALA  37 -12.260  16.005  -5.598
  275   2HB   ALA  37          HB2       ALA  37 -11.590  15.857  -3.982
  276   3HB   ALA  37          HB3       ALA  37 -12.472  17.330  -4.440
  277    H    ASP  38           H        ASP  38  -8.769  16.028  -3.887
  278    HA   ASP  38           HA       ASP  38  -8.171  13.799  -5.762
  279   1HB   ASP  38          HB2       ASP  38  -6.078  15.668  -4.498
  280   2HB   ASP  38          HB3       ASP  38  -5.701  14.128  -5.284
  281    H    GLY  39           H        GLY  39  -6.852  12.074  -4.590
  282   1HA   GLY  39          HA2       GLY  39  -6.200  11.865  -1.926
  283   2HA   GLY  39          HA3       GLY  39  -7.915  11.438  -1.937
  284    H    PHE  40           H        PHE  40  -5.976   9.613  -1.114
  285    HA   PHE  40           HA       PHE  40  -6.215   7.484  -3.134
  286   1HB   PHE  40          HB2       PHE  40  -3.586   8.185  -1.810
  287   2HB   PHE  40          HB3       PHE  40  -3.881   6.843  -2.886
  288    HD1  PHE  40           HD1      PHE  40  -4.243   7.279  -5.350
  289    HD2  PHE  40           HD2      PHE  40  -3.266  10.468  -2.633
  290    HE1  PHE  40           HE1      PHE  40  -3.668   8.754  -7.283
  291    HE2  PHE  40           HE2      PHE  40  -2.650  11.908  -4.554
  292    HZ   PHE  40           HZ       PHE  40  -2.885  11.074  -6.873
  293    HA   PRO  41           HA       PRO  41  -7.191   5.329  -3.070
  294   1HB   PRO  41          HB2       PRO  41  -9.496   4.899  -1.120
  295   2HB   PRO  41          HB3       PRO  41  -8.966   3.883  -2.484
  296   1HG   PRO  41          HG2       PRO  41  -8.229   3.188   0.026
  297   2HG   PRO  41          HG3       PRO  41  -7.005   3.163  -1.266
  298   1HD   PRO  41          HD2       PRO  41  -7.501   5.381   0.758
  299   2HD   PRO  41          HD3       PRO  41  -5.963   4.630   0.270
  300    H    GLU  42           H        GLU  42  -8.857   5.986  -4.410
  301    HA   GLU  42           HA       GLU  42  -9.288   8.613  -4.903
  302   1HB   GLU  42          HB2       GLU  42 -11.181   6.336  -5.480
  303   2HB   GLU  42          HB3       GLU  42 -11.286   7.948  -6.227
  304   1HG   GLU  42          HG2       GLU  42  -9.079   7.678  -7.233
  305   2HG   GLU  42          HG3       GLU  42  -8.835   6.124  -6.437
  306    HA   PRO  43           HA       PRO  43 -11.917   9.878  -1.595
  307   1HB   PRO  43          HB2       PRO  43 -12.370  12.494  -2.152
  308   2HB   PRO  43          HB3       PRO  43 -10.704  11.873  -1.849
  309   1HG   PRO  43          HG2       PRO  43 -12.042  12.294  -4.559
  310   2HG   PRO  43          HG3       PRO  43 -10.455  12.919  -4.022
  311   1HD   PRO  43          HD2       PRO  43 -10.642  10.602  -5.413
  312   2HD   PRO  43          HD3       PRO  43  -9.469  10.764  -4.065
  313    H    THR  44           H        THR  44 -14.007  10.548  -0.969
  314    HA   THR  44           HA       THR  44 -16.162  10.325  -3.033
  315    HB   THR  44           HB       THR  44 -16.247  10.068  -0.001
  316    HG1  THR  44           HG1      THR  44 -16.664   7.901  -0.432
  317   1HG2  THR  44          1HG2      THR  44 -18.414  10.918  -0.878
  318   2HG2  THR  44          2HG2      THR  44 -18.435   9.657  -2.110
  319   3HG2  THR  44          3HG2      THR  44 -18.596   9.251  -0.372
  320    H    MET  45           H        MET  45 -17.011  12.363  -3.674
  321    HA   MET  45           HA       MET  45 -17.057  14.499  -1.636
  322   1HB   MET  45          HB2       MET  45 -15.793  16.013  -2.872
  323   2HB   MET  45          HB3       MET  45 -14.870  14.528  -2.913
  324   1HG   MET  45          HG2       MET  45 -14.657  15.278  -5.087
  325   2HG   MET  45          HG3       MET  45 -15.972  14.133  -5.240
  326   1HE   MET  45          HE1       MET  45 -14.752  17.814  -5.270
  327   2HE   MET  45          HE2       MET  45 -16.250  18.763  -5.475
  328   3HE   MET  45          HE3       MET  45 -15.902  17.985  -3.916
  329    H    THR  46           H        THR  46 -18.503  16.084  -1.871
  330    HA   THR  46           HA       THR  46 -20.429  16.075  -4.124
  331    HB   THR  46           HB       THR  46 -22.359  15.990  -2.546
  332    HG1  THR  46           HG1      THR  46 -21.998  14.993  -0.552
  333   1HG2  THR  46          1HG2      THR  46 -20.741  13.431  -2.503
  334   2HG2  THR  46          2HG2      THR  46 -22.508  13.579  -2.347
  335   3HG2  THR  46          3HG2      THR  46 -21.703  14.006  -3.889
  336    H    TRP  47           H        TRP  47 -22.134  17.840  -3.730
  337    HA   TRP  47           HA       TRP  47 -21.342  20.042  -2.067
  338   1HB   TRP  47          HB2       TRP  47 -20.992  21.625  -4.044
  339   2HB   TRP  47          HB3       TRP  47 -19.747  20.557  -3.512
  340    HD1  TRP  47           HD1      TRP  47 -19.165  18.375  -4.979
  341    HE1  TRP  47           HE1      TRP  47 -18.488  18.475  -7.425
  342    HE3  TRP  47           HE3      TRP  47 -21.632  22.659  -6.310
  343    HZ2  TRP  47           HZ2      TRP  47 -18.466  20.484  -9.487
  344    HZ3  TRP  47           HZ3      TRP  47 -21.219  23.661  -8.533
  345    HH2  TRP  47           HH2      TRP  47 -19.615  22.610 -10.118
  346    H    THR  48           H        THR  48 -22.633  21.946  -2.158
  347    HA   THR  48           HA       THR  48 -25.487  21.231  -2.725
  348    HB   THR  48           HB       THR  48 -26.124  22.323  -0.689
  349    HG1  THR  48           HG1      THR  48 -24.459  23.158   0.699
  350   1HG2  THR  48          1HG2      THR  48 -25.081  20.934   1.010
  351   2HG2  THR  48          2HG2      THR  48 -25.251  19.961  -0.453
  352   3HG2  THR  48          3HG2      THR  48 -23.665  20.627  -0.023
  353    H    LYS  49           H        LYS  49 -26.988  22.884  -3.083
  354    HA   LYS  49           HA       LYS  49 -25.918  25.244  -4.521
  355   1HB   LYS  49          HB2       LYS  49 -27.515  23.450  -5.507
  356   2HB   LYS  49          HB3       LYS  49 -28.763  24.198  -4.508
  357   1HG   LYS  49          HG2       LYS  49 -28.324  26.382  -5.693
  358   2HG   LYS  49          HG3       LYS  49 -27.108  25.549  -6.689
  359   1HD   LYS  49          HD2       LYS  49 -28.850  24.001  -7.547
  360   2HD   LYS  49          HD3       LYS  49 -30.057  24.788  -6.559
  361   1HE   LYS  49          HE2       LYS  49 -28.444  26.178  -8.772
  362   2HE   LYS  49          HE3       LYS  49 -30.082  25.508  -8.932
  363   1HZ   LYS  49          HZ1       LYS  49 -30.416  27.737  -8.515
  364   2HZ   LYS  49          HZ2       LYS  49 -30.703  27.048  -7.062
  365   3HZ   LYS  49          HZ3       LYS  49 -29.307  27.860  -7.339
  366    H    ASP  50           H        ASP  50 -25.463  25.838  -2.136
  367    HA   ASP  50           HA       ASP  50 -25.802  26.996  -0.230
  368   1HB   ASP  50          HB2       ASP  50 -26.099  28.742  -2.025
  369   2HB   ASP  50          HB3       ASP  50 -27.830  28.634  -1.781
  370    H    GLY  51           H        GLY  51 -27.676  24.629  -0.604
  371   1HA   GLY  51          HA2       GLY  51 -29.208  24.771   1.784
  372   2HA   GLY  51          HA3       GLY  51 -30.254  25.311   0.481
  373    H    GLU  52           H        GLU  52 -28.982  23.278  -1.421
  374    HA   GLU  52           HA       GLU  52 -29.911  20.696  -0.273
  375   1HB   GLU  52          HB2       GLU  52 -31.483  20.329  -2.037
  376   2HB   GLU  52          HB3       GLU  52 -31.890  21.803  -1.196
  377   1HG   GLU  52          HG2       GLU  52 -30.859  23.138  -3.030
  378   2HG   GLU  52          HG3       GLU  52 -30.473  21.666  -3.905
  379    HA   PRO  53           HA       PRO  53 -26.513  19.158  -2.427
  380   1HB   PRO  53          HB2       PRO  53 -27.018  16.514  -2.777
  381   2HB   PRO  53          HB3       PRO  53 -26.838  17.263  -1.168
  382   1HG   PRO  53          HG2       PRO  53 -29.417  16.671  -2.664
  383   2HG   PRO  53          HG3       PRO  53 -29.019  16.251  -0.962
  384   1HD   PRO  53          HD2       PRO  53 -30.451  18.477  -1.523
  385   2HD   PRO  53          HD3       PRO  53 -29.205  18.482  -0.249
  386    H    ILE  54           H        ILE  54 -25.537  18.893  -4.286
  387    HA   ILE  54           HA       ILE  54 -27.022  18.625  -6.859
  388    HB   ILE  54           HB       ILE  54 -24.213  19.721  -6.406
  389   1HG1  ILE  54          2HG1      ILE  54 -26.622  21.530  -6.754
  390   2HG1  ILE  54          3HG1      ILE  54 -26.052  21.095  -5.167
  391   1HG2  ILE  54          1HG2      ILE  54 -26.190  20.267  -8.667
  392   2HG2  ILE  54          2HG2      ILE  54 -24.516  20.838  -8.596
  393   3HG2  ILE  54          3HG2      ILE  54 -24.861  19.125  -8.813
  394   1HD1  ILE  54          1HD1      ILE  54 -24.295  22.432  -7.221
  395   2HD1  ILE  54          2HD1      ILE  54 -25.128  23.231  -5.912
  396   3HD1  ILE  54          3HD1      ILE  54 -23.867  22.028  -5.558
  397    H    GLU  55           H        GLU  55 -26.630  16.475  -5.246
  398    HA   GLU  55           HA       GLU  55 -24.426  14.875  -5.301
  399   1HB   GLU  55          HB2       GLU  55 -26.105  12.942  -5.121
  400   2HB   GLU  55          HB3       GLU  55 -26.069  14.230  -3.889
  401   1HG   GLU  55          HG2       GLU  55 -28.072  15.286  -4.914
  402   2HG   GLU  55          HG3       GLU  55 -28.093  14.048  -6.156
  403    H    GLN  56           H        GLN  56 -23.191  14.746  -7.046
  404    HA   GLN  56           HA       GLN  56 -24.002  14.403  -9.663
  405   1HB   GLN  56          HB2       GLN  56 -21.329  13.396  -8.671
  406   2HB   GLN  56          HB3       GLN  56 -21.709  14.162 -10.223
  407   1HG   GLN  56          HG2       GLN  56 -20.605  15.868  -9.199
  408   2HG   GLN  56          HG3       GLN  56 -22.232  16.261  -8.693
  409   1HE2  GLN  56          1HE2      GLN  56 -19.375  14.981  -5.963
  410   2HE2  GLN  56          2HE2      GLN  56 -19.040  15.155  -7.673
  411    H    GLU  57           H        GLU  57 -23.884  11.945  -7.293
  412    HA   GLU  57           HA       GLU  57 -23.631   9.685  -9.208
  413   1HB   GLU  57          HB2       GLU  57 -23.111   8.312  -7.333
  414   2HB   GLU  57          HB3       GLU  57 -22.110   9.752  -7.313
  415   1HG   GLU  57          HG2       GLU  57 -23.592  10.748  -5.564
  416   2HG   GLU  57          HG3       GLU  57 -24.597   9.312  -5.615
  417    H    ASP  58           H        ASP  58 -26.129  11.479  -7.992
  418    HA   ASP  58           HA       ASP  58 -28.072   9.251  -8.429
  419   1HB   ASP  58          HB2       ASP  58 -27.870  11.032  -5.994
  420   2HB   ASP  58          HB3       ASP  58 -29.438  10.406  -6.524
  421    H    ASN  59           H        ASN  59 -27.437  12.755  -8.465
  422    HA   ASN  59           HA       ASN  59 -29.933  13.149 -10.080
  423   1HB   ASN  59          HB2       ASN  59 -29.456  14.513  -8.017
  424   2HB   ASN  59          HB3       ASN  59 -28.132  15.258  -8.890
  425   1HD2  ASN  59          1HD2      ASN  59 -31.335  17.270  -9.062
  426   2HD2  ASN  59          2HD2      ASN  59 -30.388  16.625  -7.745
  427    H    GLU  60           H        GLU  60 -29.904  13.817 -12.136
  428    HA   GLU  60           HA       GLU  60 -27.413  14.374 -13.659
  429   1HB   GLU  60          HB2       GLU  60 -29.415  12.164 -14.212
  430   2HB   GLU  60          HB3       GLU  60 -28.118  12.652 -15.314
  431   1HG   GLU  60          HG2       GLU  60 -26.428  11.974 -13.606
  432   2HG   GLU  60          HG3       GLU  60 -27.752  11.387 -12.594
  433    H    GLU  61           H        GLU  61 -30.238  15.560 -12.831
  434    HA   GLU  61           HA       GLU  61 -31.845  15.695 -15.165
  435   1HB   GLU  61          HB2       GLU  61 -31.784  17.473 -12.706
  436   2HB   GLU  61          HB3       GLU  61 -33.057  17.558 -13.932
  437   1HG   GLU  61          HG2       GLU  61 -32.425  15.020 -12.352
  438   2HG   GLU  61          HG3       GLU  61 -33.599  16.229 -11.856
  439    H    LYS  62           H        LYS  62 -29.085  17.656 -14.437
  440    HA   LYS  62           HA       LYS  62 -29.043  18.571 -17.150
  441   1HB   LYS  62          HB2       LYS  62 -29.130  20.989 -16.828
  442   2HB   LYS  62          HB3       LYS  62 -30.650  20.246 -16.362
  443   1HG   LYS  62          HG2       LYS  62 -29.883  20.382 -13.922
  444   2HG   LYS  62          HG3       LYS  62 -28.531  21.362 -14.488
  445   1HD   LYS  62          HD2       LYS  62 -31.491  22.010 -14.856
  446   2HD   LYS  62          HD3       LYS  62 -30.360  22.768 -13.678
  447   1HE   LYS  62          HE2       LYS  62 -28.993  23.571 -15.663
  448   2HE   LYS  62          HE3       LYS  62 -30.206  22.885 -16.711
  449   1HZ   LYS  62          HZ1       LYS  62 -30.791  25.147 -16.465
  450   2HZ   LYS  62          HZ2       LYS  62 -31.834  24.388 -15.435
  451   3HZ   LYS  62          HZ3       LYS  62 -30.509  25.184 -14.880
  452    H    TYR  63           H        TYR  63 -27.157  17.037 -15.846
  453    HA   TYR  63           HA       TYR  63 -24.850  18.579 -16.447
  454   1HB   TYR  63          HB2       TYR  63 -23.759  18.340 -14.101
  455   2HB   TYR  63          HB3       TYR  63 -24.782  19.683 -14.439
  456    HD1  TYR  63           HD1      TYR  63 -26.646  20.255 -13.181
  457    HD2  TYR  63           HD2      TYR  63 -24.793  16.394 -12.668
  458    HE1  TYR  63           HE1      TYR  63 -27.909  19.924 -11.062
  459    HE2  TYR  63           HE2      TYR  63 -26.014  16.082 -10.540
  460    HH   TYR  63           HH       TYR  63 -28.299  18.556  -9.255
  461    H    SER  64           H        SER  64 -22.841  17.633 -16.166
  462    HA   SER  64           HA       SER  64 -22.563  14.682 -15.918
  463   1HB   SER  64          HB2       SER  64 -21.793  16.263 -18.432
  464   2HB   SER  64          HB3       SER  64 -21.485  14.550 -18.130
  465    HG   SER  64           HG       SER  64 -23.677  14.135 -18.230
  466    H    PHE  65           H        PHE  65 -20.354  14.085 -15.476
  467    HA   PHE  65           HA       PHE  65 -18.320  16.189 -15.133
  468   1HB   PHE  65          HB2       PHE  65 -18.275  15.609 -12.830
  469   2HB   PHE  65          HB3       PHE  65 -19.926  15.959 -13.302
  470    HD1  PHE  65           HD1      PHE  65 -17.732  13.490 -11.823
  471    HD2  PHE  65           HD2      PHE  65 -21.602  14.105 -13.623
  472    HE1  PHE  65           HE1      PHE  65 -18.491  11.329 -10.861
  473    HE2  PHE  65           HE2      PHE  65 -22.371  11.928 -12.690
  474    HZ   PHE  65           HZ       PHE  65 -20.841  10.556 -11.312
  475    H    ASN  66           H        ASN  66 -16.391  15.175 -13.916
  476    HA   ASN  66           HA       ASN  66 -15.378  12.946 -15.631
  477   1HB   ASN  66          HB2       ASN  66 -13.381  14.017 -15.803
  478   2HB   ASN  66          HB3       ASN  66 -14.444  15.406 -15.689
  479   1HD2  ASN  66          1HD2      ASN  66 -13.107  16.391 -12.482
  480   2HD2  ASN  66          2HD2      ASN  66 -14.522  16.546 -13.543
  481    H    TYR  67           H        TYR  67 -13.316  11.889 -14.617
  482    HA   TYR  67           HA       TYR  67 -14.335  10.181 -12.632
  483   1HB   TYR  67          HB2       TYR  67 -11.435  10.459 -13.543
  484   2HB   TYR  67          HB3       TYR  67 -12.183   9.049 -12.844
  485    HD1  TYR  67           HD1      TYR  67 -11.417  10.717 -15.909
  486    HD2  TYR  67           HD2      TYR  67 -14.172   7.949 -14.106
  487    HE1  TYR  67           HE1      TYR  67 -12.126   9.977 -18.177
  488    HE2  TYR  67           HE2      TYR  67 -14.848   7.142 -16.401
  489    HH   TYR  67           HH       TYR  67 -14.576   7.405 -18.667
  490    H    ASP  68           H        ASP  68 -12.356  13.039 -12.133
  491    HA   ASP  68           HA       ASP  68 -11.620  12.388  -9.314
  492   1HB   ASP  68          HB2       ASP  68 -11.368  14.913 -10.968
  493   2HB   ASP  68          HB3       ASP  68 -10.815  14.700  -9.309
  494    H    GLY  69           H        GLY  69 -14.523  13.370 -10.836
  495   1HA   GLY  69          HA2       GLY  69 -16.553  14.019  -9.998
  496   2HA   GLY  69          HA3       GLY  69 -15.883  13.959  -8.372
  497    H    SER  70           H        SER  70 -13.980  16.012 -10.270
  498    HA   SER  70           HA       SER  70 -14.722  18.294  -8.656
  499   1HB   SER  70          HB2       SER  70 -12.704  19.200  -9.845
  500   2HB   SER  70          HB3       SER  70 -12.435  17.728  -8.891
  501    HG   SER  70           HG       SER  70 -11.437  17.534 -10.878
  502    H    GLU  71           H        GLU  71 -14.030  18.081 -12.111
  503    HA   GLU  71           HA       GLU  71 -15.423  20.503 -12.789
  504   1HB   GLU  71          HB2       GLU  71 -14.478  18.291 -14.647
  505   2HB   GLU  71          HB3       GLU  71 -15.011  19.911 -15.105
  506   1HG   GLU  71          HG2       GLU  71 -13.121  20.878 -13.758
  507   2HG   GLU  71          HG3       GLU  71 -12.551  19.242 -13.442
  508    H    LEU  72           H        LEU  72 -17.507  20.639 -12.387
  509    HA   LEU  72           HA       LEU  72 -19.346  18.552 -13.447
  510   1HB   LEU  72          HB2       LEU  72 -19.592  19.306 -11.055
  511   2HB   LEU  72          HB3       LEU  72 -19.930  20.931 -11.651
  512    HG   LEU  72           HG       LEU  72 -21.951  19.967 -12.896
  513   1HD1  LEU  72          1HD1      LEU  72 -21.115  17.443 -11.416
  514   2HD1  LEU  72          2HD1      LEU  72 -22.753  17.757 -12.026
  515   3HD1  LEU  72          3HD1      LEU  72 -21.417  17.662 -13.168
  516   1HD2  LEU  72          1HD2      LEU  72 -23.331  19.692 -10.870
  517   2HD2  LEU  72          2HD2      LEU  72 -21.883  19.473  -9.888
  518   3HD2  LEU  72          3HD2      LEU  72 -22.202  21.038 -10.650
  519    H    ILE  73           H        ILE  73 -20.143  18.897 -15.379
  520    HA   ILE  73           HA       ILE  73 -20.200  21.626 -16.614
  521    HB   ILE  73           HB       ILE  73 -20.679  18.940 -17.919
  522   1HG1  ILE  73          2HG1      ILE  73 -18.047  20.409 -18.223
  523   2HG1  ILE  73          3HG1      ILE  73 -18.248  19.275 -16.910
  524   1HG2  ILE  73          1HG2      ILE  73 -20.041  21.720 -19.051
  525   2HG2  ILE  73          2HG2      ILE  73 -20.340  20.247 -19.995
  526   3HG2  ILE  73          3HG2      ILE  73 -21.619  20.998 -19.044
  527   1HD1  ILE  73          1HD1      ILE  73 -17.241  18.186 -18.825
  528   2HD1  ILE  73          2HD1      ILE  73 -18.812  17.478 -18.390
  529   3HD1  ILE  73          3HD1      ILE  73 -18.673  18.557 -19.820
  530    H    ILE  74           H        ILE  74 -22.038  22.621 -16.547
  531    HA   ILE  74           HA       ILE  74 -24.595  21.199 -15.976
  532    HB   ILE  74           HB       ILE  74 -23.832  24.085 -15.476
  533   1HG1  ILE  74          2HG1      ILE  74 -24.311  21.854 -13.416
  534   2HG1  ILE  74          3HG1      ILE  74 -22.709  22.406 -13.937
  535   1HG2  ILE  74          1HG2      ILE  74 -26.385  22.642 -14.655
  536   2HG2  ILE  74          2HG2      ILE  74 -25.943  24.323 -14.277
  537   3HG2  ILE  74          3HG2      ILE  74 -26.249  23.858 -15.938
  538   1HD1  ILE  74          1HD1      ILE  74 -23.153  23.445 -11.858
  539   2HD1  ILE  74          2HD1      ILE  74 -23.240  24.686 -13.116
  540   3HD1  ILE  74          3HD1      ILE  74 -24.728  24.058 -12.377
  541    H    LYS  75           H        LYS  75 -26.058  21.214 -17.525
  542    HA   LYS  75           HA       LYS  75 -25.646  22.968 -19.934
  543   1HB   LYS  75          HB2       LYS  75 -26.822  21.271 -21.223
  544   2HB   LYS  75          HB3       LYS  75 -25.462  20.574 -20.347
  545   1HG   LYS  75          HG2       LYS  75 -27.393  20.017 -18.518
  546   2HG   LYS  75          HG3       LYS  75 -28.448  20.237 -19.895
  547   1HD   LYS  75          HD2       LYS  75 -27.948  17.905 -19.596
  548   2HD   LYS  75          HD3       LYS  75 -27.167  18.456 -21.110
  549   1HE   LYS  75          HE2       LYS  75 -24.990  18.627 -19.918
  550   2HE   LYS  75          HE3       LYS  75 -25.773  18.167 -18.394
  551   1HZ   LYS  75          HZ1       LYS  75 -25.521  16.444 -20.823
  552   2HZ   LYS  75          HZ2       LYS  75 -24.731  16.249 -19.420
  553   3HZ   LYS  75          HZ3       LYS  75 -26.333  16.028 -19.457
  554    H    LYS  76           H        LYS  76 -27.500  23.724 -20.962
  555    HA   LYS  76           HA       LYS  76 -29.363  25.000 -21.114
  556   1HB   LYS  76          HB2       LYS  76 -31.491  23.951 -20.681
  557   2HB   LYS  76          HB3       LYS  76 -30.327  22.888 -21.458
  558   1HG   LYS  76          HG2       LYS  76 -29.952  21.807 -19.148
  559   2HG   LYS  76          HG3       LYS  76 -31.320  22.746 -18.577
  560   1HD   LYS  76          HD2       LYS  76 -32.821  21.611 -20.233
  561   2HD   LYS  76          HD3       LYS  76 -31.412  20.863 -20.991
  562   1HE   LYS  76          HE2       LYS  76 -32.193  19.122 -19.703
  563   2HE   LYS  76          HE3       LYS  76 -30.925  19.780 -18.676
  564   1HZ   LYS  76          HZ1       LYS  76 -32.750  20.975 -17.472
  565   2HZ   LYS  76          HZ2       LYS  76 -33.853  20.205 -18.388
  566   3HZ   LYS  76          HZ3       LYS  76 -32.897  19.346 -17.385
  567    H    VAL  77           H        VAL  77 -27.865  26.228 -19.500
  568    HA   VAL  77           HA       VAL  77 -28.861  26.724 -16.861
  569    HB   VAL  77           HB       VAL  77 -26.885  28.183 -18.644
  570   1HG1  VAL  77          1HG1      VAL  77 -27.525  28.873 -15.745
  571   2HG1  VAL  77          2HG1      VAL  77 -26.109  29.441 -16.663
  572   3HG1  VAL  77          3HG1      VAL  77 -27.735  29.929 -17.169
  573   1HG2  VAL  77          1HG2      VAL  77 -25.227  27.250 -17.043
  574   2HG2  VAL  77          2HG2      VAL  77 -26.519  26.507 -16.111
  575   3HG2  VAL  77          3HG2      VAL  77 -26.189  25.958 -17.762
  576    H    ASP  78           H        ASP  78 -30.045  28.324 -15.980
  577    HA   ASP  78           HA       ASP  78 -30.920  30.672 -17.466
  578   1HB   ASP  78          HB2       ASP  78 -32.591  28.572 -17.770
  579   2HB   ASP  78          HB3       ASP  78 -33.137  29.148 -16.169
  580    H    LYS  79           H        LYS  79 -32.498  31.910 -15.902
  581    HA   LYS  79           HA       LYS  79 -31.112  32.998 -13.782
  582   1HB   LYS  79          HB2       LYS  79 -34.129  32.763 -14.096
  583   2HB   LYS  79          HB3       LYS  79 -33.329  33.832 -12.941
  584   1HG   LYS  79          HG2       LYS  79 -32.142  34.937 -14.830
  585   2HG   LYS  79          HG3       LYS  79 -33.073  33.947 -15.963
  586   1HD   LYS  79          HD2       LYS  79 -34.367  35.886 -14.012
  587   2HD   LYS  79          HD3       LYS  79 -33.918  36.280 -15.644
  588   1HE   LYS  79          HE2       LYS  79 -36.121  35.824 -15.953
  589   2HE   LYS  79          HE3       LYS  79 -35.406  34.258 -16.348
  590   1HZ   LYS  79          HZ1       LYS  79 -36.649  34.999 -13.755
  591   2HZ   LYS  79          HZ2       LYS  79 -37.313  34.045 -14.883
  592   3HZ   LYS  79          HZ3       LYS  79 -35.985  33.518 -14.084
  593    H    SER  80           H        SER  80 -33.012  30.060 -13.480
  594    HA   SER  80           HA       SER  80 -33.073  30.021 -10.582
  595   1HB   SER  80          HB2       SER  80 -33.832  27.617 -11.032
  596   2HB   SER  80          HB3       SER  80 -34.826  28.921 -11.728
  597    HG   SER  80           HG       SER  80 -34.386  27.178 -13.203
  598    H    ASP  81           H        ASP  81 -30.462  29.359 -12.718
  599    HA   ASP  81           HA       ASP  81 -29.288  27.250 -11.029
  600   1HB   ASP  81          HB2       ASP  81 -28.297  28.597 -13.552
  601   2HB   ASP  81          HB3       ASP  81 -27.477  27.270 -12.719
  602    H    GLU  82           H        GLU  82 -29.348  30.534 -10.610
  603    HA   GLU  82           HA       GLU  82 -26.644  31.173  -9.829
  604   1HB   GLU  82          HB2       GLU  82 -28.445  32.817 -10.238
  605   2HB   GLU  82          HB3       GLU  82 -29.319  32.261  -8.821
  606   1HG   GLU  82          HG2       GLU  82 -27.737  33.186  -7.339
  607   2HG   GLU  82          HG3       GLU  82 -26.469  33.175  -8.531
  608    H    ALA  83           H        ALA  83 -25.543  30.911  -7.890
  609    HA   ALA  83           HA       ALA  83 -26.723  29.525  -5.578
  610   1HB   ALA  83          HB1       ALA  83 -25.458  27.421  -5.914
  611   2HB   ALA  83          HB2       ALA  83 -26.464  27.696  -7.344
  612   3HB   ALA  83          HB3       ALA  83 -24.738  28.067  -7.423
  613    H    GLU  84           H        GLU  84 -25.183  28.906  -3.947
  614    HA   GLU  84           HA       GLU  84 -22.483  30.116  -4.085
  615   1HB   GLU  84          HB2       GLU  84 -23.957  31.611  -2.721
  616   2HB   GLU  84          HB3       GLU  84 -24.213  30.266  -1.592
  617   1HG   GLU  84          HG2       GLU  84 -21.738  30.142  -1.234
  618   2HG   GLU  84          HG3       GLU  84 -21.513  31.515  -2.305
  619    H    TYR  85           H        TYR  85 -21.691  28.191  -4.649
  620    HA   TYR  85           HA       TYR  85 -22.562  25.689  -3.615
  621   1HB   TYR  85          HB2       TYR  85 -20.003  26.354  -5.129
  622   2HB   TYR  85          HB3       TYR  85 -20.671  24.755  -4.874
  623    HD1  TYR  85           HD1      TYR  85 -20.309  27.210  -7.287
  624    HD2  TYR  85           HD2      TYR  85 -23.279  24.578  -5.632
  625    HE1  TYR  85           HE1      TYR  85 -21.515  27.176  -9.473
  626    HE2  TYR  85           HE2      TYR  85 -24.490  24.537  -7.828
  627    HH   TYR  85           HH       TYR  85 -23.313  26.307 -10.649
  628    H    ILE  86           H        ILE  86 -21.877  24.511  -1.970
  629    HA   ILE  86           HA       ILE  86 -19.195  25.103  -0.707
  630    HB   ILE  86           HB       ILE  86 -21.669  24.013   0.703
  631   1HG1  ILE  86          2HG1      ILE  86 -20.377  26.775   0.689
  632   2HG1  ILE  86          3HG1      ILE  86 -22.044  26.351   0.191
  633   1HG2  ILE  86          1HG2      ILE  86 -20.273  24.196   2.741
  634   2HG2  ILE  86          2HG2      ILE  86 -19.486  23.164   1.541
  635   3HG2  ILE  86          3HG2      ILE  86 -18.918  24.828   1.739
  636   1HD1  ILE  86          1HD1      ILE  86 -20.961  26.383   3.023
  637   2HD1  ILE  86          2HD1      ILE  86 -22.156  27.463   2.301
  638   3HD1  ILE  86          3HD1      ILE  86 -22.564  25.745   2.556
  639    H    CYS  87           H        CYS  87 -17.836  23.449  -0.877
  640    HA   CYS  87           HA       CYS  87 -18.884  20.811  -1.741
  641   1HB   CYS  87          HB2       CYS  87 -17.066  20.720  -3.426
  642   2HB   CYS  87          HB3       CYS  87 -18.212  22.030  -3.696
  643    H    ILE  88           H        ILE  88 -18.135  19.084  -0.968
  644    HA   ILE  88           HA       ILE  88 -15.955  19.264   1.080
  645    HB   ILE  88           HB       ILE  88 -18.558  17.658   1.290
  646   1HG1  ILE  88          2HG1      ILE  88 -18.895  19.395   3.320
  647   2HG1  ILE  88          3HG1      ILE  88 -17.950  20.466   2.273
  648   1HG2  ILE  88          1HG2      ILE  88 -16.400  18.274   3.382
  649   2HG2  ILE  88          2HG2      ILE  88 -17.916  17.366   3.651
  650   3HG2  ILE  88          3HG2      ILE  88 -16.687  16.711   2.580
  651   1HD1  ILE  88          1HD1      ILE  88 -20.523  19.022   1.480
  652   2HD1  ILE  88          2HD1      ILE  88 -20.421  20.693   2.045
  653   3HD1  ILE  88          3HD1      ILE  88 -19.705  20.234   0.504
  654    H    ALA  89           H        ALA  89 -14.530  17.605   1.042
  655    HA   ALA  89           HA       ALA  89 -15.157  15.124  -0.503
  656   1HB   ALA  89          HB1       ALA  89 -12.455  16.548  -0.319
  657   2HB   ALA  89          HB2       ALA  89 -12.758  14.955  -1.064
  658   3HB   ALA  89          HB3       ALA  89 -13.483  16.405  -1.765
  659    H    GLU  90           H        GLU  90 -14.553  13.243   0.406
  660    HA   GLU  90           HA       GLU  90 -13.414  13.169   3.162
  661   1HB   GLU  90          HB2       GLU  90 -15.903  13.587   3.189
  662   2HB   GLU  90          HB3       GLU  90 -16.118  12.056   2.323
  663   1HG   GLU  90          HG2       GLU  90 -14.948  10.897   4.253
  664   2HG   GLU  90          HG3       GLU  90 -14.953  12.444   5.114
  665    H    ASN  91           H        ASN  91 -12.442  11.177   3.626
  666    HA   ASN  91           HA       ASN  91 -13.147   8.834   2.100
  667   1HB   ASN  91          HB2       ASN  91 -11.236   8.230   1.003
  668   2HB   ASN  91          HB3       ASN  91 -11.392   9.932   0.647
  669   1HD2  ASN  91          1HD2      ASN  91  -7.842   9.554   1.240
  670   2HD2  ASN  91          2HD2      ASN  91  -9.024   9.149  -0.002
  671    H    LYS  92           H        LYS  92 -11.532   6.898   3.042
  672    HA   LYS  92           HA       LYS  92 -12.157   6.747   5.815
  673   1HB   LYS  92          HB2       LYS  92 -10.807   4.757   5.869
  674   2HB   LYS  92          HB3       LYS  92 -11.913   4.754   4.526
  675   1HG   LYS  92          HG2       LYS  92  -8.954   5.472   4.247
  676   2HG   LYS  92          HG3       LYS  92  -9.531   3.805   4.245
  677   1HD   LYS  92          HD2       LYS  92 -10.127   5.939   2.155
  678   2HD   LYS  92          HD3       LYS  92  -9.138   4.505   2.006
  679   1HE   LYS  92          HE2       LYS  92 -12.147   4.433   2.431
  680   2HE   LYS  92          HE3       LYS  92 -11.351   4.314   0.870
  681   1HZ   LYS  92          HZ1       LYS  92 -10.197   2.295   1.678
  682   2HZ   LYS  92          HZ2       LYS  92 -11.013   2.367   3.101
  683   3HZ   LYS  92          HZ3       LYS  92 -11.820   2.091   1.715
  684    H    ALA  93           H        ALA  93  -9.355   8.190   4.437
  685    HA   ALA  93           HA       ALA  93  -7.852   8.189   6.957
  686   1HB   ALA  93          HB1       ALA  93  -6.017   9.069   5.562
  687   2HB   ALA  93          HB2       ALA  93  -6.718   7.620   4.825
  688   3HB   ALA  93          HB3       ALA  93  -7.094   9.225   4.173
  689    H    GLY  94           H        GLY  94  -9.997  10.439   5.327
  690   1HA   GLY  94          HA2       GLY  94  -9.840  12.374   7.414
  691   2HA   GLY  94          HA3       GLY  94  -8.811  12.919   6.074
  692    H    GLU  95           H        GLU  95 -10.174  14.768   6.157
  693    HA   GLU  95           HA       GLU  95 -12.439  14.722   4.340
  694   1HB   GLU  95          HB2       GLU  95 -13.409  13.954   6.544
  695   2HB   GLU  95          HB3       GLU  95 -12.889  15.488   7.255
  696   1HG   GLU  95          HG2       GLU  95 -14.327  16.693   5.542
  697   2HG   GLU  95          HG3       GLU  95 -14.945  15.112   5.042
  698    H    GLN  96           H        GLN  96 -12.625  16.749   3.372
  699    HA   GLN  96           HA       GLN  96 -11.735  19.247   4.673
  700   1HB   GLN  96          HB2       GLN  96 -10.266  18.130   2.235
  701   2HB   GLN  96          HB3       GLN  96 -10.320  19.852   2.578
  702   1HG   GLN  96          HG2       GLN  96  -9.430  19.367   4.898
  703   2HG   GLN  96          HG3       GLN  96  -9.160  17.691   4.356
  704   1HE2  GLN  96          1HE2      GLN  96  -7.580  17.312   2.671
  705   2HE2  GLN  96          2HE2      GLN  96  -6.271  18.459   2.454
  706    H    ASP  97           H        ASP  97 -12.001  21.163   3.063
  707    HA   ASP  97           HA       ASP  97 -14.245  20.835   1.188
  708   1HB   ASP  97          HB2       ASP  97 -15.813  22.167   2.407
  709   2HB   ASP  97          HB3       ASP  97 -15.341  20.797   3.388
  710    H    ALA  98           H        ALA  98 -14.948  22.710   0.093
  711    HA   ALA  98           HA       ALA  98 -13.512  25.276   0.321
  712   1HB   ALA  98          HB1       ALA  98 -12.131  23.994  -1.284
  713   2HB   ALA  98          HB2       ALA  98 -13.570  23.618  -2.259
  714   3HB   ALA  98          HB3       ALA  98 -13.001  25.285  -2.132
  715    H    THR  99           H        THR  99 -14.517  26.800  -1.563
  716    HA   THR  99           HA       THR  99 -17.469  26.524  -1.737
  717    HB   THR  99           HB       THR  99 -15.993  28.564  -0.028
  718    HG1  THR  99           HG1      THR  99 -16.967  26.381   0.656
  719   1HG2  THR  99          1HG2      THR  99 -17.680  29.859  -1.274
  720   2HG2  THR  99          2HG2      THR  99 -18.936  28.695  -0.787
  721   3HG2  THR  99          3HG2      THR  99 -18.135  29.678   0.427
  722    H    ILE 100           H        ILE 100 -18.385  27.812  -3.321
  723    HA   ILE 100           HA       ILE 100 -16.767  29.719  -4.939
  724    HB   ILE 100           HB       ILE 100 -18.137  27.256  -6.098
  725   1HG1  ILE 100          2HG1      ILE 100 -15.166  27.893  -5.897
  726   2HG1  ILE 100          3HG1      ILE 100 -16.033  26.622  -5.042
  727   1HG2  ILE 100          1HG2      ILE 100 -16.652  29.515  -7.517
  728   2HG2  ILE 100          2HG2      ILE 100 -17.211  28.036  -8.298
  729   3HG2  ILE 100          3HG2      ILE 100 -18.388  29.135  -7.639
  730   1HD1  ILE 100          1HD1      ILE 100 -16.620  25.578  -7.242
  731   2HD1  ILE 100          2HD1      ILE 100 -15.451  26.687  -8.007
  732   3HD1  ILE 100          3HD1      ILE 100 -14.885  25.574  -6.780
  733    H    HIS 101           H        HIS 101 -18.070  31.354  -5.833
  734    HA   HIS 101           HA       HIS 101 -21.056  31.071  -5.600
  735   1HB   HIS 101          HB2       HIS 101 -19.942  33.004  -4.551
  736   2HB   HIS 101          HB3       HIS 101 -19.291  33.483  -6.090
  737    HD1  HIS 101           HD1      HIS 101 -23.050  32.518  -5.807
  738    HD2  HIS 101           HD2      HIS 101 -20.483  35.854  -6.001
  739    HE1  HIS 101           HE1      HIS 101 -24.536  34.538  -6.234
  740    H    LEU 102           H        LEU 102 -22.364  31.212  -7.362
  741    HA   LEU 102           HA       LEU 102 -21.199  31.724 -10.063
  742   1HB   LEU 102          HB2       LEU 102 -21.570  29.379 -10.039
  743   2HB   LEU 102          HB3       LEU 102 -23.121  29.530  -9.191
  744    HG   LEU 102           HG       LEU 102 -24.125  30.587 -11.203
  745   1HD1  LEU 102          1HD1      LEU 102 -21.552  29.882 -12.635
  746   2HD1  LEU 102          2HD1      LEU 102 -23.007  30.560 -13.364
  747   3HD1  LEU 102          3HD1      LEU 102 -22.043  31.525 -12.241
  748   1HD2  LEU 102          1HD2      LEU 102 -24.316  28.210 -10.884
  749   2HD2  LEU 102          2HD2      LEU 102 -24.226  28.651 -12.602
  750   3HD2  LEU 102          3HD2      LEU 102 -22.805  27.934 -11.782
  751    H    LYS 103           H        LYS 103 -21.911  33.601 -10.700
  752    HA   LYS 103           HA       LYS 103 -24.644  34.615 -10.024
  753   1HB   LYS 103          HB2       LYS 103 -22.356  35.836 -11.619
  754   2HB   LYS 103          HB3       LYS 103 -23.870  36.658 -11.213
  755   1HG   LYS 103          HG2       LYS 103 -23.356  36.543  -8.834
  756   2HG   LYS 103          HG3       LYS 103 -21.858  35.631  -9.134
  757   1HD   LYS 103          HD2       LYS 103 -20.953  37.552 -10.424
  758   2HD   LYS 103          HD3       LYS 103 -22.461  38.455 -10.140
  759   1HE   LYS 103          HE2       LYS 103 -22.095  38.236  -7.669
  760   2HE   LYS 103          HE3       LYS 103 -20.566  37.390  -7.975
  761   1HZ   LYS 103          HZ1       LYS 103 -20.224  39.764  -7.554
  762   2HZ   LYS 103          HZ2       LYS 103 -19.747  39.406  -9.051
  763   3HZ   LYS 103          HZ3       LYS 103 -21.185  40.169  -8.821
  764    H    VAL 104           H        VAL 104 -26.344  34.711 -11.450
  765    HA   VAL 104           HA       VAL 104 -25.910  33.859 -14.286
  766    HB   VAL 104           HB       VAL 104 -28.008  32.717 -12.450
  767   1HG1  VAL 104          1HG1      VAL 104 -28.262  31.177 -14.494
  768   2HG1  VAL 104          2HG1      VAL 104 -28.967  32.775 -14.595
  769   3HG1  VAL 104          3HG1      VAL 104 -27.426  32.428 -15.424
  770   1HG2  VAL 104          1HG2      VAL 104 -26.854  30.551 -12.862
  771   2HG2  VAL 104          2HG2      VAL 104 -25.535  31.447 -13.691
  772   3HG2  VAL 104          3HG2      VAL 104 -25.830  31.698 -11.960
  773    H    PHE 105           H        PHE 105 -26.419  35.647 -15.367
  774    HA   PHE 105           HA       PHE 105 -28.746  37.295 -14.515
  775   1HB   PHE 105          HB2       PHE 105 -27.336  39.080 -15.676
  776   2HB   PHE 105          HB3       PHE 105 -26.845  38.535 -14.096
  777    HD1  PHE 105           HD1      PHE 105 -24.692  37.524 -13.708
  778    HD2  PHE 105           HD2      PHE 105 -26.059  38.241 -17.752
  779    HE1  PHE 105           HE1      PHE 105 -22.443  36.961 -14.593
  780    HE2  PHE 105           HE2      PHE 105 -23.798  37.678 -18.594
  781    HZ   PHE 105           HZ       PHE 105 -21.992  37.053 -17.033
  782    H    ALA 106           H        ALA 106 -30.265  37.926 -15.960
  783    HA   ALA 106           HA       ALA 106 -30.214  36.821 -18.681
  784   1HB   ALA 106          HB1       ALA 106 -32.201  36.592 -17.284
  785   2HB   ALA 106          HB2       ALA 106 -32.355  38.364 -17.160
  786   3HB   ALA 106          HB3       ALA 106 -32.535  37.548 -18.731
  787    H    LYS 107           H        LYS 107 -28.213  38.433 -18.656
  788    HA   LYS 107           HA       LYS 107 -27.071  40.271 -19.335
  789   1HB   LYS 107          HB2       LYS 107 -29.429  40.703 -21.232
  790   2HB   LYS 107          HB3       LYS 107 -27.844  41.483 -21.348
  791   1HG   LYS 107          HG2       LYS 107 -26.796  39.214 -21.582
  792   2HG   LYS 107          HG3       LYS 107 -28.412  38.510 -21.614
  793   1HD   LYS 107          HD2       LYS 107 -28.969  39.889 -23.596
  794   2HD   LYS 107          HD3       LYS 107 -27.340  40.589 -23.555
  795   1HE   LYS 107          HE2       LYS 107 -26.397  38.254 -23.803
  796   2HE   LYS 107          HE3       LYS 107 -28.062  37.635 -23.988
  797   1HZ   LYS 107          HZ1       LYS 107 -28.284  39.066 -25.941
  798   2HZ   LYS 107          HZ2       LYS 107 -26.747  39.590 -25.812
  799   3HZ   LYS 107          HZ3       LYS 107 -27.044  38.029 -26.141
  Start of MODEL   10
    1   1H    GLY   1          H1        GLY   1  -7.555  -1.015  -1.840
    2   2H    GLY   1          H2        GLY   1  -6.260  -1.242  -2.818
    3   3H    GLY   1          H3        GLY   1  -6.489  -2.204  -1.501
    4   1HA   GLY   1          HA2       GLY   1  -4.745  -0.541  -1.044
    5   2HA   GLY   1          HA3       GLY   1  -5.961   0.669  -1.404
    6    H    LYS   2           H        LYS   2  -4.623   0.623   1.034
    7    HA   LYS   2           HA       LYS   2  -6.818   0.208   2.996
    8   1HB   LYS   2          HB2       LYS   2  -4.057  -1.154   3.086
    9   2HB   LYS   2          HB3       LYS   2  -4.984  -0.804   4.567
   10   1HG   LYS   2          HG2       LYS   2  -6.910  -2.090   3.588
   11   2HG   LYS   2          HG3       LYS   2  -5.804  -2.632   2.294
   12   1HD   LYS   2          HD2       LYS   2  -4.305  -3.599   3.992
   13   2HD   LYS   2          HD3       LYS   2  -5.317  -2.986   5.284
   14   1HE   LYS   2          HE2       LYS   2  -5.791  -5.307   5.043
   15   2HE   LYS   2          HE3       LYS   2  -7.187  -4.423   4.432
   16   1HZ   LYS   2          HZ1       LYS   2  -5.056  -5.606   2.735
   17   2HZ   LYS   2          HZ2       LYS   2  -6.499  -6.303   2.972
   18   3HZ   LYS   2          HZ3       LYS   2  -6.388  -4.868   2.174
   19    H    ASP   3           H        ASP   3  -6.216   1.052   5.137
   20    HA   ASP   3           HA       ASP   3  -4.742   3.621   5.018
   21   1HB   ASP   3          HB2       ASP   3  -5.952   4.218   6.976
   22   2HB   ASP   3          HB3       ASP   3  -7.116   3.524   5.854
   23    H    ILE   4           H        ILE   4  -3.612   0.663   5.419
   24    HA   ILE   4           HA       ILE   4  -2.146   0.510   7.819
   25    HB   ILE   4           HB       ILE   4  -1.478  -0.388   4.987
   26   1HG1  ILE   4          2HG1      ILE   4  -2.219  -1.864   7.543
   27   2HG1  ILE   4          3HG1      ILE   4  -3.358  -1.446   6.298
   28   1HG2  ILE   4          1HG2      ILE   4   0.380  -1.724   5.944
   29   2HG2  ILE   4          2HG2      ILE   4   0.700  -0.016   6.056
   30   3HG2  ILE   4          3HG2      ILE   4   0.179  -0.909   7.499
   31   1HD1  ILE   4          1HD1      ILE   4  -1.999  -2.853   4.644
   32   2HD1  ILE   4          2HD1      ILE   4  -1.066  -3.434   6.036
   33   3HD1  ILE   4          3HD1      ILE   4  -2.790  -3.742   5.980
   34    H    GLN   5           H        GLN   5  -0.346   1.518   8.595
   35    HA   GLN   5           HA       GLN   5   0.259   4.142   7.455
   36   1HB   GLN   5          HB2       GLN   5   1.182   2.842  10.049
   37   2HB   GLN   5          HB3       GLN   5   1.456   4.532   9.603
   38   1HG   GLN   5          HG2       GLN   5  -1.303   3.252   9.944
   39   2HG   GLN   5          HG3       GLN   5  -0.483   4.214  11.142
   40   1HE2  GLN   5          1HE2      GLN   5  -2.398   6.193   8.171
   41   2HE2  GLN   5          2HE2      GLN   5  -2.469   4.429   8.251
   42    H    VAL   6           H        VAL   6   1.216   2.065   5.902
   43    HA   VAL   6           HA       VAL   6   4.006   2.918   5.466
   44    HB   VAL   6           HB       VAL   6   3.367  -0.056   5.244
   45   1HG1  VAL   6          1HG1      VAL   6   6.026   1.436   5.613
   46   2HG1  VAL   6          2HG1      VAL   6   5.823  -0.302   5.381
   47   3HG1  VAL   6          3HG1      VAL   6   5.437   0.809   4.066
   48   1HG2  VAL   6          1HG2      VAL   6   3.071   0.388   7.651
   49   2HG2  VAL   6          2HG2      VAL   6   4.540  -0.532   7.354
   50   3HG2  VAL   6          3HG2      VAL   6   4.674   1.184   7.727
   51    H    ILE   7           H        ILE   7   1.447   3.465   4.421
   52    HA   ILE   7           HA       ILE   7   1.675   2.789   1.501
   53    HB   ILE   7           HB       ILE   7  -0.845   3.199   3.171
   54   1HG1  ILE   7          2HG1      ILE   7   0.102   0.980   3.568
   55   2HG1  ILE   7          3HG1      ILE   7  -1.424   0.894   2.748
   56   1HG2  ILE   7          1HG2      ILE   7  -1.410   4.055   1.037
   57   2HG2  ILE   7          2HG2      ILE   7  -0.599   2.718   0.163
   58   3HG2  ILE   7          3HG2      ILE   7  -2.095   2.466   1.074
   59   1HD1  ILE   7          1HD1      ILE   7   0.246  -0.734   1.862
   60   2HD1  ILE   7          2HD1      ILE   7  -0.285   0.393   0.602
   61   3HD1  ILE   7          3HD1      ILE   7   1.305   0.592   1.363
   62    H    VAL   8           H        VAL   8   0.875   4.525   0.086
   63    HA   VAL   8           HA       VAL   8   1.530   7.194   1.111
   64    HB   VAL   8           HB       VAL   8   0.646   6.476  -1.711
   65   1HG1  VAL   8          1HG1      VAL   8   1.860   8.566  -2.263
   66   2HG1  VAL   8          2HG1      VAL   8   0.587   8.920  -1.098
   67   3HG1  VAL   8          3HG1      VAL   8   2.270   8.797  -0.559
   68   1HG2  VAL   8          1HG2      VAL   8   3.454   6.608  -0.520
   69   2HG2  VAL   8          2HG2      VAL   8   2.684   5.164  -1.181
   70   3HG2  VAL   8          3HG2      VAL   8   3.051   6.488  -2.255
   71    H    ASN   9           H        ASN   9  -0.152   7.120   2.654
   72    HA   ASN   9           HA       ASN   9  -2.971   7.104   1.882
   73   1HB   ASN   9          HB2       ASN   9  -3.320   7.285   4.358
   74   2HB   ASN   9          HB3       ASN   9  -2.578   5.808   3.738
   75   1HD2  ASN   9          1HD2      ASN   9  -0.132   8.355   5.861
   76   2HD2  ASN   9          2HD2      ASN   9  -1.406   9.050   4.868
   77    H    VAL  10           H        VAL  10  -3.088   8.944   0.554
   78    HA   VAL  10           HA       VAL  10  -2.496  11.599   1.666
   79    HB   VAL  10           HB       VAL  10  -3.589  10.930  -1.057
   80   1HG1  VAL  10          1HG1      VAL  10  -2.664  13.192  -1.623
   81   2HG1  VAL  10          2HG1      VAL  10  -3.948  13.306  -0.410
   82   3HG1  VAL  10          3HG1      VAL  10  -2.240  13.413   0.066
   83   1HG2  VAL  10          1HG2      VAL  10  -1.419   9.874  -0.903
   84   2HG2  VAL  10          2HG2      VAL  10  -1.241  11.370  -1.843
   85   3HG2  VAL  10          3HG2      VAL  10  -0.703  11.317  -0.147
   86    HA   PRO  11           HA       PRO  11  -6.778  12.222   3.122
   87   1HB   PRO  11          HB2       PRO  11  -5.784  15.066   2.963
   88   2HB   PRO  11          HB3       PRO  11  -6.770  14.282   4.266
   89   1HG   PRO  11          HG2       PRO  11  -4.165  14.619   4.666
   90   2HG   PRO  11          HG3       PRO  11  -4.888  13.002   5.010
   91   1HD   PRO  11          HD2       PRO  11  -3.373  13.913   2.516
   92   2HD   PRO  11          HD3       PRO  11  -3.143  12.432   3.508
   93    HA   PRO  12           HA       PRO  12  -8.938  13.792  -0.542
   94   1HB   PRO  12          HB2       PRO  12 -11.365  14.413   0.403
   95   2HB   PRO  12          HB3       PRO  12 -10.725  12.760   0.573
   96   1HG   PRO  12          HG2       PRO  12 -10.849  14.947   2.647
   97   2HG   PRO  12          HG3       PRO  12 -11.160  13.201   2.834
   98   1HD   PRO  12          HD2       PRO  12  -8.761  14.547   3.376
   99   2HD   PRO  12          HD3       PRO  12  -8.910  12.773   3.220
  100    H    SER  13           H        SER  13  -7.459  15.546  -0.964
  101    HA   SER  13           HA       SER  13  -7.624  18.068   0.513
  102   1HB   SER  13          HB2       SER  13  -5.917  17.175  -1.828
  103   2HB   SER  13          HB3       SER  13  -5.731  18.726  -0.976
  104    HG   SER  13           HG       SER  13  -4.327  17.099  -0.130
  105    H    VAL  14           H        VAL  14 -10.076  18.017  -0.343
  106    HA   VAL  14           HA       VAL  14 -10.507  19.005  -2.984
  107    HB   VAL  14           HB       VAL  14 -12.248  17.850  -1.806
  108   1HG1  VAL  14          1HG1      VAL  14 -12.579  20.303  -0.082
  109   2HG1  VAL  14          2HG1      VAL  14 -13.649  18.894  -0.099
  110   3HG1  VAL  14          3HG1      VAL  14 -12.006  18.712   0.496
  111   1HG2  VAL  14          1HG2      VAL  14 -14.120  19.198  -2.487
  112   2HG2  VAL  14          2HG2      VAL  14 -13.183  20.686  -2.355
  113   3HG2  VAL  14          3HG2      VAL  14 -12.819  19.528  -3.636
  114    H    ARG  15           H        ARG  15 -10.631  20.913  -3.853
  115    HA   ARG  15           HA       ARG  15 -10.375  23.439  -2.280
  116   1HB   ARG  15          HB2       ARG  15  -8.508  22.419  -4.434
  117   2HB   ARG  15          HB3       ARG  15  -8.633  24.138  -4.043
  118   1HG   ARG  15          HG2       ARG  15  -8.023  23.706  -1.736
  119   2HG   ARG  15          HG3       ARG  15  -7.918  21.961  -2.050
  120   1HD   ARG  15          HD2       ARG  15  -6.154  22.376  -3.730
  121   2HD   ARG  15          HD3       ARG  15  -6.197  24.107  -3.329
  122    HE   ARG  15           HE       ARG  15  -5.813  22.510  -0.960
  123   1HH1  ARG  15          1HH1      ARG  15  -4.000  23.727  -3.734
  124   2HH1  ARG  15          2HH1      ARG  15  -2.502  23.742  -2.862
  125   1HH2  ARG  15          1HH2      ARG  15  -2.418  23.138  -0.747
  126   2HH2  ARG  15          2HH2      ARG  15  -3.836  22.580   0.127
  127    H    ALA  16           H        ALA  16 -10.661  25.360  -3.713
  128    HA   ALA  16           HA       ALA  16 -12.858  24.909  -5.698
  129   1HB   ALA  16          HB1       ALA  16 -13.232  27.335  -5.451
  130   2HB   ALA  16          HB2       ALA  16 -13.372  26.466  -3.918
  131   3HB   ALA  16          HB3       ALA  16 -11.890  27.422  -4.274
  132    H    ARG  17           H        ARG  17 -12.465  25.046  -7.816
  133    HA   ARG  17           HA       ARG  17  -9.815  25.849  -8.830
  134   1HB   ARG  17          HB2       ARG  17 -12.314  25.042 -10.372
  135   2HB   ARG  17          HB3       ARG  17 -10.791  25.473 -11.105
  136   1HG   ARG  17          HG2       ARG  17  -9.823  23.582  -9.545
  137   2HG   ARG  17          HG3       ARG  17 -11.509  23.051  -9.459
  138   1HD   ARG  17          HD2       ARG  17 -11.310  23.379 -12.150
  139   2HD   ARG  17          HD3       ARG  17  -9.604  23.149 -11.807
  140    HE   ARG  17           HE       ARG  17 -11.708  21.221 -10.888
  141   1HH1  ARG  17          1HH1      ARG  17 -11.436  19.045 -11.374
  142   2HH1  ARG  17          2HH1      ARG  17 -10.080  18.543 -12.334
  143   1HH2  ARG  17          1HH2      ARG  17  -8.764  21.664 -12.786
  144   2HH2  ARG  17          2HH2      ARG  17  -8.604  19.957 -13.073
  145    H    GLN  18           H        GLN  18 -12.860  27.495  -8.465
  146    HA   GLN  18           HA       GLN  18 -11.558  30.048  -8.899
  147   1HB   GLN  18          HB2       GLN  18 -12.186  29.622 -11.197
  148   2HB   GLN  18          HB3       GLN  18 -13.785  29.053 -10.722
  149   1HG   GLN  18          HG2       GLN  18 -13.903  31.279 -11.799
  150   2HG   GLN  18          HG3       GLN  18 -14.543  31.259 -10.168
  151   1HE2  GLN  18          1HE2      GLN  18 -12.729  34.363 -10.160
  152   2HE2  GLN  18          2HE2      GLN  18 -14.297  33.667 -10.485
  153    H    SER  19           H        SER  19 -12.438  31.512  -7.473
  154    HA   SER  19           HA       SER  19 -14.282  30.533  -5.512
  155   1HB   SER  19          HB2       SER  19 -13.341  33.364  -5.963
  156   2HB   SER  19          HB3       SER  19 -13.988  32.692  -4.437
  157    HG   SER  19           HG       SER  19 -11.645  32.780  -4.561
  158    H    THR  20           H        THR  20 -14.891  32.450  -8.368
  159    HA   THR  20           HA       THR  20 -17.801  32.619  -7.806
  160    HB   THR  20           HB       THR  20 -16.088  35.097  -8.241
  161    HG1  THR  20           HG1      THR  20 -16.800  35.679  -6.254
  162   1HG2  THR  20          1HG2      THR  20 -18.229  35.384  -9.431
  163   2HG2  THR  20          2HG2      THR  20 -19.124  34.751  -8.025
  164   3HG2  THR  20          3HG2      THR  20 -18.305  36.319  -7.932
  165    H    MET  21           H        MET  21 -18.683  31.832  -9.567
  166    HA   MET  21           HA       MET  21 -17.533  32.280 -12.267
  167   1HB   MET  21          HB2       MET  21 -19.402  30.212 -11.029
  168   2HB   MET  21          HB3       MET  21 -19.211  30.369 -12.768
  169   1HG   MET  21          HG2       MET  21 -16.970  29.798 -10.776
  170   2HG   MET  21          HG3       MET  21 -17.808  28.571 -11.739
  171   1HE   MET  21          HE1       MET  21 -18.006  30.037 -14.724
  172   2HE   MET  21          HE2       MET  21 -16.561  29.194 -15.363
  173   3HE   MET  21          HE3       MET  21 -17.673  28.346 -14.294
  174    H    ASN  22           H        ASN  22 -18.996  32.765 -13.981
  175    HA   ASN  22           HA       ASN  22 -21.602  34.010 -13.329
  176   1HB   ASN  22          HB2       ASN  22 -19.295  35.359 -14.791
  177   2HB   ASN  22          HB3       ASN  22 -20.954  35.928 -14.795
  178   1HD2  ASN  22          1HD2      ASN  22 -18.590  36.906 -11.686
  179   2HD2  ASN  22          2HD2      ASN  22 -17.997  35.909 -13.005
  180    H    ALA  23           H        ALA  23 -23.029  34.093 -15.133
  181    HA   ALA  23           HA       ALA  23 -22.368  32.980 -17.752
  182   1HB   ALA  23          HB1       ALA  23 -24.133  31.479 -15.796
  183   2HB   ALA  23          HB2       ALA  23 -23.860  31.052 -17.501
  184   3HB   ALA  23          HB3       ALA  23 -22.496  30.987 -16.357
  185    H    THR  24           H        THR  24 -24.234  32.954 -19.221
  186    HA   THR  24           HA       THR  24 -26.011  35.270 -18.648
  187    HB   THR  24           HB       THR  24 -25.615  33.955 -21.345
  188    HG1  THR  24           HG1      THR  24 -23.935  35.420 -21.686
  189   1HG2  THR  24          1HG2      THR  24 -26.272  36.784 -20.395
  190   2HG2  THR  24          2HG2      THR  24 -25.942  36.350 -22.069
  191   3HG2  THR  24          3HG2      THR  24 -27.342  35.650 -21.253
  192    H    ALA  25           H        ALA  25 -28.142  35.064 -18.357
  193    HA   ALA  25           HA       ALA  25 -29.523  32.511 -18.904
  194   1HB   ALA  25          HB1       ALA  25 -31.476  33.714 -17.881
  195   2HB   ALA  25          HB2       ALA  25 -30.071  33.553 -16.820
  196   3HB   ALA  25          HB3       ALA  25 -30.397  35.105 -17.623
  197    H    ASN  26           H        ASN  26 -31.737  32.668 -19.933
  198    HA   ASN  26           HA       ASN  26 -33.118  32.942 -21.663
  199   1HB   ASN  26          HB2       ASN  26 -31.735  35.536 -22.407
  200   2HB   ASN  26          HB3       ASN  26 -33.336  34.992 -22.869
  201   1HD2  ASN  26          1HD2      ASN  26 -32.939  36.918 -19.370
  202   2HD2  ASN  26          2HD2      ASN  26 -31.544  36.631 -20.420
  203    H    LEU  27           H        LEU  27 -29.823  32.567 -22.183
  204    HA   LEU  27           HA       LEU  27 -30.065  32.197 -25.093
  205   1HB   LEU  27          HB2       LEU  27 -27.642  32.171 -23.244
  206   2HB   LEU  27          HB3       LEU  27 -27.581  31.987 -25.004
  207    HG   LEU  27           HG       LEU  27 -28.431  34.473 -23.466
  208   1HD1  LEU  27          1HD1      LEU  27 -26.115  33.946 -25.373
  209   2HD1  LEU  27          2HD1      LEU  27 -26.431  35.464 -24.482
  210   3HD1  LEU  27          3HD1      LEU  27 -25.979  33.989 -23.607
  211   1HD2  LEU  27          1HD2      LEU  27 -29.807  34.419 -25.484
  212   2HD2  LEU  27          2HD2      LEU  27 -28.454  35.568 -25.759
  213   3HD2  LEU  27          3HD2      LEU  27 -28.399  33.955 -26.473
  214    H    SER  28           H        SER  28 -30.380  30.222 -22.361
  215    HA   SER  28           HA       SER  28 -30.267  28.013 -21.920
  216   1HB   SER  28          HB2       SER  28 -31.098  26.466 -23.500
  217   2HB   SER  28          HB3       SER  28 -31.996  27.968 -23.664
  218    HG   SER  28           HG       SER  28 -30.205  28.337 -25.387
  219    H    GLN  29           H        GLN  29 -27.707  29.280 -22.359
  220    HA   GLN  29           HA       GLN  29 -25.985  27.548 -23.890
  221   1HB   GLN  29          HB2       GLN  29 -24.181  28.933 -23.010
  222   2HB   GLN  29          HB3       GLN  29 -25.550  29.920 -23.567
  223   1HG   GLN  29          HG2       GLN  29 -26.281  30.315 -21.255
  224   2HG   GLN  29          HG3       GLN  29 -25.015  29.249 -20.650
  225   1HE2  GLN  29          1HE2      GLN  29 -23.498  32.709 -22.253
  226   2HE2  GLN  29          2HE2      GLN  29 -24.633  31.804 -23.233
  227    H    SER  30           H        SER  30 -23.984  26.623 -23.002
  228    HA   SER  30           HA       SER  30 -24.424  24.968 -20.565
  229   1HB   SER  30          HB2       SER  30 -22.816  24.288 -23.066
  230   2HB   SER  30          HB3       SER  30 -22.924  23.289 -21.608
  231    HG   SER  30           HG       SER  30 -24.443  22.596 -23.185
  232    H    VAL  31           H        VAL  31 -22.703  24.705 -19.174
  233    HA   VAL  31           HA       VAL  31 -20.351  26.528 -19.468
  234    HB   VAL  31           HB       VAL  31 -22.437  26.816 -17.244
  235   1HG1  VAL  31          1HG1      VAL  31 -20.186  27.241 -16.328
  236   2HG1  VAL  31          2HG1      VAL  31 -19.792  28.308 -17.679
  237   3HG1  VAL  31          3HG1      VAL  31 -21.040  28.750 -16.489
  238   1HG2  VAL  31          1HG2      VAL  31 -21.678  28.734 -19.468
  239   2HG2  VAL  31          2HG2      VAL  31 -23.231  27.914 -19.243
  240   3HG2  VAL  31          3HG2      VAL  31 -22.699  29.126 -18.069
  241    H    THR  32           H        THR  32 -18.547  25.769 -18.324
  242    HA   THR  32           HA       THR  32 -18.992  23.459 -16.448
  243    HB   THR  32           HB       THR  32 -16.410  24.283 -17.813
  244    HG1  THR  32           HG1      THR  32 -16.783  22.706 -19.241
  245   1HG2  THR  32          1HG2      THR  32 -17.236  21.740 -16.337
  246   2HG2  THR  32          2HG2      THR  32 -15.725  21.943 -17.262
  247   3HG2  THR  32          3HG2      THR  32 -15.983  22.925 -15.831
  248    H    LEU  33           H        LEU  33 -18.300  23.507 -14.405
  249    HA   LEU  33           HA       LEU  33 -16.377  25.527 -13.428
  250   1HB   LEU  33          HB2       LEU  33 -17.745  26.209 -11.528
  251   2HB   LEU  33          HB3       LEU  33 -18.511  26.604 -13.060
  252    HG   LEU  33           HG       LEU  33 -19.994  24.510 -12.704
  253   1HD1  LEU  33          1HD1      LEU  33 -18.782  23.372 -10.896
  254   2HD1  LEU  33          2HD1      LEU  33 -18.917  24.822  -9.870
  255   3HD1  LEU  33          3HD1      LEU  33 -20.366  23.911 -10.330
  256   1HD2  LEU  33          1HD2      LEU  33 -21.482  25.728 -11.201
  257   2HD2  LEU  33          2HD2      LEU  33 -20.154  26.865 -10.787
  258   3HD2  LEU  33          3HD2      LEU  33 -20.813  26.792 -12.448
  259    H    ALA  34           H        ALA  34 -15.790  24.814 -10.958
  260    HA   ALA  34           HA       ALA  34 -16.106  21.933 -10.584
  261   1HB   ALA  34          HB1       ALA  34 -13.771  21.341 -10.991
  262   2HB   ALA  34          HB2       ALA  34 -14.443  22.087 -12.471
  263   3HB   ALA  34          HB3       ALA  34 -13.401  23.027 -11.391
  264    H    CYS  35           H        CYS  35 -15.483  21.096  -8.737
  265    HA   CYS  35           HA       CYS  35 -13.852  22.715  -6.816
  266   1HB   CYS  35          HB2       CYS  35 -16.205  22.623  -6.127
  267   2HB   CYS  35          HB3       CYS  35 -16.138  20.858  -6.101
  268    H    ASP  36           H        ASP  36 -11.848  21.837  -6.930
  269    HA   ASP  36           HA       ASP  36 -11.498  19.147  -7.987
  270   1HB   ASP  36          HB2       ASP  36  -9.180  19.630  -8.192
  271   2HB   ASP  36          HB3       ASP  36 -10.180  20.874  -8.923
  272    H    ALA  37           H        ALA  37 -12.264  17.763  -6.465
  273    HA   ALA  37           HA       ALA  37 -10.625  17.336  -4.027
  274   1HB   ALA  37          HB1       ALA  37 -12.976  15.736  -5.099
  275   2HB   ALA  37          HB2       ALA  37 -12.218  15.609  -3.478
  276   3HB   ALA  37          HB3       ALA  37 -13.135  17.062  -3.917
  277    H    ASP  38           H        ASP  38  -9.238  15.754  -3.784
  278    HA   ASP  38           HA       ASP  38  -8.989  13.435  -5.564
  279   1HB   ASP  38          HB2       ASP  38  -7.800  15.218  -6.855
  280   2HB   ASP  38          HB3       ASP  38  -6.854  15.622  -5.433
  281    H    GLY  39           H        GLY  39  -7.483  11.883  -4.606
  282   1HA   GLY  39          HA2       GLY  39  -5.895  12.196  -2.289
  283   2HA   GLY  39          HA3       GLY  39  -7.501  11.757  -1.722
  284    H    PHE  40           H        PHE  40  -5.638  10.025  -1.036
  285    HA   PHE  40           HA       PHE  40  -5.937   7.675  -2.838
  286   1HB   PHE  40          HB2       PHE  40  -3.277   8.742  -1.901
  287   2HB   PHE  40          HB3       PHE  40  -3.542   7.163  -2.596
  288    HD1  PHE  40           HD1      PHE  40  -3.252  10.755  -3.360
  289    HD2  PHE  40           HD2      PHE  40  -4.239   6.855  -4.964
  290    HE1  PHE  40           HE1      PHE  40  -3.024  11.621  -5.676
  291    HE2  PHE  40           HE2      PHE  40  -3.959   7.744  -7.280
  292    HZ   PHE  40           HZ       PHE  40  -3.381  10.123  -7.619
  293    HA   PRO  41           HA       PRO  41  -6.639   5.519  -2.588
  294   1HB   PRO  41          HB2       PRO  41  -8.749   4.838  -0.533
  295   2HB   PRO  41          HB3       PRO  41  -8.107   3.838  -1.861
  296   1HG   PRO  41          HG2       PRO  41  -7.205   3.432   0.674
  297   2HG   PRO  41          HG3       PRO  41  -6.039   3.465  -0.681
  298   1HD   PRO  41          HD2       PRO  41  -6.718   5.657   1.274
  299   2HD   PRO  41          HD3       PRO  41  -5.099   5.139   0.672
  300    H    GLU  42           H        GLU  42  -8.488   5.838  -3.857
  301    HA   GLU  42           HA       GLU  42  -9.125   8.403  -4.370
  302   1HB   GLU  42          HB2       GLU  42 -11.010   6.070  -4.928
  303   2HB   GLU  42          HB3       GLU  42 -11.053   7.636  -5.709
  304   1HG   GLU  42          HG2       GLU  42  -9.912   6.469  -7.292
  305   2HG   GLU  42          HG3       GLU  42  -8.570   7.140  -6.400
  306    HA   PRO  43           HA       PRO  43 -11.924   9.622  -1.166
  307   1HB   PRO  43          HB2       PRO  43 -12.277  12.249  -1.716
  308   2HB   PRO  43          HB3       PRO  43 -10.634  11.583  -1.385
  309   1HG   PRO  43          HG2       PRO  43 -11.893  12.042  -4.096
  310   2HG   PRO  43          HG3       PRO  43 -10.311  12.614  -3.488
  311   1HD   PRO  43          HD2       PRO  43 -10.554  10.326  -4.947
  312   2HD   PRO  43          HD3       PRO  43  -9.362  10.468  -3.600
  313    H    THR  44           H        THR  44 -13.980  10.394  -0.634
  314    HA   THR  44           HA       THR  44 -16.087  10.220  -2.769
  315    HB   THR  44           HB       THR  44 -16.313   9.886   0.255
  316    HG1  THR  44           HG1      THR  44 -16.772   7.760  -0.263
  317   1HG2  THR  44          1HG2      THR  44 -18.374  10.873  -0.570
  318   2HG2  THR  44          2HG2      THR  44 -18.434   9.702  -1.945
  319   3HG2  THR  44          3HG2      THR  44 -18.693   9.161  -0.268
  320    H    MET  45           H        MET  45 -17.138  12.170  -3.234
  321    HA   MET  45           HA       MET  45 -17.076  14.336  -1.191
  322   1HB   MET  45          HB2       MET  45 -16.091  15.905  -2.592
  323   2HB   MET  45          HB3       MET  45 -15.104  14.461  -2.806
  324   1HG   MET  45          HG2       MET  45 -15.268  15.081  -4.951
  325   2HG   MET  45          HG3       MET  45 -16.665  14.007  -4.865
  326   1HE   MET  45          HE1       MET  45 -15.293  17.575  -5.319
  327   2HE   MET  45          HE2       MET  45 -16.687  18.660  -5.102
  328   3HE   MET  45          HE3       MET  45 -16.034  17.794  -3.716
  329    H    THR  46           H        THR  46 -18.633  15.973  -1.500
  330    HA   THR  46           HA       THR  46 -20.635  15.833  -3.654
  331    HB   THR  46           HB       THR  46 -22.554  15.887  -2.083
  332    HG1  THR  46           HG1      THR  46 -22.284  15.172   0.004
  333   1HG2  THR  46          1HG2      THR  46 -21.073  13.252  -1.780
  334   2HG2  THR  46          2HG2      THR  46 -22.828  13.528  -1.760
  335   3HG2  THR  46          3HG2      THR  46 -21.919  13.766  -3.266
  336    H    TRP  47           H        TRP  47 -22.358  17.624  -3.169
  337    HA   TRP  47           HA       TRP  47 -21.445  19.989  -1.831
  338   1HB   TRP  47          HB2       TRP  47 -21.084  21.314  -3.990
  339   2HB   TRP  47          HB3       TRP  47 -19.846  20.254  -3.398
  340    HD1  TRP  47           HD1      TRP  47 -21.264  17.664  -5.178
  341    HE1  TRP  47           HE1      TRP  47 -20.080  17.423  -7.413
  342    HE3  TRP  47           HE3      TRP  47 -19.443  22.408  -5.593
  343    HZ2  TRP  47           HZ2      TRP  47 -18.488  19.120  -9.222
  344    HZ3  TRP  47           HZ3      TRP  47 -18.309  23.141  -7.705
  345    HH2  TRP  47           HH2      TRP  47 -17.987  21.500  -9.551
  346    H    THR  48           H        THR  48 -22.730  21.998  -2.469
  347    HA   THR  48           HA       THR  48 -25.546  21.126  -2.902
  348    HB   THR  48           HB       THR  48 -26.282  22.634  -1.181
  349    HG1  THR  48           HG1      THR  48 -24.742  23.717   0.094
  350   1HG2  THR  48          1HG2      THR  48 -23.978  20.987  -0.061
  351   2HG2  THR  48          2HG2      THR  48 -25.446  21.544   0.780
  352   3HG2  THR  48          3HG2      THR  48 -25.569  20.320  -0.516
  353    H    LYS  49           H        LYS  49 -27.045  22.653  -3.523
  354    HA   LYS  49           HA       LYS  49 -26.053  24.839  -5.267
  355   1HB   LYS  49          HB2       LYS  49 -27.236  22.738  -6.183
  356   2HB   LYS  49          HB3       LYS  49 -28.714  23.381  -5.503
  357   1HG   LYS  49          HG2       LYS  49 -28.527  25.393  -6.880
  358   2HG   LYS  49          HG3       LYS  49 -26.925  24.862  -7.446
  359   1HD   LYS  49          HD2       LYS  49 -28.025  22.848  -8.494
  360   2HD   LYS  49          HD3       LYS  49 -29.594  23.459  -7.953
  361   1HE   LYS  49          HE2       LYS  49 -29.264  23.981 -10.310
  362   2HE   LYS  49          HE3       LYS  49 -29.338  25.482  -9.363
  363   1HZ   LYS  49          HZ1       LYS  49 -26.741  24.214 -10.082
  364   2HZ   LYS  49          HZ2       LYS  49 -27.503  25.263 -11.095
  365   3HZ   LYS  49          HZ3       LYS  49 -27.001  25.763  -9.615
  366    H    ASP  50           H        ASP  50 -25.954  25.852  -3.017
  367    HA   ASP  50           HA       ASP  50 -26.569  27.456  -1.573
  368   1HB   ASP  50          HB2       ASP  50 -27.830  28.423  -3.531
  369   2HB   ASP  50          HB3       ASP  50 -29.299  27.698  -2.864
  370    H    GLY  51           H        GLY  51 -28.031  24.485  -1.689
  371   1HA   GLY  51          HA2       GLY  51 -28.327  24.156   1.076
  372   2HA   GLY  51          HA3       GLY  51 -29.919  24.676   0.524
  373    H    GLU  52           H        GLU  52 -29.705  23.201  -2.075
  374    HA   GLU  52           HA       GLU  52 -30.333  20.490  -1.050
  375   1HB   GLU  52          HB2       GLU  52 -31.428  20.114  -3.196
  376   2HB   GLU  52          HB3       GLU  52 -32.098  21.487  -2.318
  377   1HG   GLU  52          HG2       GLU  52 -30.836  23.027  -3.805
  378   2HG   GLU  52          HG3       GLU  52 -30.194  21.627  -4.688
  379    HA   PRO  53           HA       PRO  53 -26.557  19.025  -2.588
  380   1HB   PRO  53          HB2       PRO  53 -26.832  16.353  -2.678
  381   2HB   PRO  53          HB3       PRO  53 -26.982  17.277  -1.162
  382   1HG   PRO  53          HG2       PRO  53 -29.228  16.290  -2.970
  383   2HG   PRO  53          HG3       PRO  53 -29.055  16.125  -1.188
  384   1HD   PRO  53          HD2       PRO  53 -30.536  18.107  -2.346
  385   2HD   PRO  53          HD3       PRO  53 -29.632  18.361  -0.840
  386    H    ILE  54           H        ILE  54 -25.406  19.036  -4.330
  387    HA   ILE  54           HA       ILE  54 -26.276  18.204  -7.015
  388    HB   ILE  54           HB       ILE  54 -23.684  19.441  -6.004
  389   1HG1  ILE  54          2HG1      ILE  54 -26.144  20.825  -7.212
  390   2HG1  ILE  54          3HG1      ILE  54 -25.654  20.932  -5.525
  391   1HG2  ILE  54          1HG2      ILE  54 -23.589  18.361  -8.345
  392   2HG2  ILE  54          2HG2      ILE  54 -24.714  19.612  -8.859
  393   3HG2  ILE  54          3HG2      ILE  54 -23.087  20.010  -8.221
  394   1HD1  ILE  54          1HD1      ILE  54 -24.104  22.072  -7.844
  395   2HD1  ILE  54          2HD1      ILE  54 -24.949  22.955  -6.568
  396   3HD1  ILE  54          3HD1      ILE  54 -23.511  21.968  -6.167
  397    H    GLU  55           H        GLU  55 -26.386  16.075  -5.372
  398    HA   GLU  55           HA       GLU  55 -23.935  14.599  -5.129
  399   1HB   GLU  55          HB2       GLU  55 -25.506  12.692  -4.582
  400   2HB   GLU  55          HB3       GLU  55 -25.481  14.136  -3.524
  401   1HG   GLU  55          HG2       GLU  55 -27.633  14.895  -4.580
  402   2HG   GLU  55          HG3       GLU  55 -27.629  13.424  -5.576
  403    H    GLN  56           H        GLN  56 -22.840  14.031  -6.816
  404    HA   GLN  56           HA       GLN  56 -23.599  13.375  -9.386
  405   1HB   GLN  56          HB2       GLN  56 -21.217  12.262  -7.835
  406   2HB   GLN  56          HB3       GLN  56 -21.376  12.334  -9.593
  407   1HG   GLN  56          HG2       GLN  56 -20.119  14.153  -9.353
  408   2HG   GLN  56          HG3       GLN  56 -21.670  14.975  -9.158
  409   1HE2  GLN  56          1HE2      GLN  56 -18.998  15.654  -6.390
  410   2HE2  GLN  56          2HE2      GLN  56 -18.803  15.539  -8.123
  411    H    GLU  57           H        GLU  57 -24.185  11.398  -6.668
  412    HA   GLU  57           HA       GLU  57 -24.066   8.814  -8.028
  413   1HB   GLU  57          HB2       GLU  57 -24.931   9.733  -5.255
  414   2HB   GLU  57          HB3       GLU  57 -24.895   8.040  -5.727
  415   1HG   GLU  57          HG2       GLU  57 -22.429   9.824  -5.691
  416   2HG   GLU  57          HG3       GLU  57 -22.938   8.780  -4.382
  417    H    ASP  58           H        ASP  58 -26.458  11.223  -7.782
  418    HA   ASP  58           HA       ASP  58 -28.449   9.487  -9.030
  419   1HB   ASP  58          HB2       ASP  58 -28.623   8.957  -6.549
  420   2HB   ASP  58          HB3       ASP  58 -29.076  10.637  -6.288
  421    H    ASN  59           H        ASN  59 -27.433  12.698  -7.984
  422    HA   ASN  59           HA       ASN  59 -29.780  13.910  -9.364
  423   1HB   ASN  59          HB2       ASN  59 -29.123  14.718  -7.077
  424   2HB   ASN  59          HB3       ASN  59 -27.631  15.349  -7.779
  425   1HD2  ASN  59          1HD2      ASN  59 -29.096  17.232  -6.596
  426   2HD2  ASN  59          2HD2      ASN  59 -29.964  18.180  -7.807
  427    H    GLU  60           H        GLU  60 -29.662  14.606 -11.373
  428    HA   GLU  60           HA       GLU  60 -27.128  15.448 -12.676
  429   1HB   GLU  60          HB2       GLU  60 -29.000  13.236 -13.618
  430   2HB   GLU  60          HB3       GLU  60 -27.674  13.910 -14.593
  431   1HG   GLU  60          HG2       GLU  60 -26.025  13.082 -12.913
  432   2HG   GLU  60          HG3       GLU  60 -27.333  12.284 -12.038
  433    H    GLU  61           H        GLU  61 -30.035  16.415 -11.931
  434    HA   GLU  61           HA       GLU  61 -31.847  16.736 -13.876
  435   1HB   GLU  61          HB2       GLU  61 -30.962  18.725 -11.753
  436   2HB   GLU  61          HB3       GLU  61 -32.330  19.059 -12.779
  437   1HG   GLU  61          HG2       GLU  61 -32.150  16.490 -11.136
  438   2HG   GLU  61          HG3       GLU  61 -32.879  17.992 -10.539
  439    H    LYS  62           H        LYS  62 -28.954  18.787 -13.812
  440    HA   LYS  62           HA       LYS  62 -29.223  19.110 -16.673
  441   1HB   LYS  62          HB2       LYS  62 -29.165  21.561 -16.830
  442   2HB   LYS  62          HB3       LYS  62 -30.660  20.960 -16.175
  443   1HG   LYS  62          HG2       LYS  62 -30.093  21.665 -13.939
  444   2HG   LYS  62          HG3       LYS  62 -28.422  22.044 -14.424
  445   1HD   LYS  62          HD2       LYS  62 -29.742  24.089 -14.166
  446   2HD   LYS  62          HD3       LYS  62 -29.177  23.868 -15.821
  447   1HE   LYS  62          HE2       LYS  62 -31.450  22.964 -16.427
  448   2HE   LYS  62          HE3       LYS  62 -31.973  23.284 -14.759
  449   1HZ   LYS  62          HZ1       LYS  62 -31.078  25.349 -16.718
  450   2HZ   LYS  62          HZ2       LYS  62 -32.612  25.107 -16.192
  451   3HZ   LYS  62          HZ3       LYS  62 -31.479  25.661 -15.152
  452    H    TYR  63           H        TYR  63 -27.343  17.731 -15.365
  453    HA   TYR  63           HA       TYR  63 -24.944  18.997 -16.313
  454   1HB   TYR  63          HB2       TYR  63 -23.830  18.783 -13.952
  455   2HB   TYR  63          HB3       TYR  63 -24.617  20.220 -14.456
  456    HD1  TYR  63           HD1      TYR  63 -25.218  17.128 -12.378
  457    HD2  TYR  63           HD2      TYR  63 -26.355  21.215 -13.243
  458    HE1  TYR  63           HE1      TYR  63 -26.659  17.165 -10.376
  459    HE2  TYR  63           HE2      TYR  63 -27.729  21.240 -11.167
  460    HH   TYR  63           HH       TYR  63 -28.452  20.077  -9.355
  461    H    SER  64           H        SER  64 -23.038  17.896 -16.207
  462    HA   SER  64           HA       SER  64 -22.979  14.959 -15.601
  463   1HB   SER  64          HB2       SER  64 -22.186  16.267 -18.244
  464   2HB   SER  64          HB3       SER  64 -21.925  14.584 -17.791
  465    HG   SER  64           HG       SER  64 -24.297  14.452 -17.571
  466    H    PHE  65           H        PHE  65 -20.824  14.192 -15.130
  467    HA   PHE  65           HA       PHE  65 -18.706  16.231 -14.894
  468   1HB   PHE  65          HB2       PHE  65 -18.586  15.323 -12.549
  469   2HB   PHE  65          HB3       PHE  65 -20.111  16.092 -13.031
  470    HD1  PHE  65           HD1      PHE  65 -18.501  12.729 -12.601
  471    HD2  PHE  65           HD2      PHE  65 -22.207  14.960 -12.825
  472    HE1  PHE  65           HE1      PHE  65 -19.810  10.638 -12.143
  473    HE2  PHE  65           HE2      PHE  65 -23.456  12.908 -12.296
  474    HZ   PHE  65           HZ       PHE  65 -22.274  10.746 -12.007
  475    H    ASN  66           H        ASN  66 -16.712  15.279 -13.826
  476    HA   ASN  66           HA       ASN  66 -15.583  13.321 -15.732
  477   1HB   ASN  66          HB2       ASN  66 -13.489  14.355 -15.292
  478   2HB   ASN  66          HB3       ASN  66 -14.641  15.666 -15.403
  479   1HD2  ASN  66          1HD2      ASN  66 -12.730  16.627 -12.483
  480   2HD2  ASN  66          2HD2      ASN  66 -12.675  16.736 -14.246
  481    H    TYR  67           H        TYR  67 -13.456  12.243 -14.691
  482    HA   TYR  67           HA       TYR  67 -14.487  10.054 -13.128
  483   1HB   TYR  67          HB2       TYR  67 -11.614  10.655 -13.920
  484   2HB   TYR  67          HB3       TYR  67 -12.252   9.103 -13.407
  485    HD1  TYR  67           HD1      TYR  67 -14.296   8.111 -14.773
  486    HD2  TYR  67           HD2      TYR  67 -11.542  11.088 -16.260
  487    HE1  TYR  67           HE1      TYR  67 -14.917   7.515 -17.099
  488    HE2  TYR  67           HE2      TYR  67 -12.147  10.468 -18.598
  489    HH   TYR  67           HH       TYR  67 -13.442   9.125 -19.929
  490    H    ASP  68           H        ASP  68 -12.891  12.944 -12.114
  491    HA   ASP  68           HA       ASP  68 -12.198  11.909  -9.370
  492   1HB   ASP  68          HB2       ASP  68 -11.998  14.661 -10.654
  493   2HB   ASP  68          HB3       ASP  68 -11.479  14.232  -9.003
  494    H    GLY  69           H        GLY  69 -14.928  13.215 -11.047
  495   1HA   GLY  69          HA2       GLY  69 -17.045  13.743 -10.366
  496   2HA   GLY  69          HA3       GLY  69 -16.594  13.597  -8.650
  497    H    SER  70           H        SER  70 -14.361  15.599 -10.245
  498    HA   SER  70           HA       SER  70 -15.206  17.825  -8.539
  499   1HB   SER  70          HB2       SER  70 -13.032  18.781  -9.288
  500   2HB   SER  70          HB3       SER  70 -12.892  17.180  -8.544
  501    HG   SER  70           HG       SER  70 -11.711  16.928 -10.306
  502    H    GLU  71           H        GLU  71 -14.793  17.440 -12.081
  503    HA   GLU  71           HA       GLU  71 -15.632  20.213 -12.556
  504   1HB   GLU  71          HB2       GLU  71 -14.994  17.950 -14.466
  505   2HB   GLU  71          HB3       GLU  71 -15.482  19.574 -14.971
  506   1HG   GLU  71          HG2       GLU  71 -13.583  20.601 -13.961
  507   2HG   GLU  71          HG3       GLU  71 -13.039  19.086 -13.251
  508    H    LEU  72           H        LEU  72 -17.657  20.826 -12.482
  509    HA   LEU  72           HA       LEU  72 -19.819  18.912 -13.213
  510   1HB   LEU  72          HB2       LEU  72 -19.895  20.089 -10.957
  511   2HB   LEU  72          HB3       LEU  72 -20.083  21.608 -11.814
  512    HG   LEU  72           HG       LEU  72 -22.154  20.526 -12.964
  513   1HD1  LEU  72          1HD1      LEU  72 -23.201  18.706 -11.564
  514   2HD1  LEU  72          2HD1      LEU  72 -21.736  18.156 -12.403
  515   3HD1  LEU  72          3HD1      LEU  72 -21.694  18.539 -10.659
  516   1HD2  LEU  72          1HD2      LEU  72 -22.380  22.234 -11.251
  517   2HD2  LEU  72          2HD2      LEU  72 -23.586  20.955 -10.965
  518   3HD2  LEU  72          3HD2      LEU  72 -22.111  21.016  -9.974
  519    H    ILE  73           H        ILE  73 -20.187  19.038 -15.313
  520    HA   ILE  73           HA       ILE  73 -20.107  21.622 -16.767
  521    HB   ILE  73           HB       ILE  73 -20.711  18.879 -17.895
  522   1HG1  ILE  73          2HG1      ILE  73 -18.006  20.197 -18.216
  523   2HG1  ILE  73          3HG1      ILE  73 -18.306  19.154 -16.808
  524   1HG2  ILE  73          1HG2      ILE  73 -21.470  20.983 -19.130
  525   2HG2  ILE  73          2HG2      ILE  73 -19.816  21.522 -19.177
  526   3HG2  ILE  73          3HG2      ILE  73 -20.268  20.034 -20.053
  527   1HD1  ILE  73          1HD1      ILE  73 -17.294  17.899 -18.644
  528   2HD1  ILE  73          2HD1      ILE  73 -18.878  17.268 -18.168
  529   3HD1  ILE  73          3HD1      ILE  73 -18.720  18.237 -19.647
  530    H    ILE  74           H        ILE  74 -21.871  22.753 -16.813
  531    HA   ILE  74           HA       ILE  74 -24.522  21.546 -16.168
  532    HB   ILE  74           HB       ILE  74 -23.614  24.464 -16.134
  533   1HG1  ILE  74          2HG1      ILE  74 -24.209  22.742 -13.675
  534   2HG1  ILE  74          3HG1      ILE  74 -22.560  22.959 -14.290
  535   1HG2  ILE  74          1HG2      ILE  74 -26.011  24.247 -16.533
  536   2HG2  ILE  74          2HG2      ILE  74 -26.189  23.187 -15.137
  537   3HG2  ILE  74          3HG2      ILE  74 -25.749  24.875 -14.915
  538   1HD1  ILE  74          1HD1      ILE  74 -22.817  24.492 -12.543
  539   2HD1  ILE  74          2HD1      ILE  74 -22.808  25.432 -14.042
  540   3HD1  ILE  74          3HD1      ILE  74 -24.352  25.145 -13.160
  541    H    LYS  75           H        LYS  75 -26.184  21.818 -17.531
  542    HA   LYS  75           HA       LYS  75 -25.716  23.188 -20.143
  543   1HB   LYS  75          HB2       LYS  75 -27.191  21.512 -21.211
  544   2HB   LYS  75          HB3       LYS  75 -25.701  20.839 -20.572
  545   1HG   LYS  75          HG2       LYS  75 -26.892  19.956 -18.599
  546   2HG   LYS  75          HG3       LYS  75 -28.405  20.652 -19.205
  547   1HD   LYS  75          HD2       LYS  75 -28.221  19.217 -21.241
  548   2HD   LYS  75          HD3       LYS  75 -26.687  18.569 -20.608
  549   1HE   LYS  75          HE2       LYS  75 -27.957  17.738 -18.599
  550   2HE   LYS  75          HE3       LYS  75 -29.453  18.323 -19.342
  551   1HZ   LYS  75          HZ1       LYS  75 -29.163  15.986 -19.828
  552   2HZ   LYS  75          HZ2       LYS  75 -29.043  16.804 -21.216
  553   3HZ   LYS  75          HZ3       LYS  75 -27.685  16.236 -20.505
  554    H    LYS  76           H        LYS  76 -27.442  24.101 -21.120
  555    HA   LYS  76           HA       LYS  76 -29.042  25.711 -21.161
  556   1HB   LYS  76          HB2       LYS  76 -31.337  24.934 -20.827
  557   2HB   LYS  76          HB3       LYS  76 -30.330  23.867 -21.804
  558   1HG   LYS  76          HG2       LYS  76 -30.139  22.262 -19.987
  559   2HG   LYS  76          HG3       LYS  76 -30.920  23.350 -18.842
  560   1HD   LYS  76          HD2       LYS  76 -32.507  21.660 -19.572
  561   2HD   LYS  76          HD3       LYS  76 -33.002  23.213 -20.249
  562   1HE   LYS  76          HE2       LYS  76 -31.963  22.589 -22.431
  563   2HE   LYS  76          HE3       LYS  76 -31.461  21.043 -21.745
  564   1HZ   LYS  76          HZ1       LYS  76 -34.246  21.924 -22.110
  565   2HZ   LYS  76          HZ2       LYS  76 -33.491  20.780 -22.985
  566   3HZ   LYS  76          HZ3       LYS  76 -33.818  20.517 -21.396
  567    H    VAL  77           H        VAL  77 -27.603  26.754 -19.537
  568    HA   VAL  77           HA       VAL  77 -28.524  27.299 -16.879
  569    HB   VAL  77           HB       VAL  77 -26.752  28.876 -18.803
  570   1HG1  VAL  77          1HG1      VAL  77 -27.551  30.525 -17.159
  571   2HG1  VAL  77          2HG1      VAL  77 -27.195  29.403 -15.815
  572   3HG1  VAL  77          3HG1      VAL  77 -25.897  30.083 -16.782
  573   1HG2  VAL  77          1HG2      VAL  77 -24.952  27.971 -17.331
  574   2HG2  VAL  77          2HG2      VAL  77 -26.160  27.093 -16.415
  575   3HG2  VAL  77          3HG2      VAL  77 -25.868  26.663 -18.110
  576    H    ASP  78           H        ASP  78 -29.705  28.891 -16.020
  577    HA   ASP  78           HA       ASP  78 -30.631  31.191 -17.430
  578   1HB   ASP  78          HB2       ASP  78 -32.296  29.197 -18.047
  579   2HB   ASP  78          HB3       ASP  78 -32.949  29.511 -16.444
  580    H    LYS  79           H        LYS  79 -32.521  32.177 -15.704
  581    HA   LYS  79           HA       LYS  79 -30.878  33.085 -13.544
  582   1HB   LYS  79          HB2       LYS  79 -33.888  33.292 -13.925
  583   2HB   LYS  79          HB3       LYS  79 -32.933  34.205 -12.746
  584   1HG   LYS  79          HG2       LYS  79 -31.696  35.327 -14.555
  585   2HG   LYS  79          HG3       LYS  79 -32.569  34.382 -15.764
  586   1HD   LYS  79          HD2       LYS  79 -33.591  36.529 -15.699
  587   2HD   LYS  79          HD3       LYS  79 -34.722  35.394 -14.956
  588   1HE   LYS  79          HE2       LYS  79 -33.876  36.120 -12.678
  589   2HE   LYS  79          HE3       LYS  79 -32.788  37.270 -13.493
  590   1HZ   LYS  79          HZ1       LYS  79 -34.776  38.348 -12.730
  591   2HZ   LYS  79          HZ2       LYS  79 -34.736  38.416 -14.360
  592   3HZ   LYS  79          HZ3       LYS  79 -35.750  37.349 -13.596
  593    H    SER  80           H        SER  80 -32.947  30.300 -13.644
  594    HA   SER  80           HA       SER  80 -33.226  29.989 -10.775
  595   1HB   SER  80          HB2       SER  80 -34.207  27.796 -11.473
  596   2HB   SER  80          HB3       SER  80 -34.971  29.192 -12.227
  597    HG   SER  80           HG       SER  80 -34.555  27.556 -13.739
  598    H    ASP  81           H        ASP  81 -30.610  29.437 -12.885
  599    HA   ASP  81           HA       ASP  81 -29.578  27.025 -11.554
  600   1HB   ASP  81          HB2       ASP  81 -29.387  27.443 -14.008
  601   2HB   ASP  81          HB3       ASP  81 -28.316  28.820 -13.645
  602    H    GLU  82           H        GLU  82 -29.297  30.434 -11.112
  603    HA   GLU  82           HA       GLU  82 -26.757  30.834  -9.972
  604   1HB   GLU  82          HB2       GLU  82 -28.273  32.609 -10.579
  605   2HB   GLU  82          HB3       GLU  82 -29.434  32.125  -9.358
  606   1HG   GLU  82          HG2       GLU  82 -28.057  32.809  -7.573
  607   2HG   GLU  82          HG3       GLU  82 -26.622  32.891  -8.596
  608    H    ALA  83           H        ALA  83 -25.798  30.407  -7.991
  609    HA   ALA  83           HA       ALA  83 -27.261  29.311  -5.694
  610   1HB   ALA  83          HB1       ALA  83 -25.590  27.575  -7.560
  611   2HB   ALA  83          HB2       ALA  83 -26.127  27.025  -5.966
  612   3HB   ALA  83          HB3       ALA  83 -27.311  27.362  -7.226
  613    H    GLU  84           H        GLU  84 -25.910  28.615  -3.953
  614    HA   GLU  84           HA       GLU  84 -23.103  29.685  -3.959
  615   1HB   GLU  84          HB2       GLU  84 -24.568  30.667  -2.262
  616   2HB   GLU  84          HB3       GLU  84 -24.888  29.057  -1.607
  617   1HG   GLU  84          HG2       GLU  84 -22.521  28.776  -1.057
  618   2HG   GLU  84          HG3       GLU  84 -22.126  30.283  -1.857
  619    H    TYR  85           H        TYR  85 -21.585  28.179  -4.172
  620    HA   TYR  85           HA       TYR  85 -22.331  25.329  -4.169
  621   1HB   TYR  85          HB2       TYR  85 -20.540  27.086  -5.753
  622   2HB   TYR  85          HB3       TYR  85 -20.032  25.437  -5.532
  623    HD1  TYR  85           HD1      TYR  85 -22.854  27.523  -6.881
  624    HD2  TYR  85           HD2      TYR  85 -20.833  23.741  -6.831
  625    HE1  TYR  85           HE1      TYR  85 -24.108  26.813  -8.933
  626    HE2  TYR  85           HE2      TYR  85 -22.086  23.016  -8.833
  627    HH   TYR  85           HH       TYR  85 -24.458  25.177 -10.463
  628    H    ILE  86           H        ILE  86 -22.064  24.939  -1.904
  629    HA   ILE  86           HA       ILE  86 -19.267  25.090  -0.841
  630    HB   ILE  86           HB       ILE  86 -21.794  24.142   0.551
  631   1HG1  ILE  86          2HG1      ILE  86 -20.237  26.741   0.927
  632   2HG1  ILE  86          3HG1      ILE  86 -21.745  26.616   0.030
  633   1HG2  ILE  86          1HG2      ILE  86 -18.939  24.649   1.596
  634   2HG2  ILE  86          2HG2      ILE  86 -20.328  24.203   2.600
  635   3HG2  ILE  86          3HG2      ILE  86 -19.727  23.044   1.446
  636   1HD1  ILE  86          1HD1      ILE  86 -22.291  27.449   2.180
  637   2HD1  ILE  86          2HD1      ILE  86 -22.887  25.776   2.074
  638   3HD1  ILE  86          3HD1      ILE  86 -21.393  26.165   3.011
  639    H    CYS  87           H        CYS  87 -17.968  23.351  -0.818
  640    HA   CYS  87           HA       CYS  87 -19.052  20.696  -1.601
  641   1HB   CYS  87          HB2       CYS  87 -16.891  20.397  -2.921
  642   2HB   CYS  87          HB3       CYS  87 -18.153  21.398  -3.624
  643    H    ILE  88           H        ILE  88 -18.291  18.955  -0.695
  644    HA   ILE  88           HA       ILE  88 -16.262  19.183   1.491
  645    HB   ILE  88           HB       ILE  88 -18.948  17.705   1.575
  646   1HG1  ILE  88          2HG1      ILE  88 -19.232  19.520   3.554
  647   2HG1  ILE  88          3HG1      ILE  88 -18.244  20.497   2.483
  648   1HG2  ILE  88          1HG2      ILE  88 -18.433  17.464   4.013
  649   2HG2  ILE  88          2HG2      ILE  88 -17.228  16.649   3.012
  650   3HG2  ILE  88          3HG2      ILE  88 -16.845  18.218   3.756
  651   1HD1  ILE  88          1HD1      ILE  88 -20.891  19.130   1.738
  652   2HD1  ILE  88          2HD1      ILE  88 -20.695  20.856   2.196
  653   3HD1  ILE  88          3HD1      ILE  88 -19.974  20.243   0.710
  654    H    ALA  89           H        ALA  89 -14.963  17.342   1.783
  655    HA   ALA  89           HA       ALA  89 -15.590  14.906   0.242
  656   1HB   ALA  89          HB1       ALA  89 -14.123  16.382  -1.179
  657   2HB   ALA  89          HB2       ALA  89 -12.899  16.305   0.113
  658   3HB   ALA  89          HB3       ALA  89 -13.378  14.830  -0.776
  659    H    GLU  90           H        GLU  90 -14.521  13.055   0.885
  660    HA   GLU  90           HA       GLU  90 -13.182  12.955   3.550
  661   1HB   GLU  90          HB2       GLU  90 -15.591  12.939   3.928
  662   2HB   GLU  90          HB3       GLU  90 -15.810  11.610   2.784
  663   1HG   GLU  90          HG2       GLU  90 -14.486  10.100   4.263
  664   2HG   GLU  90          HG3       GLU  90 -14.156  11.449   5.333
  665    H    ASN  91           H        ASN  91 -11.860  11.092   3.753
  666    HA   ASN  91           HA       ASN  91 -12.365   8.747   2.114
  667   1HB   ASN  91          HB2       ASN  91 -10.487   8.533   0.816
  668   2HB   ASN  91          HB3       ASN  91 -10.942  10.211   0.592
  669   1HD2  ASN  91          1HD2      ASN  91  -7.260  10.021   0.980
  670   2HD2  ASN  91          2HD2      ASN  91  -8.427   9.226  -0.083
  671    H    LYS  92           H        LYS  92  -9.869   7.452   2.560
  672    HA   LYS  92           HA       LYS  92 -10.341   6.502   5.239
  673   1HB   LYS  92          HB2       LYS  92  -7.944   5.431   3.972
  674   2HB   LYS  92          HB3       LYS  92  -9.388   4.613   4.521
  675   1HG   LYS  92          HG2       LYS  92  -8.920   5.928   1.815
  676   2HG   LYS  92          HG3       LYS  92  -8.892   4.203   2.174
  677   1HD   LYS  92          HD2       LYS  92 -11.296   6.044   1.939
  678   2HD   LYS  92          HD3       LYS  92 -10.919   4.577   1.054
  679   1HE   LYS  92          HE2       LYS  92 -11.211   3.218   3.134
  680   2HE   LYS  92          HE3       LYS  92 -11.641   4.687   4.015
  681   1HZ   LYS  92          HZ1       LYS  92 -13.629   3.541   3.276
  682   2HZ   LYS  92          HZ2       LYS  92 -13.543   4.950   2.452
  683   3HZ   LYS  92          HZ3       LYS  92 -13.154   3.546   1.711
  684    H    ALA  93           H        ALA  93  -8.196   8.797   3.900
  685    HA   ALA  93           HA       ALA  93  -6.299   8.726   6.173
  686   1HB   ALA  93          HB1       ALA  93  -6.215  10.140   3.507
  687   2HB   ALA  93          HB2       ALA  93  -4.905  10.118   4.702
  688   3HB   ALA  93          HB3       ALA  93  -5.389   8.614   3.890
  689    H    GLY  94           H        GLY  94  -9.055  10.627   5.095
  690   1HA   GLY  94          HA2       GLY  94  -8.968  12.359   7.342
  691   2HA   GLY  94          HA3       GLY  94  -8.171  13.190   6.006
  692    H    GLU  95           H        GLU  95  -9.771  14.771   6.299
  693    HA   GLU  95           HA       GLU  95 -12.153  14.520   4.630
  694   1HB   GLU  95          HB2       GLU  95 -12.900  13.738   6.909
  695   2HB   GLU  95          HB3       GLU  95 -12.384  15.297   7.578
  696   1HG   GLU  95          HG2       GLU  95 -14.049  16.439   6.018
  697   2HG   GLU  95          HG3       GLU  95 -14.577  14.826   5.527
  698    H    GLN  96           H        GLN  96 -12.748  16.623   3.771
  699    HA   GLN  96           HA       GLN  96 -11.723  19.099   4.930
  700   1HB   GLN  96          HB2       GLN  96  -9.790  17.842   3.484
  701   2HB   GLN  96          HB3       GLN  96 -10.631  18.675   2.178
  702   1HG   GLN  96          HG2       GLN  96  -8.807  20.015   2.917
  703   2HG   GLN  96          HG3       GLN  96 -10.282  20.825   3.397
  704   1HE2  GLN  96          1HE2      GLN  96  -7.713  19.263   6.251
  705   2HE2  GLN  96          2HE2      GLN  96  -7.601  18.738   4.584
  706    H    ASP  97           H        ASP  97 -12.076  20.994   3.156
  707    HA   ASP  97           HA       ASP  97 -14.428  20.659   1.455
  708   1HB   ASP  97          HB2       ASP  97 -15.926  22.066   2.725
  709   2HB   ASP  97          HB3       ASP  97 -15.497  20.667   3.667
  710    H    ALA  98           H        ALA  98 -15.024  22.435   0.239
  711    HA   ALA  98           HA       ALA  98 -13.521  24.965   0.473
  712   1HB   ALA  98          HB1       ALA  98 -12.990  24.997  -1.950
  713   2HB   ALA  98          HB2       ALA  98 -12.226  23.637  -1.099
  714   3HB   ALA  98          HB3       ALA  98 -13.631  23.361  -2.143
  715    H    THR  99           H        THR  99 -14.421  26.640  -1.163
  716    HA   THR  99           HA       THR  99 -17.386  26.445  -1.448
  717    HB   THR  99           HB       THR  99 -15.887  28.669  -0.015
  718    HG1  THR  99           HG1      THR  99 -17.060  27.936   1.768
  719   1HG2  THR  99          1HG2      THR  99 -17.779  29.650  -1.125
  720   2HG2  THR  99          2HG2      THR  99 -18.830  28.297  -0.635
  721   3HG2  THR  99          3HG2      THR  99 -18.221  29.437   0.585
  722    H    ILE 100           H        ILE 100 -18.233  27.453  -3.116
  723    HA   ILE 100           HA       ILE 100 -16.706  29.351  -4.859
  724    HB   ILE 100           HB       ILE 100 -18.328  26.869  -5.643
  725   1HG1  ILE 100          2HG1      ILE 100 -15.383  27.287  -6.209
  726   2HG1  ILE 100          3HG1      ILE 100 -15.974  26.376  -4.816
  727   1HG2  ILE 100          1HG2      ILE 100 -17.561  27.410  -8.012
  728   2HG2  ILE 100          2HG2      ILE 100 -18.776  28.458  -7.351
  729   3HG2  ILE 100          3HG2      ILE 100 -17.092  28.993  -7.399
  730   1HD1  ILE 100          1HD1      ILE 100 -15.475  24.783  -6.444
  731   2HD1  ILE 100          2HD1      ILE 100 -17.249  24.868  -6.329
  732   3HD1  ILE 100          3HD1      ILE 100 -16.411  25.606  -7.704
  733    H    HIS 101           H        HIS 101 -18.181  30.767  -6.066
  734    HA   HIS 101           HA       HIS 101 -21.096  30.661  -5.369
  735   1HB   HIS 101          HB2       HIS 101 -19.596  33.101  -6.366
  736   2HB   HIS 101          HB3       HIS 101 -21.199  33.038  -5.621
  737    HD1  HIS 101           HD1      HIS 101 -17.709  33.805  -4.834
  738    HD2  HIS 101           HD2      HIS 101 -21.089  32.310  -2.818
  739    HE1  HIS 101           HE1      HIS 101 -17.238  34.091  -2.314
  740    H    LEU 102           H        LEU 102 -22.560  30.667  -7.109
  741    HA   LEU 102           HA       LEU 102 -21.453  31.005  -9.870
  742   1HB   LEU 102          HB2       LEU 102 -21.906  28.652  -9.437
  743   2HB   LEU 102          HB3       LEU 102 -23.583  29.005  -8.992
  744    HG   LEU 102           HG       LEU 102 -23.258  27.988 -11.213
  745   1HD1  LEU 102          1HD1      LEU 102 -25.256  29.395 -10.733
  746   2HD1  LEU 102          2HD1      LEU 102 -24.448  30.749 -11.556
  747   3HD1  LEU 102          3HD1      LEU 102 -24.832  29.273 -12.437
  748   1HD2  LEU 102          1HD2      LEU 102 -21.152  29.100 -11.902
  749   2HD2  LEU 102          2HD2      LEU 102 -22.433  29.276 -13.126
  750   3HD2  LEU 102          3HD2      LEU 102 -22.045  30.637 -12.073
  751    H    LYS 103           H        LYS 103 -22.162  33.016 -10.362
  752    HA   LYS 103           HA       LYS 103 -25.043  33.728  -9.870
  753   1HB   LYS 103          HB2       LYS 103 -22.637  35.474 -10.486
  754   2HB   LYS 103          HB3       LYS 103 -24.321  36.025 -10.492
  755   1HG   LYS 103          HG2       LYS 103 -24.512  35.070  -8.092
  756   2HG   LYS 103          HG3       LYS 103 -22.772  34.908  -8.137
  757   1HD   LYS 103          HD2       LYS 103 -23.437  36.976  -7.007
  758   2HD   LYS 103          HD3       LYS 103 -22.479  37.294  -8.449
  759   1HE   LYS 103          HE2       LYS 103 -24.341  38.896  -8.221
  760   2HE   LYS 103          HE3       LYS 103 -24.442  37.957  -9.712
  761   1HZ   LYS 103          HZ1       LYS 103 -26.594  38.152  -8.555
  762   2HZ   LYS 103          HZ2       LYS 103 -26.167  36.593  -8.727
  763   3HZ   LYS 103          HZ3       LYS 103 -26.033  37.356  -7.268
  764    H    VAL 104           H        VAL 104 -26.272  34.795 -11.496
  765    HA   VAL 104           HA       VAL 104 -25.531  34.143 -14.313
  766    HB   VAL 104           HB       VAL 104 -28.198  33.480 -13.024
  767   1HG1  VAL 104          1HG1      VAL 104 -27.119  32.982 -15.859
  768   2HG1  VAL 104          2HG1      VAL 104 -28.674  32.381 -15.209
  769   3HG1  VAL 104          3HG1      VAL 104 -28.405  34.120 -15.405
  770   1HG2  VAL 104          1HG2      VAL 104 -27.594  31.089 -13.523
  771   2HG2  VAL 104          2HG2      VAL 104 -25.971  31.619 -13.991
  772   3HG2  VAL 104          3HG2      VAL 104 -26.564  31.813 -12.322
  773    H    PHE 105           H        PHE 105 -25.946  35.922 -15.704
  774    HA   PHE 105           HA       PHE 105 -27.632  38.076 -14.606
  775   1HB   PHE 105          HB2       PHE 105 -26.351  39.501 -16.067
  776   2HB   PHE 105          HB3       PHE 105 -25.389  38.753 -14.809
  777    HD1  PHE 105           HD1      PHE 105 -25.911  39.158 -18.418
  778    HD2  PHE 105           HD2      PHE 105 -23.691  37.006 -15.422
  779    HE1  PHE 105           HE1      PHE 105 -24.222  38.532 -20.130
  780    HE2  PHE 105           HE2      PHE 105 -22.004  36.387 -17.120
  781    HZ   PHE 105           HZ       PHE 105 -22.247  37.170 -19.464
  782    H    ALA 106           H        ALA 106 -29.153  39.068 -15.800
  783    HA   ALA 106           HA       ALA 106 -30.450  37.387 -17.830
  784   1HB   ALA 106          HB1       ALA 106 -31.593  38.141 -15.760
  785   2HB   ALA 106          HB2       ALA 106 -31.427  39.837 -16.324
  786   3HB   ALA 106          HB3       ALA 106 -32.419  38.702 -17.232
  787    H    LYS 107           H        LYS 107 -28.219  38.498 -18.901
  788    HA   LYS 107           HA       LYS 107 -27.316  39.684 -20.625
  789   1HB   LYS 107          HB2       LYS 107 -30.199  39.928 -21.606
  790   2HB   LYS 107          HB3       LYS 107 -28.764  40.266 -22.548
  791   1HG   LYS 107          HG2       LYS 107 -28.010  37.941 -22.407
  792   2HG   LYS 107          HG3       LYS 107 -29.351  37.534 -21.350
  793   1HD   LYS 107          HD2       LYS 107 -29.838  36.787 -23.605
  794   2HD   LYS 107          HD3       LYS 107 -30.965  38.095 -23.148
  795   1HE   LYS 107          HE2       LYS 107 -29.559  39.708 -24.442
  796   2HE   LYS 107          HE3       LYS 107 -28.466  38.395 -24.898
  797   1HZ   LYS 107          HZ1       LYS 107 -30.368  37.352 -26.060
  798   2HZ   LYS 107          HZ2       LYS 107 -31.359  38.551 -25.569
  799   3HZ   LYS 107          HZ3       LYS 107 -30.143  38.854 -26.626
  Start of MODEL   11
    1   1H    GLY   1          H1        GLY   1  -7.188   0.875  -7.430
    2   2H    GLY   1          H2        GLY   1  -8.187  -0.252  -6.749
    3   3H    GLY   1          H3        GLY   1  -8.037   1.273  -6.084
    4   1HA   GLY   1          HA2       GLY   1  -5.891  -0.734  -6.234
    5   2HA   GLY   1          HA3       GLY   1  -5.742   0.894  -5.548
    6    H    LYS   2           H        LYS   2  -5.288   0.310  -3.458
    7    HA   LYS   2           HA       LYS   2  -7.522  -0.348  -1.666
    8   1HB   LYS   2          HB2       LYS   2  -6.623  -2.359  -0.699
    9   2HB   LYS   2          HB3       LYS   2  -7.011  -2.627  -2.389
   10   1HG   LYS   2          HG2       LYS   2  -4.649  -2.611  -3.019
   11   2HG   LYS   2          HG3       LYS   2  -4.173  -2.035  -1.440
   12   1HD   LYS   2          HD2       LYS   2  -3.656  -4.365  -1.632
   13   2HD   LYS   2          HD3       LYS   2  -4.829  -4.109  -0.358
   14   1HE   LYS   2          HE2       LYS   2  -5.480  -6.076  -1.517
   15   2HE   LYS   2          HE3       LYS   2  -6.667  -4.826  -1.955
   16   1HZ   LYS   2          HZ1       LYS   2  -5.410  -4.536  -4.049
   17   2HZ   LYS   2          HZ2       LYS   2  -4.350  -5.724  -3.633
   18   3HZ   LYS   2          HZ3       LYS   2  -5.930  -6.052  -3.896
   19    H    ASP   3           H        ASP   3  -6.805  -0.462   0.622
   20    HA   ASP   3           HA       ASP   3  -4.659   1.508   1.194
   21   1HB   ASP   3          HB2       ASP   3  -6.862   1.825   2.200
   22   2HB   ASP   3          HB3       ASP   3  -6.735   0.235   3.013
   23    H    ILE   4           H        ILE   4  -3.076   1.067   2.829
   24    HA   ILE   4           HA       ILE   4  -2.234  -1.763   3.215
   25    HB   ILE   4           HB       ILE   4  -0.507   0.455   2.053
   26   1HG1  ILE   4          2HG1      ILE   4  -2.058  -0.399   0.310
   27   2HG1  ILE   4          3HG1      ILE   4  -0.381  -0.668  -0.035
   28   1HG2  ILE   4          1HG2      ILE   4   0.188  -2.447   2.647
   29   2HG2  ILE   4          2HG2      ILE   4   1.166  -1.348   1.653
   30   3HG2  ILE   4          3HG2      ILE   4   0.912  -0.983   3.355
   31   1HD1  ILE   4          1HD1      ILE   4  -0.535  -3.015   0.456
   32   2HD1  ILE   4          2HD1      ILE   4  -2.199  -2.827   1.043
   33   3HD1  ILE   4          3HD1      ILE   4  -1.838  -2.567  -0.670
   34    H    GLN   5           H        GLN   5  -0.729  -2.005   4.982
   35    HA   GLN   5           HA       GLN   5  -0.893   0.017   7.120
   36   1HB   GLN   5          HB2       GLN   5   0.474  -2.732   7.028
   37   2HB   GLN   5          HB3       GLN   5   0.318  -1.719   8.468
   38   1HG   GLN   5          HG2       GLN   5  -2.198  -1.835   8.230
   39   2HG   GLN   5          HG3       GLN   5  -1.997  -2.893   6.841
   40   1HE2  GLN   5          1HE2      GLN   5  -2.532  -5.452   9.319
   41   2HE2  GLN   5          2HE2      GLN   5  -3.335  -4.507   8.072
   42    H    VAL   6           H        VAL   6   0.422   1.008   4.939
   43    HA   VAL   6           HA       VAL   6   3.057   1.872   5.912
   44    HB   VAL   6           HB       VAL   6   2.689   0.616   3.135
   45   1HG1  VAL   6          1HG1      VAL   6   5.162   1.872   4.410
   46   2HG1  VAL   6          2HG1      VAL   6   5.183   0.909   2.953
   47   3HG1  VAL   6          3HG1      VAL   6   4.300   2.404   2.928
   48   1HG2  VAL   6          1HG2      VAL   6   4.352  -1.041   3.819
   49   2HG2  VAL   6          2HG2      VAL   6   4.354  -0.343   5.480
   50   3HG2  VAL   6          3HG2      VAL   6   2.922  -1.147   4.823
   51    H    ILE   7           H        ILE   7   3.734   3.877   4.619
   52    HA   ILE   7           HA       ILE   7   1.542   5.696   4.283
   53    HB   ILE   7           HB       ILE   7   4.435   6.025   3.404
   54   1HG1  ILE   7          2HG1      ILE   7   3.060   6.783   6.033
   55   2HG1  ILE   7          3HG1      ILE   7   4.290   5.525   5.808
   56   1HG2  ILE   7          1HG2      ILE   7   2.291   8.127   3.973
   57   2HG2  ILE   7          2HG2      ILE   7   3.944   8.428   3.413
   58   3HG2  ILE   7          3HG2      ILE   7   2.788   7.623   2.347
   59   1HD1  ILE   7          1HD1      ILE   7   5.946   7.223   5.118
   60   2HD1  ILE   7          2HD1      ILE   7   4.781   8.507   5.567
   61   3HD1  ILE   7          3HD1      ILE   7   5.390   7.395   6.782
   62    H    VAL   8           H        VAL   8   0.094   5.150   2.817
   63    HA   VAL   8           HA       VAL   8   0.702   5.135  -0.110
   64    HB   VAL   8           HB       VAL   8  -0.795   2.883   1.291
   65   1HG1  VAL   8          1HG1      VAL   8  -0.307   3.408  -1.682
   66   2HG1  VAL   8          2HG1      VAL   8  -0.973   1.900  -1.013
   67   3HG1  VAL   8          3HG1      VAL   8  -1.904   3.382  -0.839
   68   1HG2  VAL   8          1HG2      VAL   8   1.833   2.863  -0.307
   69   2HG2  VAL   8          2HG2      VAL   8   1.640   2.500   1.427
   70   3HG2  VAL   8          3HG2      VAL   8   0.916   1.405   0.247
   71    H    ASN   9           H        ASN   9  -1.718   5.217   2.478
   72    HA   ASN   9           HA       ASN   9  -3.758   6.443   0.757
   73   1HB   ASN   9          HB2       ASN   9  -5.123   6.544   2.783
   74   2HB   ASN   9          HB3       ASN   9  -4.478   4.932   2.520
   75   1HD2  ASN   9          1HD2      ASN   9  -3.615   3.960   4.311
   76   2HD2  ASN   9          2HD2      ASN   9  -2.926   4.844   5.695
   77    H    VAL  10           H        VAL  10  -4.675   8.559   1.341
   78    HA   VAL  10           HA       VAL  10  -2.916  10.583   2.594
   79    HB   VAL  10           HB       VAL  10  -3.736  10.830  -0.342
   80   1HG1  VAL  10          1HG1      VAL  10  -3.762  13.037   0.827
   81   2HG1  VAL  10          2HG1      VAL  10  -2.113  12.735   1.395
   82   3HG1  VAL  10          3HG1      VAL  10  -2.464  12.899  -0.337
   83   1HG2  VAL  10          1HG2      VAL  10  -0.944  10.506   0.846
   84   2HG2  VAL  10          2HG2      VAL  10  -1.761   9.377  -0.228
   85   3HG2  VAL  10          3HG2      VAL  10  -1.299  10.953  -0.829
   86    HA   PRO  11           HA       PRO  11  -7.110  11.967   3.747
   87   1HB   PRO  11          HB2       PRO  11  -5.561  14.532   4.180
   88   2HB   PRO  11          HB3       PRO  11  -6.801  13.745   5.222
   89   1HG   PRO  11          HG2       PRO  11  -4.197  13.490   5.865
   90   2HG   PRO  11          HG3       PRO  11  -5.310  12.074   5.948
   91   1HD   PRO  11          HD2       PRO  11  -3.334  12.762   3.736
   92   2HD   PRO  11          HD3       PRO  11  -3.681  11.180   4.507
   93    HA   PRO  12           HA       PRO  12  -8.391  13.940   0.056
   94   1HB   PRO  12          HB2       PRO  12 -10.801  15.057   0.626
   95   2HB   PRO  12          HB3       PRO  12 -10.524  13.294   0.731
   96   1HG   PRO  12          HG2       PRO  12 -10.539  15.323   2.953
   97   2HG   PRO  12          HG3       PRO  12 -11.300  13.720   2.946
   98   1HD   PRO  12          HD2       PRO  12  -8.795  14.284   4.068
   99   2HD   PRO  12          HD3       PRO  12  -9.271  12.673   3.457
  100    H    SER  13           H        SER  13  -8.674  15.833  -1.129
  101    HA   SER  13           HA       SER  13  -7.925  18.434   0.171
  102   1HB   SER  13          HB2       SER  13  -5.911  17.061  -0.467
  103   2HB   SER  13          HB3       SER  13  -6.397  17.240  -2.159
  104    HG   SER  13           HG       SER  13  -4.941  18.892  -1.496
  105    H    VAL  14           H        VAL  14 -10.408  18.383  -0.475
  106    HA   VAL  14           HA       VAL  14 -10.813  19.212  -3.257
  107    HB   VAL  14           HB       VAL  14 -12.578  17.993  -2.091
  108   1HG1  VAL  14          1HG1      VAL  14 -13.156  20.578  -0.571
  109   2HG1  VAL  14          2HG1      VAL  14 -14.142  19.114  -0.605
  110   3HG1  VAL  14          3HG1      VAL  14 -12.561  19.057   0.153
  111   1HG2  VAL  14          1HG2      VAL  14 -13.028  19.377  -4.085
  112   2HG2  VAL  14          2HG2      VAL  14 -14.424  19.252  -2.997
  113   3HG2  VAL  14          3HG2      VAL  14 -13.477  20.746  -3.020
  114    H    ARG  15           H        ARG  15 -10.853  21.138  -4.066
  115    HA   ARG  15           HA       ARG  15 -10.534  23.631  -2.409
  116   1HB   ARG  15          HB2       ARG  15  -8.849  22.476  -4.659
  117   2HB   ARG  15          HB3       ARG  15  -8.845  24.190  -4.324
  118   1HG   ARG  15          HG2       ARG  15  -7.787  24.020  -2.306
  119   2HG   ARG  15          HG3       ARG  15  -8.324  22.383  -1.973
  120   1HD   ARG  15          HD2       ARG  15  -6.302  23.131  -4.112
  121   2HD   ARG  15          HD3       ARG  15  -5.878  22.584  -2.475
  122    HE   ARG  15           HE       ARG  15  -7.515  20.568  -3.339
  123   1HH1  ARG  15          1HH1      ARG  15  -7.087  18.793  -4.366
  124   2HH1  ARG  15          2HH1      ARG  15  -5.711  18.663  -5.455
  125   1HH2  ARG  15          1HH2      ARG  15  -4.650  21.896  -4.926
  126   2HH2  ARG  15          2HH2      ARG  15  -4.377  20.388  -5.764
  127    H    ALA  16           H        ALA  16 -10.820  25.550  -3.775
  128    HA   ALA  16           HA       ALA  16 -13.077  25.292  -5.668
  129   1HB   ALA  16          HB1       ALA  16 -13.254  27.023  -3.970
  130   2HB   ALA  16          HB2       ALA  16 -11.683  27.678  -4.452
  131   3HB   ALA  16          HB3       ALA  16 -13.053  27.793  -5.557
  132    H    ARG  17           H        ARG  17 -12.578  24.841  -7.751
  133    HA   ARG  17           HA       ARG  17  -9.987  25.326  -8.942
  134   1HB   ARG  17          HB2       ARG  17 -11.701  23.573  -9.640
  135   2HB   ARG  17          HB3       ARG  17 -12.554  24.865 -10.493
  136   1HG   ARG  17          HG2       ARG  17 -10.468  25.294 -11.793
  137   2HG   ARG  17          HG3       ARG  17  -9.666  23.942 -10.967
  138   1HD   ARG  17          HD2       ARG  17 -12.184  23.695 -12.638
  139   2HD   ARG  17          HD3       ARG  17 -10.570  23.467 -13.285
  140    HE   ARG  17           HE       ARG  17 -12.007  21.577 -11.561
  141   1HH1  ARG  17          1HH1      ARG  17  -8.823  22.363 -12.801
  142   2HH1  ARG  17          2HH1      ARG  17  -8.280  20.723 -12.669
  143   1HH2  ARG  17          1HH2      ARG  17 -11.238  19.491 -11.380
  144   2HH2  ARG  17          2HH2      ARG  17  -9.594  19.154 -11.895
  145    H    GLN  18           H        GLN  18 -12.844  27.229  -8.733
  146    HA   GLN  18           HA       GLN  18 -11.433  29.709  -9.188
  147   1HB   GLN  18          HB2       GLN  18 -12.033  29.033 -11.557
  148   2HB   GLN  18          HB3       GLN  18 -13.725  29.176 -11.082
  149   1HG   GLN  18          HG2       GLN  18 -13.347  31.571 -10.463
  150   2HG   GLN  18          HG3       GLN  18 -11.637  31.401 -10.788
  151   1HE2  GLN  18          1HE2      GLN  18 -14.013  32.462 -13.801
  152   2HE2  GLN  18          2HE2      GLN  18 -14.468  32.554 -12.104
  153    H    SER  19           H        SER  19 -12.218  31.017  -7.617
  154    HA   SER  19           HA       SER  19 -14.304  30.056  -5.908
  155   1HB   SER  19          HB2       SER  19 -12.908  32.752  -5.868
  156   2HB   SER  19          HB3       SER  19 -13.787  31.994  -4.521
  157    HG   SER  19           HG       SER  19 -11.514  31.651  -4.384
  158    H    THR  20           H        THR  20 -14.583  32.120  -8.628
  159    HA   THR  20           HA       THR  20 -17.466  32.651  -8.051
  160    HB   THR  20           HB       THR  20 -15.467  34.846  -8.836
  161    HG1  THR  20           HG1      THR  20 -16.022  35.725  -6.882
  162   1HG2  THR  20          1HG2      THR  20 -17.641  35.212  -9.947
  163   2HG2  THR  20          2HG2      THR  20 -18.486  34.948  -8.385
  164   3HG2  THR  20          3HG2      THR  20 -17.444  36.352  -8.614
  165    H    MET  21           H        MET  21 -18.480  31.866  -9.674
  166    HA   MET  21           HA       MET  21 -17.457  32.083 -12.478
  167   1HB   MET  21          HB2       MET  21 -19.061  29.966 -10.987
  168   2HB   MET  21          HB3       MET  21 -19.057  30.058 -12.754
  169   1HG   MET  21          HG2       MET  21 -16.592  29.691 -11.004
  170   2HG   MET  21          HG3       MET  21 -17.440  28.416 -11.834
  171   1HE   MET  21          HE1       MET  21 -17.679  28.307 -14.576
  172   2HE   MET  21          HE2       MET  21 -18.065  30.027 -14.768
  173   3HE   MET  21          HE3       MET  21 -16.708  29.332 -15.665
  174    H    ASN  22           H        ASN  22 -19.049  32.444 -14.105
  175    HA   ASN  22           HA       ASN  22 -21.707  33.518 -13.290
  176   1HB   ASN  22          HB2       ASN  22 -19.612  35.058 -14.929
  177   2HB   ASN  22          HB3       ASN  22 -21.256  35.609 -14.559
  178   1HD2  ASN  22          1HD2      ASN  22 -20.503  36.619 -11.254
  179   2HD2  ASN  22          2HD2      ASN  22 -21.802  35.974 -12.258
  180    H    ALA  23           H        ALA  23 -23.060  33.976 -15.221
  181    HA   ALA  23           HA       ALA  23 -22.411  32.750 -17.774
  182   1HB   ALA  23          HB1       ALA  23 -24.354  31.320 -15.884
  183   2HB   ALA  23          HB2       ALA  23 -24.135  30.931 -17.594
  184   3HB   ALA  23          HB3       ALA  23 -22.799  30.685 -16.467
  185    H    THR  24           H        THR  24 -24.117  32.953 -19.320
  186    HA   THR  24           HA       THR  24 -25.897  35.258 -18.777
  187    HB   THR  24           HB       THR  24 -25.417  33.906 -21.453
  188    HG1  THR  24           HG1      THR  24 -23.739  35.301 -21.792
  189   1HG2  THR  24          1HG2      THR  24 -27.240  35.559 -21.466
  190   2HG2  THR  24          2HG2      THR  24 -26.212  36.744 -20.614
  191   3HG2  THR  24          3HG2      THR  24 -25.834  36.279 -22.283
  192    H    ALA  25           H        ALA  25 -27.965  34.840 -18.189
  193    HA   ALA  25           HA       ALA  25 -29.340  32.354 -18.920
  194   1HB   ALA  25          HB1       ALA  25 -31.222  33.394 -17.627
  195   2HB   ALA  25          HB2       ALA  25 -29.702  33.230 -16.750
  196   3HB   ALA  25          HB3       ALA  25 -30.186  34.825 -17.393
  197    H    ASN  26           H        ASN  26 -31.572  32.410 -19.725
  198    HA   ASN  26           HA       ASN  26 -33.089  32.592 -21.348
  199   1HB   ASN  26          HB2       ASN  26 -33.183  34.982 -20.500
  200   2HB   ASN  26          HB3       ASN  26 -32.145  35.454 -21.834
  201   1HD2  ASN  26          1HD2      ASN  26 -36.021  34.305 -22.673
  202   2HD2  ASN  26          2HD2      ASN  26 -35.229  33.677 -21.234
  203    H    LEU  27           H        LEU  27 -29.903  32.437 -22.038
  204    HA   LEU  27           HA       LEU  27 -30.305  32.002 -24.959
  205   1HB   LEU  27          HB2       LEU  27 -27.766  31.989 -23.247
  206   2HB   LEU  27          HB3       LEU  27 -27.829  31.761 -24.987
  207    HG   LEU  27           HG       LEU  27 -28.543  34.293 -23.502
  208   1HD1  LEU  27          1HD1      LEU  27 -26.233  33.621 -25.378
  209   2HD1  LEU  27          2HD1      LEU  27 -26.501  35.169 -24.543
  210   3HD1  LEU  27          3HD1      LEU  27 -26.128  33.718 -23.611
  211   1HD2  LEU  27          1HD2      LEU  27 -29.921  34.108 -25.532
  212   2HD2  LEU  27          2HD2      LEU  27 -28.661  35.341 -25.769
  213   3HD2  LEU  27          3HD2      LEU  27 -28.486  33.727 -26.496
  214    H    SER  28           H        SER  28 -30.587  30.231 -22.123
  215    HA   SER  28           HA       SER  28 -30.479  28.012 -21.543
  216   1HB   SER  28          HB2       SER  28 -31.068  27.483 -24.466
  217   2HB   SER  28          HB3       SER  28 -31.288  26.350 -23.130
  218    HG   SER  28           HG       SER  28 -32.791  27.817 -22.214
  219    H    GLN  29           H        GLN  29 -28.001  29.145 -21.773
  220    HA   GLN  29           HA       GLN  29 -26.274  27.850 -23.634
  221   1HB   GLN  29          HB2       GLN  29 -26.096  30.178 -22.557
  222   2HB   GLN  29          HB3       GLN  29 -25.540  29.378 -21.089
  223   1HG   GLN  29          HG2       GLN  29 -23.752  30.393 -22.498
  224   2HG   GLN  29          HG3       GLN  29 -23.490  28.694 -22.169
  225   1HE2  GLN  29          1HE2      GLN  29 -23.993  29.910 -26.043
  226   2HE2  GLN  29          2HE2      GLN  29 -24.219  31.074 -24.743
  227    H    SER  30           H        SER  30 -24.177  26.897 -22.881
  228    HA   SER  30           HA       SER  30 -24.525  24.852 -20.725
  229   1HB   SER  30          HB2       SER  30 -23.057  24.507 -23.389
  230   2HB   SER  30          HB3       SER  30 -23.022  23.357 -22.023
  231    HG   SER  30           HG       SER  30 -24.623  22.875 -23.654
  232    H    VAL  31           H        VAL  31 -22.953  24.649 -19.258
  233    HA   VAL  31           HA       VAL  31 -20.486  26.325 -19.491
  234    HB   VAL  31           HB       VAL  31 -22.517  26.751 -17.261
  235   1HG1  VAL  31          1HG1      VAL  31 -20.219  27.103 -16.448
  236   2HG1  VAL  31          2HG1      VAL  31 -19.869  28.173 -17.814
  237   3HG1  VAL  31          3HG1      VAL  31 -21.056  28.631 -16.575
  238   1HG2  VAL  31          1HG2      VAL  31 -22.751  29.040 -18.132
  239   2HG2  VAL  31          2HG2      VAL  31 -21.773  28.614 -19.552
  240   3HG2  VAL  31          3HG2      VAL  31 -23.364  27.850 -19.260
  241    H    THR  32           H        THR  32 -18.766  25.523 -18.299
  242    HA   THR  32           HA       THR  32 -19.235  23.199 -16.488
  243    HB   THR  32           HB       THR  32 -16.607  24.006 -17.819
  244    HG1  THR  32           HG1      THR  32 -17.077  22.521 -19.348
  245   1HG2  THR  32          1HG2      THR  32 -16.038  21.600 -17.375
  246   2HG2  THR  32          2HG2      THR  32 -16.274  22.514 -15.880
  247   3HG2  THR  32          3HG2      THR  32 -17.551  21.445 -16.462
  248    H    LEU  33           H        LEU  33 -18.400  23.220 -14.432
  249    HA   LEU  33           HA       LEU  33 -16.451  25.143 -13.495
  250   1HB   LEU  33          HB2       LEU  33 -17.874  26.079 -11.697
  251   2HB   LEU  33          HB3       LEU  33 -18.274  26.576 -13.330
  252    HG   LEU  33           HG       LEU  33 -20.176  24.875 -13.307
  253   1HD1  LEU  33          1HD1      LEU  33 -19.615  23.491 -11.451
  254   2HD1  LEU  33          2HD1      LEU  33 -19.493  24.870 -10.326
  255   3HD1  LEU  33          3HD1      LEU  33 -21.068  24.364 -11.027
  256   1HD2  LEU  33          1HD2      LEU  33 -20.161  27.185 -11.339
  257   2HD2  LEU  33          2HD2      LEU  33 -20.468  27.305 -13.084
  258   3HD2  LEU  33          3HD2      LEU  33 -21.614  26.438 -12.026
  259    H    ALA  34           H        ALA  34 -15.951  24.691 -11.034
  260    HA   ALA  34           HA       ALA  34 -16.484  21.887 -10.313
  261   1HB   ALA  34          HB1       ALA  34 -14.854  21.902 -12.306
  262   2HB   ALA  34          HB2       ALA  34 -13.742  22.767 -11.282
  263   3HB   ALA  34          HB3       ALA  34 -14.214  21.119 -10.845
  264    H    CYS  35           H        CYS  35 -15.733  21.140  -8.445
  265    HA   CYS  35           HA       CYS  35 -14.013  22.856  -6.669
  266   1HB   CYS  35          HB2       CYS  35 -16.197  20.865  -6.037
  267   2HB   CYS  35          HB3       CYS  35 -14.873  21.173  -4.920
  268    H    ASP  36           H        ASP  36 -11.958  22.185  -7.257
  269    HA   ASP  36           HA       ASP  36 -11.457  19.580  -8.410
  270   1HB   ASP  36          HB2       ASP  36  -9.248  20.280  -8.783
  271   2HB   ASP  36          HB3       ASP  36 -10.356  21.556  -9.235
  272    H    ALA  37           H        ALA  37 -11.460  17.809  -7.322
  273    HA   ALA  37           HA       ALA  37 -10.465  17.709  -4.543
  274   1HB   ALA  37          HB1       ALA  37 -12.355  15.857  -6.038
  275   2HB   ALA  37          HB2       ALA  37 -11.913  15.771  -4.312
  276   3HB   ALA  37          HB3       ALA  37 -12.827  17.146  -4.905
  277    H    ASP  38           H        ASP  38  -9.305  16.029  -3.762
  278    HA   ASP  38           HA       ASP  38  -8.126  13.959  -5.469
  279   1HB   ASP  38          HB2       ASP  38  -6.704  15.944  -5.941
  280   2HB   ASP  38          HB3       ASP  38  -6.476  16.176  -4.196
  281    H    GLY  39           H        GLY  39  -6.774  12.448  -4.082
  282   1HA   GLY  39          HA2       GLY  39  -6.296  12.360  -1.393
  283   2HA   GLY  39          HA3       GLY  39  -8.009  11.917  -1.472
  284    H    PHE  40           H        PHE  40  -6.009  10.106  -0.565
  285    HA   PHE  40           HA       PHE  40  -6.131   8.037  -2.726
  286   1HB   PHE  40          HB2       PHE  40  -3.667   8.804  -1.152
  287   2HB   PHE  40          HB3       PHE  40  -3.849   7.250  -1.896
  288    HD1  PHE  40           HD1      PHE  40  -3.746   6.904  -4.283
  289    HD2  PHE  40           HD2      PHE  40  -3.497  10.858  -2.598
  290    HE1  PHE  40           HE1      PHE  40  -3.066   7.787  -6.481
  291    HE2  PHE  40           HE2      PHE  40  -2.768  11.749  -4.814
  292    HZ   PHE  40           HZ       PHE  40  -2.550  10.215  -6.754
  293    HA   PRO  41           HA       PRO  41  -5.241   5.772  -2.714
  294   1HB   PRO  41          HB2       PRO  41  -7.181   3.503  -2.380
  295   2HB   PRO  41          HB3       PRO  41  -5.430   3.452  -2.769
  296   1HG   PRO  41          HG2       PRO  41  -6.317   2.829  -0.259
  297   2HG   PRO  41          HG3       PRO  41  -4.847   3.845  -0.493
  298   1HD   PRO  41          HD2       PRO  41  -7.665   4.774   0.062
  299   2HD   PRO  41          HD3       PRO  41  -6.152   5.209   0.911
  300    H    GLU  42           H        GLU  42  -8.176   6.668  -2.034
  301    HA   GLU  42           HA       GLU  42  -8.751   7.845  -4.648
  302   1HB   GLU  42          HB2       GLU  42 -10.626   5.871  -3.261
  303   2HB   GLU  42          HB3       GLU  42 -11.226   6.991  -4.482
  304   1HG   GLU  42          HG2       GLU  42  -9.636   5.995  -6.135
  305   2HG   GLU  42          HG3       GLU  42  -9.308   4.703  -4.945
  306    HA   PRO  43           HA       PRO  43 -10.852  10.612  -1.663
  307   1HB   PRO  43          HB2       PRO  43 -11.856  12.520  -3.283
  308   2HB   PRO  43          HB3       PRO  43 -10.107  12.290  -3.067
  309   1HG   PRO  43          HG2       PRO  43 -11.849  11.302  -5.360
  310   2HG   PRO  43          HG3       PRO  43 -10.230  12.091  -5.472
  311   1HD   PRO  43          HD2       PRO  43 -10.675   9.339  -5.512
  312   2HD   PRO  43          HD3       PRO  43  -9.142  10.105  -4.999
  313    H    THR  44           H        THR  44 -13.043  11.329  -1.117
  314    HA   THR  44           HA       THR  44 -15.353  10.314  -2.691
  315    HB   THR  44           HB       THR  44 -15.031   9.951   0.289
  316    HG1  THR  44           HG1      THR  44 -15.056   7.734  -0.221
  317   1HG2  THR  44          1HG2      THR  44 -17.111   8.594   0.101
  318   2HG2  THR  44          2HG2      THR  44 -17.399  10.286  -0.332
  319   3HG2  THR  44          3HG2      THR  44 -17.232   9.077  -1.621
  320    H    MET  45           H        MET  45 -16.923  12.009  -2.855
  321    HA   MET  45           HA       MET  45 -16.958  14.180  -0.891
  322   1HB   MET  45          HB2       MET  45 -16.233  15.876  -2.434
  323   2HB   MET  45          HB3       MET  45 -14.986  14.661  -2.343
  324   1HG   MET  45          HG2       MET  45 -15.000  14.865  -4.611
  325   2HG   MET  45          HG3       MET  45 -16.285  13.687  -4.470
  326   1HE   MET  45          HE1       MET  45 -15.136  17.148  -5.469
  327   2HE   MET  45          HE2       MET  45 -16.606  18.145  -5.547
  328   3HE   MET  45          HE3       MET  45 -15.945  17.616  -3.966
  329    H    THR  46           H        THR  46 -18.548  15.816  -1.266
  330    HA   THR  46           HA       THR  46 -20.563  15.501  -3.375
  331    HB   THR  46           HB       THR  46 -22.453  15.668  -1.710
  332    HG1  THR  46           HG1      THR  46 -22.131  15.029   0.392
  333   1HG2  THR  46          1HG2      THR  46 -21.952  13.543  -2.852
  334   2HG2  THR  46          2HG2      THR  46 -20.945  13.066  -1.441
  335   3HG2  THR  46          3HG2      THR  46 -22.704  13.359  -1.262
  336    H    TRP  47           H        TRP  47 -22.221  17.373  -3.183
  337    HA   TRP  47           HA       TRP  47 -21.368  19.702  -1.689
  338   1HB   TRP  47          HB2       TRP  47 -20.864  21.108  -3.667
  339   2HB   TRP  47          HB3       TRP  47 -19.693  19.891  -3.245
  340    HD1  TRP  47           HD1      TRP  47 -19.778  17.546  -4.772
  341    HE1  TRP  47           HE1      TRP  47 -19.154  17.642  -7.254
  342    HE3  TRP  47           HE3      TRP  47 -21.218  22.380  -5.777
  343    HZ2  TRP  47           HZ2      TRP  47 -18.851  19.681  -9.267
  344    HZ3  TRP  47           HZ3      TRP  47 -20.671  23.382  -7.985
  345    HH2  TRP  47           HH2      TRP  47 -19.506  22.043  -9.724
  346    H    THR  48           H        THR  48 -22.599  21.641  -2.047
  347    HA   THR  48           HA       THR  48 -25.438  20.944  -2.691
  348    HB   THR  48           HB       THR  48 -26.154  22.134  -0.742
  349    HG1  THR  48           HG1      THR  48 -24.665  23.019   0.708
  350   1HG2  THR  48          1HG2      THR  48 -25.314  20.731   1.051
  351   2HG2  THR  48          2HG2      THR  48 -25.342  19.742  -0.438
  352   3HG2  THR  48          3HG2      THR  48 -23.813  20.393   0.149
  353    H    LYS  49           H        LYS  49 -26.872  22.639  -3.125
  354    HA   LYS  49           HA       LYS  49 -25.723  24.898  -4.670
  355   1HB   LYS  49          HB2       LYS  49 -27.376  23.143  -5.550
  356   2HB   LYS  49          HB3       LYS  49 -28.609  23.925  -4.560
  357   1HG   LYS  49          HG2       LYS  49 -28.152  26.098  -5.802
  358   2HG   LYS  49          HG3       LYS  49 -26.980  25.213  -6.791
  359   1HD   LYS  49          HD2       LYS  49 -28.711  23.641  -7.552
  360   2HD   LYS  49          HD3       LYS  49 -29.928  24.489  -6.591
  361   1HE   LYS  49          HE2       LYS  49 -28.321  25.715  -8.884
  362   2HE   LYS  49          HE3       LYS  49 -29.922  25.005  -9.038
  363   1HZ   LYS  49          HZ1       LYS  49 -30.389  27.248  -8.766
  364   2HZ   LYS  49          HZ2       LYS  49 -30.628  26.698  -7.263
  365   3HZ   LYS  49          HZ3       LYS  49 -29.241  27.512  -7.628
  366    H    ASP  50           H        ASP  50 -25.206  25.572  -2.265
  367    HA   ASP  50           HA       ASP  50 -25.396  26.971  -0.523
  368   1HB   ASP  50          HB2       ASP  50 -26.040  28.616  -2.215
  369   2HB   ASP  50          HB3       ASP  50 -27.742  28.218  -1.952
  370    H    GLY  51           H        GLY  51 -28.173  24.999  -1.195
  371   1HA   GLY  51          HA2       GLY  51 -28.591  24.564   1.691
  372   2HA   GLY  51          HA3       GLY  51 -29.921  25.400   0.862
  373    H    GLU  52           H        GLU  52 -28.514  23.031  -1.248
  374    HA   GLU  52           HA       GLU  52 -29.823  20.708  -0.156
  375   1HB   GLU  52          HB2       GLU  52 -31.436  20.292  -1.893
  376   2HB   GLU  52          HB3       GLU  52 -31.813  21.792  -1.060
  377   1HG   GLU  52          HG2       GLU  52 -30.794  23.081  -2.951
  378   2HG   GLU  52          HG3       GLU  52 -30.464  21.566  -3.787
  379    HA   PRO  53           HA       PRO  53 -26.589  18.898  -2.296
  380   1HB   PRO  53          HB2       PRO  53 -28.182  16.433  -2.891
  381   2HB   PRO  53          HB3       PRO  53 -26.638  16.598  -2.031
  382   1HG   PRO  53          HG2       PRO  53 -28.935  16.181  -0.663
  383   2HG   PRO  53          HG3       PRO  53 -27.754  17.363  -0.037
  384   1HD   PRO  53          HD2       PRO  53 -30.241  17.920  -1.684
  385   2HD   PRO  53          HD3       PRO  53 -29.679  18.693  -0.195
  386    H    ILE  54           H        ILE  54 -25.519  18.602  -4.157
  387    HA   ILE  54           HA       ILE  54 -26.996  18.342  -6.735
  388    HB   ILE  54           HB       ILE  54 -24.163  19.390  -6.368
  389   1HG1  ILE  54          2HG1      ILE  54 -26.529  21.263  -6.755
  390   2HG1  ILE  54          3HG1      ILE  54 -26.006  20.868  -5.142
  391   1HG2  ILE  54          1HG2      ILE  54 -24.671  18.825  -8.692
  392   2HG2  ILE  54          2HG2      ILE  54 -26.208  19.701  -8.617
  393   3HG2  ILE  54          3HG2      ILE  54 -24.675  20.580  -8.574
  394   1HD1  ILE  54          1HD1      ILE  54 -25.002  22.967  -5.934
  395   2HD1  ILE  54          2HD1      ILE  54 -23.800  21.736  -5.466
  396   3HD1  ILE  54          3HD1      ILE  54 -24.100  22.051  -7.178
  397    H    GLU  55           H        GLU  55 -26.329  16.327  -4.849
  398    HA   GLU  55           HA       GLU  55 -24.288  14.592  -4.993
  399   1HB   GLU  55          HB2       GLU  55 -25.921  12.731  -4.768
  400   2HB   GLU  55          HB3       GLU  55 -26.038  14.049  -3.582
  401   1HG   GLU  55          HG2       GLU  55 -28.015  14.933  -4.918
  402   2HG   GLU  55          HG3       GLU  55 -27.938  13.456  -5.897
  403    H    GLN  56           H        GLN  56 -23.077  14.517  -6.836
  404    HA   GLN  56           HA       GLN  56 -24.021  14.128  -9.400
  405   1HB   GLN  56          HB2       GLN  56 -21.269  13.475  -8.227
  406   2HB   GLN  56          HB3       GLN  56 -21.632  13.659  -9.954
  407   1HG   GLN  56          HG2       GLN  56 -22.319  16.015  -9.554
  408   2HG   GLN  56          HG3       GLN  56 -21.911  15.844  -7.845
  409   1HE2  GLN  56          1HE2      GLN  56 -18.333  15.770  -8.502
  410   2HE2  GLN  56          2HE2      GLN  56 -19.552  15.128  -7.406
  411    H    GLU  57           H        GLU  57 -23.984  11.703  -7.060
  412    HA   GLU  57           HA       GLU  57 -23.598   9.411  -8.888
  413   1HB   GLU  57          HB2       GLU  57 -24.127   9.706  -5.907
  414   2HB   GLU  57          HB3       GLU  57 -24.025   8.131  -6.712
  415   1HG   GLU  57          HG2       GLU  57 -21.758  10.172  -6.678
  416   2HG   GLU  57          HG3       GLU  57 -21.935   8.815  -5.545
  417    H    ASP  58           H        ASP  58 -26.207  11.422  -8.106
  418    HA   ASP  58           HA       ASP  58 -28.172   9.433  -9.127
  419   1HB   ASP  58          HB2       ASP  58 -28.043   9.141  -6.608
  420   2HB   ASP  58          HB3       ASP  58 -28.538  10.815  -6.454
  421    H    ASN  59           H        ASN  59 -27.375  12.783  -8.258
  422    HA   ASN  59           HA       ASN  59 -29.780  13.750  -9.753
  423   1HB   ASN  59          HB2       ASN  59 -27.704  15.196  -8.052
  424   2HB   ASN  59          HB3       ASN  59 -28.864  16.007  -9.125
  425   1HD2  ASN  59          1HD2      ASN  59 -30.566  16.169  -5.970
  426   2HD2  ASN  59          2HD2      ASN  59 -29.251  16.960  -6.799
  427    H    GLU  60           H        GLU  60 -29.761  14.380 -11.746
  428    HA   GLU  60           HA       GLU  60 -27.284  15.123 -13.242
  429   1HB   GLU  60          HB2       GLU  60 -29.146  12.793 -13.907
  430   2HB   GLU  60          HB3       GLU  60 -27.908  13.448 -14.990
  431   1HG   GLU  60          HG2       GLU  60 -26.181  12.890 -13.260
  432   2HG   GLU  60          HG3       GLU  60 -27.415  12.020 -12.365
  433    H    GLU  61           H        GLU  61 -30.208  16.067 -12.440
  434    HA   GLU  61           HA       GLU  61 -32.127  16.295 -14.165
  435   1HB   GLU  61          HB2       GLU  61 -31.087  18.802 -12.838
  436   2HB   GLU  61          HB3       GLU  61 -32.744  18.424 -13.244
  437   1HG   GLU  61          HG2       GLU  61 -31.050  17.238 -11.023
  438   2HG   GLU  61          HG3       GLU  61 -32.554  18.136 -10.888
  439    H    LYS  62           H        LYS  62 -29.320  18.388 -14.673
  440    HA   LYS  62           HA       LYS  62 -29.631  18.229 -17.557
  441   1HB   LYS  62          HB2       LYS  62 -29.780  20.624 -18.066
  442   2HB   LYS  62          HB3       LYS  62 -31.231  19.997 -17.271
  443   1HG   LYS  62          HG2       LYS  62 -30.360  21.053 -15.071
  444   2HG   LYS  62          HG3       LYS  62 -29.073  21.763 -16.033
  445   1HD   LYS  62          HD2       LYS  62 -30.929  22.712 -17.551
  446   2HD   LYS  62          HD3       LYS  62 -32.063  22.256 -16.260
  447   1HE   LYS  62          HE2       LYS  62 -30.692  23.540 -14.638
  448   2HE   LYS  62          HE3       LYS  62 -29.577  23.969 -15.941
  449   1HZ   LYS  62          HZ1       LYS  62 -32.378  24.871 -15.721
  450   2HZ   LYS  62          HZ2       LYS  62 -30.994  25.783 -15.545
  451   3HZ   LYS  62          HZ3       LYS  62 -31.398  25.190 -17.013
  452    H    TYR  63           H        TYR  63 -27.746  17.196 -15.988
  453    HA   TYR  63           HA       TYR  63 -25.296  18.543 -16.757
  454   1HB   TYR  63          HB2       TYR  63 -24.509  18.803 -14.346
  455   2HB   TYR  63          HB3       TYR  63 -25.617  19.983 -14.957
  456    HD1  TYR  63           HD1      TYR  63 -27.645  20.448 -13.951
  457    HD2  TYR  63           HD2      TYR  63 -25.409  16.977 -12.708
  458    HE1  TYR  63           HE1      TYR  63 -29.094  20.253 -11.952
  459    HE2  TYR  63           HE2      TYR  63 -26.830  16.818 -10.669
  460    HH   TYR  63           HH       TYR  63 -29.475  19.141  -9.974
  461    H    SER  64           H        SER  64 -23.369  17.563 -16.198
  462    HA   SER  64           HA       SER  64 -23.232  14.929 -14.990
  463   1HB   SER  64          HB2       SER  64 -22.517  13.725 -16.987
  464   2HB   SER  64          HB3       SER  64 -24.186  14.308 -17.152
  465    HG   SER  64           HG       SER  64 -22.893  14.670 -19.049
  466    H    PHE  65           H        PHE  65 -20.955  14.009 -15.118
  467    HA   PHE  65           HA       PHE  65 -18.908  16.130 -15.321
  468   1HB   PHE  65          HB2       PHE  65 -18.373  15.728 -13.076
  469   2HB   PHE  65          HB3       PHE  65 -20.136  15.907 -13.176
  470    HD1  PHE  65           HD1      PHE  65 -21.581  13.731 -13.115
  471    HD2  PHE  65           HD2      PHE  65 -17.400  13.819 -12.054
  472    HE1  PHE  65           HE1      PHE  65 -21.800  11.512 -12.045
  473    HE2  PHE  65           HE2      PHE  65 -17.658  11.588 -10.948
  474    HZ   PHE  65           HZ       PHE  65 -19.858  10.431 -10.968
  475    H    ASN  66           H        ASN  66 -16.729  14.996 -14.318
  476    HA   ASN  66           HA       ASN  66 -16.185  12.422 -15.711
  477   1HB   ASN  66          HB2       ASN  66 -14.271  13.408 -16.885
  478   2HB   ASN  66          HB3       ASN  66 -15.798  14.099 -17.391
  479   1HD2  ASN  66          1HD2      ASN  66 -13.205  16.616 -15.385
  480   2HD2  ASN  66          2HD2      ASN  66 -13.396  15.015 -14.665
  481    H    TYR  67           H        TYR  67 -13.705  12.032 -15.525
  482    HA   TYR  67           HA       TYR  67 -12.816  11.098 -13.172
  483   1HB   TYR  67          HB2       TYR  67 -10.501  11.512 -14.070
  484   2HB   TYR  67          HB3       TYR  67 -11.628  10.616 -15.073
  485    HD1  TYR  67           HD1      TYR  67 -12.221  11.336 -17.279
  486    HD2  TYR  67           HD2      TYR  67 -10.036  14.019 -14.681
  487    HE1  TYR  67           HE1      TYR  67 -11.903  12.899 -19.168
  488    HE2  TYR  67           HE2      TYR  67  -9.687  15.556 -16.586
  489    HH   TYR  67           HH       TYR  67 -10.063  15.969 -18.785
  490    H    ASP  68           H        ASP  68 -11.546  11.633 -11.506
  491    HA   ASP  68           HA       ASP  68 -10.827  12.718  -9.649
  492   1HB   ASP  68          HB2       ASP  68 -10.784  15.300 -11.229
  493   2HB   ASP  68          HB3       ASP  68 -10.182  15.040  -9.604
  494    H    GLY  69           H        GLY  69 -13.808  13.341 -11.168
  495   1HA   GLY  69          HA2       GLY  69 -15.881  13.412 -10.166
  496   2HA   GLY  69          HA3       GLY  69 -15.123  13.501  -8.578
  497    H    SER  70           H        SER  70 -13.884  15.947 -10.559
  498    HA   SER  70           HA       SER  70 -15.336  17.927  -8.892
  499   1HB   SER  70          HB2       SER  70 -13.516  19.405  -9.366
  500   2HB   SER  70          HB3       SER  70 -12.934  17.844  -8.767
  501    HG   SER  70           HG       SER  70 -12.174  17.363 -10.768
  502    H    GLU  71           H        GLU  71 -14.752  17.484 -12.412
  503    HA   GLU  71           HA       GLU  71 -15.824  20.161 -12.930
  504   1HB   GLU  71          HB2       GLU  71 -14.844  18.015 -14.801
  505   2HB   GLU  71          HB3       GLU  71 -15.375  19.620 -15.297
  506   1HG   GLU  71          HG2       GLU  71 -13.559  20.664 -14.028
  507   2HG   GLU  71          HG3       GLU  71 -13.088  19.110 -13.342
  508    H    LEU  72           H        LEU  72 -17.878  20.376 -12.426
  509    HA   LEU  72           HA       LEU  72 -19.949  18.568 -13.499
  510   1HB   LEU  72          HB2       LEU  72 -20.107  19.421 -11.196
  511   2HB   LEU  72          HB3       LEU  72 -20.072  21.077 -11.807
  512    HG   LEU  72           HG       LEU  72 -22.243  20.617 -13.017
  513   1HD1  LEU  72          1HD1      LEU  72 -22.102  18.021 -11.423
  514   2HD1  LEU  72          2HD1      LEU  72 -23.563  18.655 -12.176
  515   3HD1  LEU  72          3HD1      LEU  72 -22.203  18.203 -13.203
  516   1HD2  LEU  72          1HD2      LEU  72 -23.660  20.774 -11.032
  517   2HD2  LEU  72          2HD2      LEU  72 -22.325  20.190 -10.012
  518   3HD2  LEU  72          3HD2      LEU  72 -22.200  21.741 -10.814
  519    H    ILE  73           H        ILE  73 -20.598  18.832 -15.495
  520    HA   ILE  73           HA       ILE  73 -20.519  21.479 -16.860
  521    HB   ILE  73           HB       ILE  73 -21.095  18.775 -18.023
  522   1HG1  ILE  73          2HG1      ILE  73 -18.402  20.103 -18.424
  523   2HG1  ILE  73          3HG1      ILE  73 -18.664  19.065 -17.023
  524   1HG2  ILE  73          1HG2      ILE  73 -20.571  20.027 -20.184
  525   2HG2  ILE  73          2HG2      ILE  73 -21.956  20.697 -19.304
  526   3HG2  ILE  73          3HG2      ILE  73 -20.394  21.488 -19.233
  527   1HD1  ILE  73          1HD1      ILE  73 -19.118  18.119 -19.855
  528   2HD1  ILE  73          2HD1      ILE  73 -17.664  17.841 -18.867
  529   3HD1  ILE  73          3HD1      ILE  73 -19.217  17.180 -18.346
  530    H    ILE  74           H        ILE  74 -22.360  22.577 -16.939
  531    HA   ILE  74           HA       ILE  74 -24.990  21.175 -16.600
  532    HB   ILE  74           HB       ILE  74 -24.344  24.086 -16.075
  533   1HG1  ILE  74          2HG1      ILE  74 -24.855  21.934 -13.945
  534   2HG1  ILE  74          3HG1      ILE  74 -23.236  22.470 -14.406
  535   1HG2  ILE  74          1HG2      ILE  74 -26.579  24.109 -14.922
  536   2HG2  ILE  74          2HG2      ILE  74 -26.727  23.738 -16.638
  537   3HG2  ILE  74          3HG2      ILE  74 -26.836  22.429 -15.435
  538   1HD1  ILE  74          1HD1      ILE  74 -23.812  23.606 -12.440
  539   2HD1  ILE  74          2HD1      ILE  74 -23.806  24.787 -13.744
  540   3HD1  ILE  74          3HD1      ILE  74 -25.337  24.209 -13.102
  541    H    LYS  75           H        LYS  75 -26.581  21.567 -18.011
  542    HA   LYS  75           HA       LYS  75 -26.053  23.381 -20.322
  543   1HB   LYS  75          HB2       LYS  75 -27.185  21.827 -21.812
  544   2HB   LYS  75          HB3       LYS  75 -25.697  21.157 -21.182
  545   1HG   LYS  75          HG2       LYS  75 -26.940  19.759 -19.592
  546   2HG   LYS  75          HG3       LYS  75 -28.473  20.516 -20.085
  547   1HD   LYS  75          HD2       LYS  75 -28.264  18.346 -21.081
  548   2HD   LYS  75          HD3       LYS  75 -28.184  19.580 -22.356
  549   1HE   LYS  75          HE2       LYS  75 -25.689  19.381 -22.393
  550   2HE   LYS  75          HE3       LYS  75 -25.776  18.147 -21.136
  551   1HZ   LYS  75          HZ1       LYS  75 -27.041  16.752 -22.673
  552   2HZ   LYS  75          HZ2       LYS  75 -27.002  17.900 -23.832
  553   3HZ   LYS  75          HZ3       LYS  75 -25.621  17.129 -23.361
  554    H    LYS  76           H        LYS  76 -27.752  24.316 -21.199
  555    HA   LYS  76           HA       LYS  76 -29.736  25.458 -21.383
  556   1HB   LYS  76          HB2       LYS  76 -31.164  23.493 -19.575
  557   2HB   LYS  76          HB3       LYS  76 -31.836  24.564 -20.799
  558   1HG   LYS  76          HG2       LYS  76 -30.396  23.171 -22.500
  559   2HG   LYS  76          HG3       LYS  76 -30.297  21.989 -21.173
  560   1HD   LYS  76          HD2       LYS  76 -32.852  23.121 -22.405
  561   2HD   LYS  76          HD3       LYS  76 -32.165  21.551 -22.792
  562   1HE   LYS  76          HE2       LYS  76 -33.043  22.327 -19.939
  563   2HE   LYS  76          HE3       LYS  76 -34.143  21.636 -21.147
  564   1HZ   LYS  76          HZ1       LYS  76 -32.763  19.686 -21.277
  565   2HZ   LYS  76          HZ2       LYS  76 -31.671  20.289 -20.241
  566   3HZ   LYS  76          HZ3       LYS  76 -33.192  19.918 -19.739
  567    H    VAL  77           H        VAL  77 -27.909  26.470 -19.700
  568    HA   VAL  77           HA       VAL  77 -28.786  26.952 -17.065
  569    HB   VAL  77           HB       VAL  77 -26.785  28.371 -18.827
  570   1HG1  VAL  77          1HG1      VAL  77 -27.401  30.028 -17.083
  571   2HG1  VAL  77          2HG1      VAL  77 -27.278  28.784 -15.828
  572   3HG1  VAL  77          3HG1      VAL  77 -25.833  29.336 -16.712
  573   1HG2  VAL  77          1HG2      VAL  77 -26.202  26.023 -18.198
  574   2HG2  VAL  77          2HG2      VAL  77 -25.155  27.147 -17.312
  575   3HG2  VAL  77          3HG2      VAL  77 -26.544  26.382 -16.511
  576    H    ASP  78           H        ASP  78 -29.921  28.468 -16.078
  577    HA   ASP  78           HA       ASP  78 -30.686  31.017 -17.337
  578   1HB   ASP  78          HB2       ASP  78 -32.626  28.796 -16.601
  579   2HB   ASP  78          HB3       ASP  78 -33.150  30.465 -16.419
  580    H    LYS  79           H        LYS  79 -32.131  32.231 -15.517
  581    HA   LYS  79           HA       LYS  79 -30.464  32.653 -13.258
  582   1HB   LYS  79          HB2       LYS  79 -33.386  33.365 -13.785
  583   2HB   LYS  79          HB3       LYS  79 -32.565  33.852 -12.325
  584   1HG   LYS  79          HG2       LYS  79 -31.832  34.739 -15.133
  585   2HG   LYS  79          HG3       LYS  79 -32.561  35.677 -13.821
  586   1HD   LYS  79          HD2       LYS  79 -29.729  34.678 -14.095
  587   2HD   LYS  79          HD3       LYS  79 -30.248  36.341 -13.880
  588   1HE   LYS  79          HE2       LYS  79 -30.489  34.163 -11.734
  589   2HE   LYS  79          HE3       LYS  79 -29.101  35.195 -11.889
  590   1HZ   LYS  79          HZ1       LYS  79 -31.823  36.163 -11.313
  591   2HZ   LYS  79          HZ2       LYS  79 -30.569  36.022 -10.252
  592   3HZ   LYS  79          HZ3       LYS  79 -30.485  37.118 -11.451
  593    H    SER  80           H        SER  80 -32.697  30.043 -13.563
  594    HA   SER  80           HA       SER  80 -33.064  29.595 -10.717
  595   1HB   SER  80          HB2       SER  80 -33.949  27.395 -11.516
  596   2HB   SER  80          HB3       SER  80 -34.697  28.780 -12.300
  597    HG   SER  80           HG       SER  80 -34.132  27.117 -13.783
  598    H    ASP  81           H        ASP  81 -30.393  29.024 -12.879
  599    HA   ASP  81           HA       ASP  81 -29.334  26.774 -11.340
  600   1HB   ASP  81          HB2       ASP  81 -28.215  28.474 -13.599
  601   2HB   ASP  81          HB3       ASP  81 -27.353  27.137 -12.851
  602    H    GLU  82           H        GLU  82 -29.132  30.202 -11.071
  603    HA   GLU  82           HA       GLU  82 -26.787  30.899  -9.874
  604   1HB   GLU  82          HB2       GLU  82 -28.838  32.312 -10.309
  605   2HB   GLU  82          HB3       GLU  82 -29.549  31.607  -8.843
  606   1HG   GLU  82          HG2       GLU  82 -27.563  32.563  -7.552
  607   2HG   GLU  82          HG3       GLU  82 -27.075  33.372  -9.055
  608    H    ALA  83           H        ALA  83 -25.652  30.504  -8.079
  609    HA   ALA  83           HA       ALA  83 -26.795  29.141  -5.724
  610   1HB   ALA  83          HB1       ALA  83 -24.629  27.804  -7.422
  611   2HB   ALA  83          HB2       ALA  83 -25.409  27.146  -5.976
  612   3HB   ALA  83          HB3       ALA  83 -26.318  27.324  -7.491
  613    H    GLU  84           H        GLU  84 -25.015  28.527  -4.194
  614    HA   GLU  84           HA       GLU  84 -22.528  30.062  -4.388
  615   1HB   GLU  84          HB2       GLU  84 -24.286  31.489  -3.226
  616   2HB   GLU  84          HB3       GLU  84 -24.253  30.338  -1.897
  617   1HG   GLU  84          HG2       GLU  84 -21.916  30.811  -1.446
  618   2HG   GLU  84          HG3       GLU  84 -21.736  31.701  -2.969
  619    H    TYR  85           H        TYR  85 -22.050  27.925  -4.939
  620    HA   TYR  85           HA       TYR  85 -22.696  25.571  -3.652
  621   1HB   TYR  85          HB2       TYR  85 -20.131  26.259  -5.132
  622   2HB   TYR  85          HB3       TYR  85 -20.731  24.640  -4.831
  623    HD1  TYR  85           HD1      TYR  85 -23.368  24.418  -5.622
  624    HD2  TYR  85           HD2      TYR  85 -20.335  26.927  -7.382
  625    HE1  TYR  85           HE1      TYR  85 -24.503  24.255  -7.850
  626    HE2  TYR  85           HE2      TYR  85 -21.488  26.770  -9.569
  627    HH   TYR  85           HH       TYR  85 -24.487  24.889 -10.041
  628    H    ILE  86           H        ILE  86 -22.018  24.400  -1.961
  629    HA   ILE  86           HA       ILE  86 -19.374  25.047  -0.720
  630    HB   ILE  86           HB       ILE  86 -21.857  24.105   0.792
  631   1HG1  ILE  86          2HG1      ILE  86 -20.417  26.794   0.834
  632   2HG1  ILE  86          3HG1      ILE  86 -22.035  26.489   0.188
  633   1HG2  ILE  86          1HG2      ILE  86 -20.361  24.270   2.778
  634   2HG2  ILE  86          2HG2      ILE  86 -19.679  23.140   1.618
  635   3HG2  ILE  86          3HG2      ILE  86 -19.019  24.796   1.757
  636   1HD1  ILE  86          1HD1      ILE  86 -22.777  25.837   2.481
  637   2HD1  ILE  86          2HD1      ILE  86 -21.185  26.327   3.096
  638   3HD1  ILE  86          3HD1      ILE  86 -22.234  27.529   2.345
  639    H    CYS  87           H        CYS  87 -18.069  23.340  -0.735
  640    HA   CYS  87           HA       CYS  87 -19.137  20.680  -1.461
  641   1HB   CYS  87          HB2       CYS  87 -17.280  20.431  -3.068
  642   2HB   CYS  87          HB3       CYS  87 -18.399  21.738  -3.452
  643    H    ILE  88           H        ILE  88 -18.320  18.931  -0.609
  644    HA   ILE  88           HA       ILE  88 -16.264  19.224   1.568
  645    HB   ILE  88           HB       ILE  88 -18.937  17.756   1.654
  646   1HG1  ILE  88          2HG1      ILE  88 -18.066  20.316   3.094
  647   2HG1  ILE  88          3HG1      ILE  88 -19.253  20.201   1.775
  648   1HG2  ILE  88          1HG2      ILE  88 -17.158  16.622   2.962
  649   2HG2  ILE  88          2HG2      ILE  88 -16.800  18.142   3.811
  650   3HG2  ILE  88          3HG2      ILE  88 -18.362  17.317   4.005
  651   1HD1  ILE  88          1HD1      ILE  88 -19.574  19.140   4.614
  652   2HD1  ILE  88          2HD1      ILE  88 -20.488  20.426   3.788
  653   3HD1  ILE  88          3HD1      ILE  88 -20.683  18.723   3.276
  654    H    ALA  89           H        ALA  89 -14.764  17.656   1.586
  655    HA   ALA  89           HA       ALA  89 -15.314  15.074   0.177
  656   1HB   ALA  89          HB1       ALA  89 -12.953  14.907  -0.347
  657   2HB   ALA  89          HB2       ALA  89 -13.650  16.340  -1.111
  658   3HB   ALA  89          HB3       ALA  89 -12.656  16.516   0.363
  659    H    GLU  90           H        GLU  90 -14.581  13.236   1.204
  660    HA   GLU  90           HA       GLU  90 -13.598  13.236   3.919
  661   1HB   GLU  90          HB2       GLU  90 -15.964  14.069   4.189
  662   2HB   GLU  90          HB3       GLU  90 -16.533  12.545   3.466
  663   1HG   GLU  90          HG2       GLU  90 -15.265  11.335   5.320
  664   2HG   GLU  90          HG3       GLU  90 -14.886  12.919   5.995
  665    H    ASN  91           H        ASN  91 -12.149  11.842   2.957
  666    HA   ASN  91           HA       ASN  91 -13.171   9.292   1.799
  667   1HB   ASN  91          HB2       ASN  91 -11.324   9.069   0.533
  668   2HB   ASN  91          HB3       ASN  91 -11.458  10.812   0.547
  669   1HD2  ASN  91          1HD2      ASN  91  -7.912   9.744   1.117
  670   2HD2  ASN  91          2HD2      ASN  91  -9.135   9.282  -0.078
  671    H    LYS  92           H        LYS  92 -11.359   7.503   2.257
  672    HA   LYS  92           HA       LYS  92 -11.708   6.518   4.863
  673   1HB   LYS  92          HB2       LYS  92  -9.834   4.952   4.213
  674   2HB   LYS  92          HB3       LYS  92 -11.282   4.943   3.257
  675   1HG   LYS  92          HG2       LYS  92  -8.975   6.657   2.296
  676   2HG   LYS  92          HG3       LYS  92  -8.777   4.899   2.209
  677   1HD   LYS  92          HD2       LYS  92 -11.166   6.303   0.943
  678   2HD   LYS  92          HD3       LYS  92  -9.658   5.955   0.113
  679   1HE   LYS  92          HE2       LYS  92  -9.952   3.554   0.522
  680   2HE   LYS  92          HE3       LYS  92 -11.399   3.844   1.455
  681   1HZ   LYS  92          HZ1       LYS  92 -12.446   4.736  -0.548
  682   2HZ   LYS  92          HZ2       LYS  92 -11.100   4.456  -1.440
  683   3HZ   LYS  92          HZ3       LYS  92 -11.952   3.206  -0.847
  684    H    ALA  93           H        ALA  93  -9.248   8.723   3.836
  685    HA   ALA  93           HA       ALA  93  -7.625   8.255   6.295
  686   1HB   ALA  93          HB1       ALA  93  -6.467   8.055   4.164
  687   2HB   ALA  93          HB2       ALA  93  -7.033   9.644   3.662
  688   3HB   ALA  93          HB3       ALA  93  -5.884   9.517   5.009
  689    H    GLY  94           H        GLY  94  -9.894  10.663   5.135
  690   1HA   GLY  94          HA2       GLY  94  -9.747  12.223   7.533
  691   2HA   GLY  94          HA3       GLY  94  -8.723  12.998   6.321
  692    H    GLU  95           H        GLU  95 -10.056  14.823   6.474
  693    HA   GLU  95           HA       GLU  95 -12.512  14.849   4.823
  694   1HB   GLU  95          HB2       GLU  95 -13.213  14.310   7.173
  695   2HB   GLU  95          HB3       GLU  95 -12.384  15.776   7.726
  696   1HG   GLU  95          HG2       GLU  95 -13.966  17.173   6.419
  697   2HG   GLU  95          HG3       GLU  95 -14.729  15.712   5.775
  698    H    GLN  96           H        GLN  96 -13.035  16.901   3.992
  699    HA   GLN  96           HA       GLN  96 -11.413  19.307   4.567
  700   1HB   GLN  96          HB2       GLN  96 -10.131  17.520   3.021
  701   2HB   GLN  96          HB3       GLN  96 -11.177  18.174   1.781
  702   1HG   GLN  96          HG2       GLN  96  -9.124  19.382   1.667
  703   2HG   GLN  96          HG3       GLN  96 -10.231  20.514   2.448
  704   1HE2  GLN  96          1HE2      GLN  96  -7.822  17.895   3.223
  705   2HE2  GLN  96          2HE2      GLN  96  -7.183  18.739   4.645
  706    H    ASP  97           H        ASP  97 -12.051  21.166   2.992
  707    HA   ASP  97           HA       ASP  97 -14.494  20.842   1.454
  708   1HB   ASP  97          HB2       ASP  97 -15.916  22.269   2.767
  709   2HB   ASP  97          HB3       ASP  97 -15.384  20.912   3.780
  710    H    ALA  98           H        ALA  98 -15.186  22.655   0.277
  711    HA   ALA  98           HA       ALA  98 -13.718  25.201   0.466
  712   1HB   ALA  98          HB1       ALA  98 -12.320  23.901  -1.082
  713   2HB   ALA  98          HB2       ALA  98 -13.713  23.558  -2.134
  714   3HB   ALA  98          HB3       ALA  98 -13.101  25.213  -1.953
  715    H    THR  99           H        THR  99 -14.663  26.754  -1.360
  716    HA   THR  99           HA       THR  99 -17.636  26.537  -1.577
  717    HB   THR  99           HB       THR  99 -16.093  28.805  -0.236
  718    HG1  THR  99           HG1      THR  99 -17.066  28.100   1.659
  719   1HG2  THR  99          1HG2      THR  99 -18.322  29.640   0.493
  720   2HG2  THR  99          2HG2      THR  99 -18.151  29.640  -1.267
  721   3HG2  THR  99          3HG2      THR  99 -19.107  28.372  -0.491
  722    H    ILE 100           H        ILE 100 -18.522  27.750  -3.261
  723    HA   ILE 100           HA       ILE 100 -16.802  29.529  -4.895
  724    HB   ILE 100           HB       ILE 100 -18.242  27.066  -5.918
  725   1HG1  ILE 100          2HG1      ILE 100 -15.288  27.788  -6.070
  726   2HG1  ILE 100          3HG1      ILE 100 -16.005  26.573  -4.990
  727   1HG2  ILE 100          1HG2      ILE 100 -17.495  27.750  -8.225
  728   2HG2  ILE 100          2HG2      ILE 100 -18.672  28.834  -7.519
  729   3HG2  ILE 100          3HG2      ILE 100 -16.962  29.298  -7.543
  730   1HD1  ILE 100          1HD1      ILE 100 -15.744  26.397  -7.994
  731   2HD1  ILE 100          2HD1      ILE 100 -15.088  25.349  -6.749
  732   3HD1  ILE 100          3HD1      ILE 100 -16.853  25.353  -7.067
  733    H    HIS 101           H        HIS 101 -17.977  31.152  -5.964
  734    HA   HIS 101           HA       HIS 101 -20.919  31.302  -5.434
  735   1HB   HIS 101          HB2       HIS 101 -19.116  33.374  -6.738
  736   2HB   HIS 101          HB3       HIS 101 -20.718  33.631  -6.108
  737    HD1  HIS 101           HD1      HIS 101 -17.090  33.281  -4.987
  738    HD2  HIS 101           HD2      HIS 101 -20.939  34.021  -3.412
  739    HE1  HIS 101           HE1      HIS 101 -16.761  34.093  -2.555
  740    H    LEU 102           H        LEU 102 -22.468  31.230  -7.104
  741    HA   LEU 102           HA       LEU 102 -21.482  31.263  -9.896
  742   1HB   LEU 102          HB2       LEU 102 -21.779  28.987  -9.200
  743   2HB   LEU 102          HB3       LEU 102 -23.438  29.262  -8.742
  744    HG   LEU 102           HG       LEU 102 -23.009  28.042 -10.916
  745   1HD1  LEU 102          1HD1      LEU 102 -24.780  29.000 -12.161
  746   2HD1  LEU 102          2HD1      LEU 102 -25.182  29.110 -10.443
  747   3HD1  LEU 102          3HD1      LEU 102 -24.648  30.551 -11.344
  748   1HD2  LEU 102          1HD2      LEU 102 -21.171  29.449 -11.764
  749   2HD2  LEU 102          2HD2      LEU 102 -22.480  29.274 -12.939
  750   3HD2  LEU 102          3HD2      LEU 102 -22.307  30.797 -12.062
  751    H    LYS 103           H        LYS 103 -22.074  33.319 -10.168
  752    HA   LYS 103           HA       LYS 103 -24.912  34.126  -9.600
  753   1HB   LYS 103          HB2       LYS 103 -22.485  35.901  -9.987
  754   2HB   LYS 103          HB3       LYS 103 -24.109  36.387  -9.481
  755   1HG   LYS 103          HG2       LYS 103 -22.100  34.719  -7.923
  756   2HG   LYS 103          HG3       LYS 103 -22.655  36.359  -7.561
  757   1HD   LYS 103          HD2       LYS 103 -24.951  35.455  -7.095
  758   2HD   LYS 103          HD3       LYS 103 -24.354  33.818  -7.390
  759   1HE   LYS 103          HE2       LYS 103 -22.646  34.150  -5.556
  760   2HE   LYS 103          HE3       LYS 103 -23.347  35.746  -5.255
  761   1HZ   LYS 103          HZ1       LYS 103 -24.204  34.057  -3.743
  762   2HZ   LYS 103          HZ2       LYS 103 -25.442  34.625  -4.671
  763   3HZ   LYS 103          HZ3       LYS 103 -24.763  33.151  -4.985
  764    H    VAL 104           H        VAL 104 -25.982  33.449 -11.338
  765    HA   VAL 104           HA       VAL 104 -25.176  33.916 -14.124
  766    HB   VAL 104           HB       VAL 104 -27.948  33.284 -13.062
  767   1HG1  VAL 104          1HG1      VAL 104 -27.797  33.908 -15.481
  768   2HG1  VAL 104          2HG1      VAL 104 -26.630  32.592 -15.725
  769   3HG1  VAL 104          3HG1      VAL 104 -28.280  32.229 -15.225
  770   1HG2  VAL 104          1HG2      VAL 104 -27.422  30.879 -13.490
  771   2HG2  VAL 104          2HG2      VAL 104 -25.706  31.335 -13.668
  772   3HG2  VAL 104          3HG2      VAL 104 -26.546  31.556 -12.142
  773    H    PHE 105           H        PHE 105 -25.796  35.632 -15.501
  774    HA   PHE 105           HA       PHE 105 -27.414  37.825 -14.317
  775   1HB   PHE 105          HB2       PHE 105 -26.039  39.238 -15.748
  776   2HB   PHE 105          HB3       PHE 105 -25.124  38.451 -14.496
  777    HD1  PHE 105           HD1      PHE 105 -23.368  36.794 -15.087
  778    HD2  PHE 105           HD2      PHE 105 -25.682  38.794 -18.130
  779    HE1  PHE 105           HE1      PHE 105 -21.732  36.072 -16.856
  780    HE2  PHE 105           HE2      PHE 105 -24.061  38.074 -19.845
  781    HZ   PHE 105           HZ       PHE 105 -22.099  36.690 -19.192
  782    H    ALA 106           H        ALA 106 -28.919  38.840 -15.511
  783    HA   ALA 106           HA       ALA 106 -29.969  37.367 -17.833
  784   1HB   ALA 106          HB1       ALA 106 -32.078  38.456 -17.274
  785   2HB   ALA 106          HB2       ALA 106 -31.408  37.641 -15.851
  786   3HB   ALA 106          HB3       ALA 106 -31.270  39.390 -16.009
  787    H    LYS 107           H        LYS 107 -27.791  38.690 -18.529
  788    HA   LYS 107           HA       LYS 107 -26.750  40.207 -19.887
  789   1HB   LYS 107          HB2       LYS 107 -29.497  40.678 -21.079
  790   2HB   LYS 107          HB3       LYS 107 -27.912  41.071 -21.799
  791   1HG   LYS 107          HG2       LYS 107 -27.333  38.665 -21.794
  792   2HG   LYS 107          HG3       LYS 107 -28.936  38.273 -21.151
  793   1HD   LYS 107          HD2       LYS 107 -29.902  39.434 -23.218
  794   2HD   LYS 107          HD3       LYS 107 -28.243  39.578 -23.824
  795   1HE   LYS 107          HE2       LYS 107 -29.224  37.658 -24.870
  796   2HE   LYS 107          HE3       LYS 107 -28.019  37.065 -23.709
  797   1HZ   LYS 107          HZ1       LYS 107 -29.800  36.499 -22.186
  798   2HZ   LYS 107          HZ2       LYS 107 -30.950  37.245 -23.120
  799   3HZ   LYS 107          HZ3       LYS 107 -30.230  35.875 -23.636
  Start of MODEL   12
    1   1H    GLY   1          H1        GLY   1  -0.950   1.940  -4.523
    2   2H    GLY   1          H2        GLY   1  -1.510   0.629  -3.724
    3   3H    GLY   1          H3        GLY   1  -2.270   2.062  -3.541
    4   1HA   GLY   1          HA2       GLY   1   0.444   1.505  -2.602
    5   2HA   GLY   1          HA3       GLY   1  -0.383   3.061  -2.455
    6    H    LYS   2           H        LYS   2   0.464   0.419  -0.737
    7    HA   LYS   2           HA       LYS   2  -2.014   0.015   0.834
    8   1HB   LYS   2          HB2       LYS   2  -0.405  -1.793  -0.071
    9   2HB   LYS   2          HB3       LYS   2   0.709  -1.308   1.186
   10   1HG   LYS   2          HG2       LYS   2  -1.049  -1.860   2.912
   11   2HG   LYS   2          HG3       LYS   2  -2.152  -2.334   1.612
   12   1HD   LYS   2          HD2       LYS   2  -0.441  -4.043   0.907
   13   2HD   LYS   2          HD3       LYS   2   0.584  -3.572   2.306
   14   1HE   LYS   2          HE2       LYS   2  -1.271  -4.210   3.873
   15   2HE   LYS   2          HE3       LYS   2  -2.272  -4.667   2.493
   16   1HZ   LYS   2          HZ1       LYS   2  -0.602  -6.376   1.955
   17   2HZ   LYS   2          HZ2       LYS   2   0.300  -5.946   3.271
   18   3HZ   LYS   2          HZ3       LYS   2  -1.207  -6.597   3.450
   19    H    ASP   3           H        ASP   3  -2.123   0.306   3.073
   20    HA   ASP   3           HA       ASP   3  -0.562   2.484   4.230
   21   1HB   ASP   3          HB2       ASP   3  -3.013   2.162   4.439
   22   2HB   ASP   3          HB3       ASP   3  -2.721   0.770   5.467
   23    H    ILE   4           H        ILE   4  -0.158  -0.919   4.192
   24    HA   ILE   4           HA       ILE   4   1.420  -0.971   6.708
   25    HB   ILE   4           HB       ILE   4   0.571  -3.404   5.141
   26   1HG1  ILE   4          2HG1      ILE   4  -0.907  -1.915   7.385
   27   2HG1  ILE   4          3HG1      ILE   4  -1.479  -2.182   5.732
   28   1HG2  ILE   4          1HG2      ILE   4   2.469  -3.599   6.838
   29   2HG2  ILE   4          2HG2      ILE   4   1.329  -3.030   8.056
   30   3HG2  ILE   4          3HG2      ILE   4   1.069  -4.575   7.242
   31   1HD1  ILE   4          1HD1      ILE   4  -1.493  -4.658   6.160
   32   2HD1  ILE   4          2HD1      ILE   4  -1.141  -4.323   7.866
   33   3HD1  ILE   4          3HD1      ILE   4  -2.658  -3.732   7.141
   34    H    GLN   5           H        GLN   5   2.742   0.489   5.235
   35    HA   GLN   5           HA       GLN   5   5.089  -0.867   4.102
   36   1HB   GLN   5          HB2       GLN   5   3.143   0.861   2.520
   37   2HB   GLN   5          HB3       GLN   5   4.803   0.701   2.032
   38   1HG   GLN   5          HG2       GLN   5   2.823  -1.577   2.191
   39   2HG   GLN   5          HG3       GLN   5   3.462  -0.790   0.743
   40   1HE2  GLN   5          1HE2      GLN   5   5.492  -3.940   1.973
   41   2HE2  GLN   5          2HE2      GLN   5   3.783  -3.624   2.314
   42    H    VAL   6           H        VAL   6   6.482   1.241   3.161
   43    HA   VAL   6           HA       VAL   6   6.729   3.189   5.361
   44    HB   VAL   6           HB       VAL   6   8.332   3.227   2.798
   45   1HG1  VAL   6          1HG1      VAL   6  10.042   4.300   4.252
   46   2HG1  VAL   6          2HG1      VAL   6   8.543   5.227   4.274
   47   3HG1  VAL   6          3HG1      VAL   6   8.930   4.184   5.647
   48   1HG2  VAL   6          1HG2      VAL   6   8.850   1.619   5.346
   49   2HG2  VAL   6          2HG2      VAL   6   8.619   0.974   3.715
   50   3HG2  VAL   6          3HG2      VAL   6  10.049   1.934   4.080
   51    H    ILE   7           H        ILE   7   4.305   3.383   4.499
   52    HA   ILE   7           HA       ILE   7   3.823   5.922   3.044
   53    HB   ILE   7           HB       ILE   7   2.586   3.209   2.328
   54   1HG1  ILE   7          2HG1      ILE   7   4.345   4.949   0.566
   55   2HG1  ILE   7          3HG1      ILE   7   4.825   3.457   1.338
   56   1HG2  ILE   7          1HG2      ILE   7   1.287   4.390   0.622
   57   2HG2  ILE   7          2HG2      ILE   7   0.909   5.046   2.192
   58   3HG2  ILE   7          3HG2      ILE   7   1.985   5.952   1.112
   59   1HD1  ILE   7          1HD1      ILE   7   3.018   2.232   0.058
   60   2HD1  ILE   7          2HD1      ILE   7   2.781   3.718  -0.896
   61   3HD1  ILE   7          3HD1      ILE   7   4.349   2.895  -0.902
   62    H    VAL   8           H        VAL   8   1.951   6.929   3.894
   63    HA   VAL   8           HA       VAL   8   0.293   5.447   5.910
   64    HB   VAL   8           HB       VAL   8   1.409   8.250   6.284
   65   1HG1  VAL   8          1HG1      VAL   8   0.458   8.039   8.576
   66   2HG1  VAL   8          2HG1      VAL   8  -0.792   7.985   7.339
   67   3HG1  VAL   8          3HG1      VAL   8  -0.254   6.468   8.121
   68   1HG2  VAL   8          1HG2      VAL   8   3.200   6.593   6.679
   69   2HG2  VAL   8          2HG2      VAL   8   2.668   7.234   8.225
   70   3HG2  VAL   8          3HG2      VAL   8   2.112   5.636   7.725
   71    H    ASN   9           H        ASN   9  -1.764   5.679   5.559
   72    HA   ASN   9           HA       ASN   9  -3.097   6.808   3.523
   73   1HB   ASN   9          HB2       ASN   9  -5.138   6.737   4.895
   74   2HB   ASN   9          HB3       ASN   9  -4.148   5.310   5.096
   75   1HD2  ASN   9          1HD2      ASN   9  -3.404   5.926   8.545
   76   2HD2  ASN   9          2HD2      ASN   9  -2.891   5.043   7.113
   77    H    VAL  10           H        VAL  10  -3.710   8.635   2.716
   78    HA   VAL  10           HA       VAL  10  -2.934  11.161   4.030
   79    HB   VAL  10           HB       VAL  10  -3.424  10.499   1.115
   80   1HG1  VAL  10          1HG1      VAL  10  -2.286  12.702   0.682
   81   2HG1  VAL  10          2HG1      VAL  10  -3.872  12.847   1.421
   82   3HG1  VAL  10          3HG1      VAL  10  -2.423  13.047   2.416
   83   1HG2  VAL  10          1HG2      VAL  10  -1.383   9.436   1.964
   84   2HG2  VAL  10          2HG2      VAL  10  -0.951  10.786   0.935
   85   3HG2  VAL  10          3HG2      VAL  10  -0.846  10.980   2.692
   86    HA   PRO  11           HA       PRO  11  -7.400  12.091   4.515
   87   1HB   PRO  11          HB2       PRO  11  -6.191  14.831   4.848
   88   2HB   PRO  11          HB3       PRO  11  -7.489  14.048   5.801
   89   1HG   PRO  11          HG2       PRO  11  -4.942  14.165   6.757
   90   2HG   PRO  11          HG3       PRO  11  -5.891  12.657   6.940
   91   1HD   PRO  11          HD2       PRO  11  -3.784  13.349   4.890
   92   2HD   PRO  11          HD3       PRO  11  -4.007  11.826   5.796
   93    HA   PRO  12           HA       PRO  12  -8.514  13.795   0.605
   94   1HB   PRO  12          HB2       PRO  12 -10.710  15.409   1.831
   95   2HB   PRO  12          HB3       PRO  12 -10.790  14.139   0.574
   96   1HG   PRO  12          HG2       PRO  12 -11.595  13.640   3.106
   97   2HG   PRO  12          HG3       PRO  12 -10.679  12.416   2.193
   98   1HD   PRO  12          HD2       PRO  12  -9.625  14.478   4.172
   99   2HD   PRO  12          HD3       PRO  12  -9.357  12.717   4.184
  100    H    SER  13           H        SER  13  -8.704  15.651  -0.704
  101    HA   SER  13           HA       SER  13  -7.904  18.326   0.270
  102   1HB   SER  13          HB2       SER  13  -6.011  18.406  -1.286
  103   2HB   SER  13          HB3       SER  13  -5.793  17.289   0.090
  104    HG   SER  13           HG       SER  13  -6.577  15.640  -1.486
  105    H    VAL  14           H        VAL  14 -10.068  18.715  -0.296
  106    HA   VAL  14           HA       VAL  14 -10.616  18.725  -3.198
  107    HB   VAL  14           HB       VAL  14 -12.317  17.686  -1.874
  108   1HG1  VAL  14          1HG1      VAL  14 -13.833  18.889  -0.457
  109   2HG1  VAL  14          2HG1      VAL  14 -12.209  19.158   0.188
  110   3HG1  VAL  14          3HG1      VAL  14 -13.016  20.428  -0.757
  111   1HG2  VAL  14          1HG2      VAL  14 -12.838  18.800  -4.026
  112   2HG2  VAL  14          2HG2      VAL  14 -14.209  18.709  -2.903
  113   3HG2  VAL  14          3HG2      VAL  14 -13.349  20.238  -3.100
  114    H    ARG  15           H        ARG  15 -10.091  20.431  -4.296
  115    HA   ARG  15           HA       ARG  15 -10.004  23.141  -3.012
  116   1HB   ARG  15          HB2       ARG  15  -8.305  22.008  -5.285
  117   2HB   ARG  15          HB3       ARG  15  -8.347  23.699  -4.801
  118   1HG   ARG  15          HG2       ARG  15  -6.508  22.932  -3.675
  119   2HG   ARG  15          HG3       ARG  15  -7.783  22.975  -2.459
  120   1HD   ARG  15          HD2       ARG  15  -6.270  20.970  -2.286
  121   2HD   ARG  15          HD3       ARG  15  -7.961  20.573  -2.425
  122    HE   ARG  15           HE       ARG  15  -7.589  19.646  -4.577
  123   1HH1  ARG  15          1HH1      ARG  15  -3.714  20.282  -4.827
  124   2HH1  ARG  15          2HH1      ARG  15  -4.564  20.989  -3.486
  125   1HH2  ARG  15          1HH2      ARG  15  -4.761  19.137  -6.353
  126   2HH2  ARG  15          2HH2      ARG  15  -6.502  18.952  -6.302
  127    H    ALA  16           H        ALA  16 -10.740  24.830  -3.962
  128    HA   ALA  16           HA       ALA  16 -12.764  24.505  -6.119
  129   1HB   ALA  16          HB1       ALA  16 -12.086  26.910  -4.345
  130   2HB   ALA  16          HB2       ALA  16 -13.328  26.877  -5.600
  131   3HB   ALA  16          HB3       ALA  16 -13.473  25.813  -4.194
  132    H    ARG  17           H        ARG  17 -11.788  24.268  -8.035
  133    HA   ARG  17           HA       ARG  17  -9.306  25.654  -8.754
  134   1HB   ARG  17          HB2       ARG  17 -11.203  24.075 -10.530
  135   2HB   ARG  17          HB3       ARG  17  -9.584  24.660 -10.959
  136   1HG   ARG  17          HG2       ARG  17  -8.757  23.354  -8.876
  137   2HG   ARG  17          HG3       ARG  17 -10.340  22.533  -8.948
  138   1HD   ARG  17          HD2       ARG  17  -8.193  22.661 -11.131
  139   2HD   ARG  17          HD3       ARG  17  -8.580  21.261 -10.129
  140    HE   ARG  17           HE       ARG  17 -10.642  20.939 -11.300
  141   1HH1  ARG  17          1HH1      ARG  17 -11.593  20.716 -13.196
  142   2HH1  ARG  17          2HH1      ARG  17 -11.200  21.765 -14.534
  143   1HH2  ARG  17          1HH2      ARG  17  -8.744  23.485 -12.869
  144   2HH2  ARG  17          2HH2      ARG  17  -9.618  23.273 -14.359
  145    H    GLN  18           H        GLN  18 -12.684  26.209  -9.365
  146    HA   GLN  18           HA       GLN  18 -12.131  28.825 -10.705
  147   1HB   GLN  18          HB2       GLN  18 -14.747  27.323 -10.224
  148   2HB   GLN  18          HB3       GLN  18 -14.562  28.860 -11.093
  149   1HG   GLN  18          HG2       GLN  18 -13.533  26.128 -11.979
  150   2HG   GLN  18          HG3       GLN  18 -14.851  27.084 -12.709
  151   1HE2  GLN  18          1HE2      GLN  18 -12.531  29.305 -14.405
  152   2HE2  GLN  18          2HE2      GLN  18 -14.160  29.234 -13.725
  153    H    SER  19           H        SER  19 -13.115  30.760  -9.710
  154    HA   SER  19           HA       SER  19 -13.701  30.457  -6.776
  155   1HB   SER  19          HB2       SER  19 -12.730  32.929  -8.228
  156   2HB   SER  19          HB3       SER  19 -13.061  32.770  -6.496
  157    HG   SER  19           HG       SER  19 -10.830  32.496  -6.935
  158    H    THR  20           H        THR  20 -14.688  32.319  -9.645
  159    HA   THR  20           HA       THR  20 -17.505  32.515  -8.678
  160    HB   THR  20           HB       THR  20 -15.918  34.969  -9.486
  161    HG1  THR  20           HG1      THR  20 -15.371  34.506  -7.417
  162   1HG2  THR  20          1HG2      THR  20 -18.335  35.113 -10.107
  163   2HG2  THR  20          2HG2      THR  20 -18.795  34.574  -8.501
  164   3HG2  THR  20          3HG2      THR  20 -18.008  36.159  -8.710
  165    H    MET  21           H        MET  21 -18.721  31.901 -10.238
  166    HA   MET  21           HA       MET  21 -17.911  32.148 -13.092
  167   1HB   MET  21          HB2       MET  21 -19.872  30.286 -11.687
  168   2HB   MET  21          HB3       MET  21 -19.547  30.295 -13.423
  169   1HG   MET  21          HG2       MET  21 -17.547  29.710 -11.197
  170   2HG   MET  21          HG3       MET  21 -18.318  28.530 -12.228
  171   1HE   MET  21          HE1       MET  21 -18.048  28.542 -14.929
  172   2HE   MET  21          HE2       MET  21 -18.002  30.312 -15.184
  173   3HE   MET  21          HE3       MET  21 -16.665  29.298 -15.762
  174    H    ASN  22           H        ASN  22 -19.889  32.322 -14.575
  175    HA   ASN  22           HA       ASN  22 -22.182  33.833 -13.639
  176   1HB   ASN  22          HB2       ASN  22 -21.675  35.862 -14.938
  177   2HB   ASN  22          HB3       ASN  22 -20.506  35.625 -13.673
  178   1HD2  ASN  22          1HD2      ASN  22 -19.325  35.501 -17.578
  179   2HD2  ASN  22          2HD2      ASN  22 -21.017  35.571 -17.187
  180    H    ALA  23           H        ALA  23 -23.638  34.465 -15.391
  181    HA   ALA  23           HA       ALA  23 -23.409  33.199 -18.005
  182   1HB   ALA  23          HB1       ALA  23 -25.310  32.062 -15.913
  183   2HB   ALA  23          HB2       ALA  23 -25.365  31.689 -17.651
  184   3HB   ALA  23          HB3       ALA  23 -23.953  31.215 -16.694
  185    H    THR  24           H        THR  24 -25.141  33.753 -19.424
  186    HA   THR  24           HA       THR  24 -26.895  36.015 -18.583
  187    HB   THR  24           HB       THR  24 -26.362  35.055 -21.415
  188    HG1  THR  24           HG1      THR  24 -24.975  36.801 -21.552
  189   1HG2  THR  24          1HG2      THR  24 -28.443  36.363 -21.164
  190   2HG2  THR  24          2HG2      THR  24 -27.553  37.626 -20.286
  191   3HG2  THR  24          3HG2      THR  24 -27.207  37.311 -21.991
  192    H    ALA  25           H        ALA  25 -28.653  35.187 -17.714
  193    HA   ALA  25           HA       ALA  25 -29.989  32.752 -18.544
  194   1HB   ALA  25          HB1       ALA  25 -30.797  35.004 -16.683
  195   2HB   ALA  25          HB2       ALA  25 -31.673  33.475 -16.925
  196   3HB   ALA  25          HB3       ALA  25 -30.045  33.423 -16.260
  197    H    ASN  26           H        ASN  26 -32.387  32.875 -18.984
  198    HA   ASN  26           HA       ASN  26 -34.054  33.158 -20.440
  199   1HB   ASN  26          HB2       ASN  26 -32.862  35.793 -21.393
  200   2HB   ASN  26          HB3       ASN  26 -34.456  35.184 -21.724
  201   1HD2  ASN  26          1HD2      ASN  26 -34.602  37.729 -19.016
  202   2HD2  ASN  26          2HD2      ASN  26 -33.808  37.689 -20.587
  203    H    LEU  27           H        LEU  27 -30.841  32.905 -21.368
  204    HA   LEU  27           HA       LEU  27 -31.456  32.169 -24.187
  205   1HB   LEU  27          HB2       LEU  27 -28.835  32.845 -22.822
  206   2HB   LEU  27          HB3       LEU  27 -29.035  32.470 -24.538
  207    HG   LEU  27           HG       LEU  27 -30.119  34.909 -23.076
  208   1HD1  LEU  27          1HD1      LEU  27 -27.673  34.963 -23.474
  209   2HD1  LEU  27          2HD1      LEU  27 -27.953  34.651 -25.195
  210   3HD1  LEU  27          3HD1      LEU  27 -28.535  36.144 -24.458
  211   1HD2  LEU  27          1HD2      LEU  27 -30.321  34.165 -26.026
  212   2HD2  LEU  27          2HD2      LEU  27 -31.675  34.295 -24.897
  213   3HD2  LEU  27          3HD2      LEU  27 -30.734  35.756 -25.307
  214    H    SER  28           H        SER  28 -31.212  30.564 -21.299
  215    HA   SER  28           HA       SER  28 -30.823  28.427 -20.619
  216   1HB   SER  28          HB2       SER  28 -31.518  27.879 -23.534
  217   2HB   SER  28          HB3       SER  28 -31.519  26.677 -22.237
  218    HG   SER  28           HG       SER  28 -33.604  27.660 -22.627
  219    H    GLN  29           H        GLN  29 -28.426  29.697 -20.990
  220    HA   GLN  29           HA       GLN  29 -26.554  28.428 -22.709
  221   1HB   GLN  29          HB2       GLN  29 -26.299  30.087 -20.174
  222   2HB   GLN  29          HB3       GLN  29 -24.874  29.445 -20.999
  223   1HG   GLN  29          HG2       GLN  29 -25.575  30.541 -23.086
  224   2HG   GLN  29          HG3       GLN  29 -26.992  31.241 -22.263
  225   1HE2  GLN  29          1HE2      GLN  29 -24.164  33.766 -22.286
  226   2HE2  GLN  29          2HE2      GLN  29 -25.000  32.862 -23.562
  227    H    SER  30           H        SER  30 -24.732  27.115 -22.235
  228    HA   SER  30           HA       SER  30 -25.048  25.202 -19.952
  229   1HB   SER  30          HB2       SER  30 -23.717  24.733 -22.642
  230   2HB   SER  30          HB3       SER  30 -23.712  23.621 -21.245
  231    HG   SER  30           HG       SER  30 -25.919  24.500 -22.806
  232    H    VAL  31           H        VAL  31 -23.313  24.904 -18.602
  233    HA   VAL  31           HA       VAL  31 -20.917  26.725 -18.947
  234    HB   VAL  31           HB       VAL  31 -22.741  26.599 -16.506
  235   1HG1  VAL  31          1HG1      VAL  31 -21.263  28.415 -15.596
  236   2HG1  VAL  31          2HG1      VAL  31 -20.424  26.891 -15.778
  237   3HG1  VAL  31          3HG1      VAL  31 -20.165  28.187 -16.969
  238   1HG2  VAL  31          1HG2      VAL  31 -23.142  28.983 -16.979
  239   2HG2  VAL  31          2HG2      VAL  31 -22.157  28.877 -18.440
  240   3HG2  VAL  31          3HG2      VAL  31 -23.677  27.993 -18.341
  241    H    THR  32           H        THR  32 -19.033  25.827 -18.419
  242    HA   THR  32           HA       THR  32 -18.929  23.374 -16.711
  243    HB   THR  32           HB       THR  32 -16.652  24.677 -18.238
  244    HG1  THR  32           HG1      THR  32 -17.040  23.184 -19.836
  245   1HG2  THR  32          1HG2      THR  32 -15.909  23.147 -16.447
  246   2HG2  THR  32          2HG2      THR  32 -17.033  21.911 -16.999
  247   3HG2  THR  32          3HG2      THR  32 -15.666  22.379 -18.027
  248    H    LEU  33           H        LEU  33 -18.087  23.437 -14.723
  249    HA   LEU  33           HA       LEU  33 -16.273  25.503 -13.766
  250   1HB   LEU  33          HB2       LEU  33 -17.789  26.034 -11.806
  251   2HB   LEU  33          HB3       LEU  33 -18.118  26.733 -13.388
  252    HG   LEU  33           HG       LEU  33 -19.991  25.191 -13.759
  253   1HD1  LEU  33          1HD1      LEU  33 -20.925  23.946 -11.815
  254   2HD1  LEU  33          2HD1      LEU  33 -19.362  23.296 -12.358
  255   3HD1  LEU  33          3HD1      LEU  33 -19.433  24.307 -10.901
  256   1HD2  LEU  33          1HD2      LEU  33 -21.497  26.269 -12.126
  257   2HD2  LEU  33          2HD2      LEU  33 -20.084  26.796 -11.180
  258   3HD2  LEU  33          3HD2      LEU  33 -20.320  27.423 -12.830
  259    H    ALA  34           H        ALA  34 -15.491  24.929 -11.407
  260    HA   ALA  34           HA       ALA  34 -15.643  22.007 -11.029
  261   1HB   ALA  34          HB1       ALA  34 -13.230  21.719 -11.648
  262   2HB   ALA  34          HB2       ALA  34 -14.167  22.344 -13.007
  263   3HB   ALA  34          HB3       ALA  34 -13.128  23.435 -12.030
  264    H    CYS  35           H        CYS  35 -14.757  21.106  -9.353
  265    HA   CYS  35           HA       CYS  35 -12.971  22.509  -7.553
  266   1HB   CYS  35          HB2       CYS  35 -15.182  23.127  -6.684
  267   2HB   CYS  35          HB3       CYS  35 -15.643  21.432  -6.548
  268    H    ASP  36           H        ASP  36 -11.308  20.979  -7.558
  269    HA   ASP  36           HA       ASP  36 -11.938  18.192  -8.245
  270   1HB   ASP  36          HB2       ASP  36  -9.745  17.973  -8.945
  271   2HB   ASP  36          HB3       ASP  36 -10.154  19.641  -9.348
  272    H    ALA  37           H        ALA  37 -11.669  16.377  -6.899
  273    HA   ALA  37           HA       ALA  37 -10.545  16.896  -4.153
  274   1HB   ALA  37          HB1       ALA  37 -11.951  15.034  -3.408
  275   2HB   ALA  37          HB2       ALA  37 -12.939  16.301  -4.158
  276   3HB   ALA  37          HB3       ALA  37 -12.576  14.803  -5.054
  277    H    ASP  38           H        ASP  38  -8.962  15.562  -3.361
  278    HA   ASP  38           HA       ASP  38  -8.146  13.090  -4.778
  279   1HB   ASP  38          HB2       ASP  38  -6.967  14.933  -5.936
  280   2HB   ASP  38          HB3       ASP  38  -6.337  15.516  -4.409
  281    H    GLY  39           H        GLY  39  -6.445  11.914  -3.502
  282   1HA   GLY  39          HA2       GLY  39  -5.536  12.295  -0.969
  283   2HA   GLY  39          HA3       GLY  39  -7.172  11.684  -0.689
  284    H    PHE  40           H        PHE  40  -5.287  10.016   0.289
  285    HA   PHE  40           HA       PHE  40  -5.221   7.753  -1.663
  286   1HB   PHE  40          HB2       PHE  40  -2.755   8.757  -0.221
  287   2HB   PHE  40          HB3       PHE  40  -2.911   7.242  -1.093
  288    HD1  PHE  40           HD1      PHE  40  -3.180   7.231  -3.604
  289    HD2  PHE  40           HD2      PHE  40  -2.356  10.838  -1.386
  290    HE1  PHE  40           HE1      PHE  40  -2.432   8.319  -5.676
  291    HE2  PHE  40           HE2      PHE  40  -1.632  11.944  -3.489
  292    HZ   PHE  40           HZ       PHE  40  -1.623  10.675  -5.634
  293    HA   PRO  41           HA       PRO  41  -6.226   5.768  -1.614
  294   1HB   PRO  41          HB2       PRO  41  -8.638   5.115   0.049
  295   2HB   PRO  41          HB3       PRO  41  -7.837   4.137  -1.182
  296   1HG   PRO  41          HG2       PRO  41  -7.431   3.571   1.440
  297   2HG   PRO  41          HG3       PRO  41  -6.049   3.572   0.309
  298   1HD   PRO  41          HD2       PRO  41  -6.905   5.788   2.171
  299   2HD   PRO  41          HD3       PRO  41  -5.275   5.107   1.900
  300    H    GLU  42           H        GLU  42  -7.797   6.468  -3.051
  301    HA   GLU  42           HA       GLU  42  -8.429   9.161  -3.043
  302   1HB   GLU  42          HB2       GLU  42  -9.766   8.792  -5.032
  303   2HB   GLU  42          HB3       GLU  42  -8.262   7.848  -5.055
  304   1HG   GLU  42          HG2       GLU  42  -9.565   5.818  -4.340
  305   2HG   GLU  42          HG3       GLU  42 -11.058   6.784  -4.436
  306    HA   PRO  43           HA       PRO  43 -12.012   9.527  -0.504
  307   1HB   PRO  43          HB2       PRO  43 -12.574  12.159  -0.771
  308   2HB   PRO  43          HB3       PRO  43 -10.935  11.660  -0.221
  309   1HG   PRO  43          HG2       PRO  43 -11.841  12.313  -3.043
  310   2HG   PRO  43          HG3       PRO  43 -10.471  13.053  -2.153
  311   1HD   PRO  43          HD2       PRO  43 -10.055  10.968  -3.832
  312   2HD   PRO  43          HD3       PRO  43  -9.193  11.064  -2.274
  313    H    THR  44           H        THR  44 -14.158  10.225  -0.343
  314    HA   THR  44           HA       THR  44 -15.839   9.965  -2.832
  315    HB   THR  44           HB       THR  44 -16.576   9.667   0.121
  316    HG1  THR  44           HG1      THR  44 -15.389   7.957  -0.781
  317   1HG2  THR  44          1HG2      THR  44 -18.735   8.759  -0.770
  318   2HG2  THR  44          2HG2      THR  44 -18.543  10.471  -1.116
  319   3HG2  THR  44          3HG2      THR  44 -18.263   9.268  -2.406
  320    H    MET  45           H        MET  45 -16.882  11.858  -3.476
  321    HA   MET  45           HA       MET  45 -16.863  14.173  -1.631
  322   1HB   MET  45          HB2       MET  45 -15.807  15.589  -3.271
  323   2HB   MET  45          HB3       MET  45 -14.793  14.183  -3.015
  324   1HG   MET  45          HG2       MET  45 -14.719  14.188  -5.311
  325   2HG   MET  45          HG3       MET  45 -16.210  13.265  -5.132
  326   1HE   MET  45          HE1       MET  45 -15.162  17.104  -4.923
  327   2HE   MET  45          HE2       MET  45 -14.464  16.466  -6.434
  328   3HE   MET  45          HE3       MET  45 -15.746  17.669  -6.514
  329    H    THR  46           H        THR  46 -18.300  15.821  -2.019
  330    HA   THR  46           HA       THR  46 -20.257  15.681  -4.203
  331    HB   THR  46           HB       THR  46 -22.244  15.803  -2.715
  332    HG1  THR  46           HG1      THR  46 -21.974  15.158  -0.543
  333   1HG2  THR  46          1HG2      THR  46 -21.603  13.602  -3.648
  334   2HG2  THR  46          2HG2      THR  46 -20.765  13.240  -2.106
  335   3HG2  THR  46          3HG2      THR  46 -22.514  13.529  -2.154
  336    H    TRP  47           H        TRP  47 -21.869  17.549  -3.955
  337    HA   TRP  47           HA       TRP  47 -20.958  19.837  -2.458
  338   1HB   TRP  47          HB2       TRP  47 -20.570  21.269  -4.513
  339   2HB   TRP  47          HB3       TRP  47 -19.318  20.256  -3.914
  340    HD1  TRP  47           HD1      TRP  47 -18.781  17.919  -5.210
  341    HE1  TRP  47           HE1      TRP  47 -18.015  17.921  -7.653
  342    HE3  TRP  47           HE3      TRP  47 -21.083  22.215  -6.754
  343    HZ2  TRP  47           HZ2      TRP  47 -17.976  19.811  -9.826
  344    HZ3  TRP  47           HZ3      TRP  47 -20.492  23.208  -8.959
  345    HH2  TRP  47           HH2      TRP  47 -18.925  22.030 -10.466
  346    H    THR  48           H        THR  48 -22.224  21.801  -2.715
  347    HA   THR  48           HA       THR  48 -25.094  20.979  -3.074
  348    HB   THR  48           HB       THR  48 -25.620  22.401  -1.216
  349    HG1  THR  48           HG1      THR  48 -23.908  23.304  -0.016
  350   1HG2  THR  48          1HG2      THR  48 -24.607  21.185   0.578
  351   2HG2  THR  48          2HG2      THR  48 -24.904  20.048  -0.745
  352   3HG2  THR  48          3HG2      THR  48 -23.257  20.644  -0.452
  353    H    LYS  49           H        LYS  49 -26.687  22.446  -3.576
  354    HA   LYS  49           HA       LYS  49 -25.896  24.694  -5.401
  355   1HB   LYS  49          HB2       LYS  49 -27.333  22.617  -6.029
  356   2HB   LYS  49          HB3       LYS  49 -28.608  23.330  -5.074
  357   1HG   LYS  49          HG2       LYS  49 -29.116  24.010  -7.248
  358   2HG   LYS  49          HG3       LYS  49 -28.331  25.440  -6.608
  359   1HD   LYS  49          HD2       LYS  49 -26.218  24.781  -7.746
  360   2HD   LYS  49          HD3       LYS  49 -26.993  23.312  -8.334
  361   1HE   LYS  49          HE2       LYS  49 -28.655  24.704  -9.572
  362   2HE   LYS  49          HE3       LYS  49 -27.853  26.162  -8.970
  363   1HZ   LYS  49          HZ1       LYS  49 -26.655  24.158 -10.759
  364   2HZ   LYS  49          HZ2       LYS  49 -27.120  25.682 -11.187
  365   3HZ   LYS  49          HZ3       LYS  49 -25.865  25.459 -10.167
  366    H    ASP  50           H        ASP  50 -25.469  25.476  -2.947
  367    HA   ASP  50           HA       ASP  50 -25.929  26.848  -1.195
  368   1HB   ASP  50          HB2       ASP  50 -26.094  28.396  -3.141
  369   2HB   ASP  50          HB3       ASP  50 -27.834  28.221  -3.125
  370    H    GLY  51           H        GLY  51 -27.631  24.407  -1.298
  371   1HA   GLY  51          HA2       GLY  51 -29.086  24.768   1.025
  372   2HA   GLY  51          HA3       GLY  51 -30.268  25.028  -0.268
  373    H    GLU  52           H        GLU  52 -28.705  22.834  -1.870
  374    HA   GLU  52           HA       GLU  52 -29.196  20.407  -0.304
  375   1HB   GLU  52          HB2       GLU  52 -30.901  19.495  -1.795
  376   2HB   GLU  52          HB3       GLU  52 -31.447  21.009  -1.064
  377   1HG   GLU  52          HG2       GLU  52 -30.848  22.181  -3.244
  378   2HG   GLU  52          HG3       GLU  52 -30.397  20.620  -3.909
  379    HA   PRO  53           HA       PRO  53 -25.982  18.818  -2.670
  380   1HB   PRO  53          HB2       PRO  53 -27.374  16.194  -3.114
  381   2HB   PRO  53          HB3       PRO  53 -25.783  16.513  -2.383
  382   1HG   PRO  53          HG2       PRO  53 -27.900  15.922  -0.802
  383   2HG   PRO  53          HG3       PRO  53 -26.776  17.239  -0.349
  384   1HD   PRO  53          HD2       PRO  53 -29.455  17.505  -1.731
  385   2HD   PRO  53          HD3       PRO  53 -28.834  18.397  -0.316
  386    H    ILE  54           H        ILE  54 -25.060  18.585  -4.591
  387    HA   ILE  54           HA       ILE  54 -26.579  18.280  -7.140
  388    HB   ILE  54           HB       ILE  54 -23.744  19.285  -6.607
  389   1HG1  ILE  54          2HG1      ILE  54 -26.145  20.993  -7.418
  390   2HG1  ILE  54          3HG1      ILE  54 -25.679  20.760  -5.727
  391   1HG2  ILE  54          1HG2      ILE  54 -25.441  19.412  -9.157
  392   2HG2  ILE  54          2HG2      ILE  54 -23.845  20.184  -8.950
  393   3HG2  ILE  54          3HG2      ILE  54 -23.981  18.446  -8.941
  394   1HD1  ILE  54          1HD1      ILE  54 -24.811  22.836  -6.613
  395   2HD1  ILE  54          2HD1      ILE  54 -23.525  21.704  -6.055
  396   3HD1  ILE  54          3HD1      ILE  54 -23.821  21.956  -7.775
  397    H    GLU  55           H        GLU  55 -26.517  16.141  -5.551
  398    HA   GLU  55           HA       GLU  55 -24.361  14.385  -5.631
  399   1HB   GLU  55          HB2       GLU  55 -26.012  12.652  -4.997
  400   2HB   GLU  55          HB3       GLU  55 -26.180  14.146  -4.074
  401   1HG   GLU  55          HG2       GLU  55 -28.148  14.765  -5.534
  402   2HG   GLU  55          HG3       GLU  55 -28.003  13.190  -6.313
  403    H    GLN  56           H        GLN  56 -23.450  13.249  -7.074
  404    HA   GLN  56           HA       GLN  56 -23.985  13.451  -9.799
  405   1HB   GLN  56          HB2       GLN  56 -22.128  11.489  -8.364
  406   2HB   GLN  56          HB3       GLN  56 -22.046  11.967 -10.034
  407   1HG   GLN  56          HG2       GLN  56 -20.483  13.406  -9.325
  408   2HG   GLN  56          HG3       GLN  56 -21.860  14.446  -9.027
  409   1HE2  GLN  56          1HE2      GLN  56 -19.508  13.429  -5.902
  410   2HE2  GLN  56          2HE2      GLN  56 -19.062  13.130  -7.574
  411    H    GLU  57           H        GLU  57 -25.260  11.123  -7.601
  412    HA   GLU  57           HA       GLU  57 -25.576   9.032  -9.622
  413   1HB   GLU  57          HB2       GLU  57 -26.417   8.880  -6.706
  414   2HB   GLU  57          HB3       GLU  57 -26.078   7.577  -7.808
  415   1HG   GLU  57          HG2       GLU  57 -24.081   7.475  -6.845
  416   2HG   GLU  57          HG3       GLU  57 -23.656   8.819  -7.894
  417    H    ASP  58           H        ASP  58 -27.530  11.555  -8.602
  418    HA   ASP  58           HA       ASP  58 -30.017  10.267  -9.633
  419   1HB   ASP  58          HB2       ASP  58 -29.763   9.576  -7.211
  420   2HB   ASP  58          HB3       ASP  58 -29.831  11.291  -6.779
  421    H    ASN  59           H        ASN  59 -28.303  13.226  -8.717
  422    HA   ASN  59           HA       ASN  59 -30.648  14.869  -9.580
  423   1HB   ASN  59          HB2       ASN  59 -29.605  15.276  -7.382
  424   2HB   ASN  59          HB3       ASN  59 -28.054  15.610  -8.127
  425   1HD2  ASN  59          1HD2      ASN  59 -28.939  18.954  -8.870
  426   2HD2  ASN  59          2HD2      ASN  59 -27.738  17.652  -9.035
  427    H    GLU  60           H        GLU  60 -28.625  13.271 -11.291
  428    HA   GLU  60           HA       GLU  60 -27.068  15.062 -12.867
  429   1HB   GLU  60          HB2       GLU  60 -26.874  12.553 -12.292
  430   2HB   GLU  60          HB3       GLU  60 -28.024  12.281 -13.615
  431   1HG   GLU  60          HG2       GLU  60 -26.376  13.272 -15.197
  432   2HG   GLU  60          HG3       GLU  60 -25.299  13.653 -13.852
  433    H    GLU  61           H        GLU  61 -30.214  15.264 -12.904
  434    HA   GLU  61           HA       GLU  61 -31.218  14.705 -15.439
  435   1HB   GLU  61          HB2       GLU  61 -33.057  16.134 -14.930
  436   2HB   GLU  61          HB3       GLU  61 -32.574  15.249 -13.473
  437   1HG   GLU  61          HG2       GLU  61 -31.461  17.260 -12.627
  438   2HG   GLU  61          HG3       GLU  61 -31.886  18.150 -14.087
  439    H    LYS  62           H        LYS  62 -29.030  17.290 -14.796
  440    HA   LYS  62           HA       LYS  62 -28.802  17.737 -17.620
  441   1HB   LYS  62          HB2       LYS  62 -29.164  20.127 -17.735
  442   2HB   LYS  62          HB3       LYS  62 -30.632  19.285 -17.265
  443   1HG   LYS  62          HG2       LYS  62 -30.092  19.903 -14.830
  444   2HG   LYS  62          HG3       LYS  62 -28.821  20.967 -15.470
  445   1HD   LYS  62          HD2       LYS  62 -30.604  22.036 -16.942
  446   2HD   LYS  62          HD3       LYS  62 -31.806  21.063 -16.061
  447   1HE   LYS  62          HE2       LYS  62 -31.719  23.300 -15.133
  448   2HE   LYS  62          HE3       LYS  62 -31.066  22.173 -13.924
  449   1HZ   LYS  62          HZ1       LYS  62 -28.864  22.896 -14.466
  450   2HZ   LYS  62          HZ2       LYS  62 -29.366  23.744 -15.777
  451   3HZ   LYS  62          HZ3       LYS  62 -29.744  24.237 -14.241
  452    H    TYR  63           H        TYR  63 -26.988  16.576 -16.091
  453    HA   TYR  63           HA       TYR  63 -24.803  18.244 -16.930
  454   1HB   TYR  63          HB2       TYR  63 -23.531  18.255 -14.755
  455   2HB   TYR  63          HB3       TYR  63 -24.901  19.285 -14.872
  456    HD1  TYR  63           HD1      TYR  63 -26.435  19.375 -13.165
  457    HD2  TYR  63           HD2      TYR  63 -23.895  15.949 -13.503
  458    HE1  TYR  63           HE1      TYR  63 -27.101  18.690 -10.901
  459    HE2  TYR  63           HE2      TYR  63 -24.573  15.199 -11.248
  460    HH   TYR  63           HH       TYR  63 -25.891  15.634  -9.425
  461    H    SER  64           H        SER  64 -22.666  17.407 -16.570
  462    HA   SER  64           HA       SER  64 -22.224  14.524 -16.334
  463   1HB   SER  64          HB2       SER  64 -21.216  14.430 -18.635
  464   2HB   SER  64          HB3       SER  64 -22.997  14.508 -18.560
  465    HG   SER  64           HG       SER  64 -21.849  15.899 -20.148
  466    H    PHE  65           H        PHE  65 -20.108  14.033 -15.862
  467    HA   PHE  65           HA       PHE  65 -18.104  16.177 -15.831
  468   1HB   PHE  65          HB2       PHE  65 -17.983  15.857 -13.453
  469   2HB   PHE  65          HB3       PHE  65 -19.674  16.123 -13.916
  470    HD1  PHE  65           HD1      PHE  65 -17.265  13.887 -12.355
  471    HD2  PHE  65           HD2      PHE  65 -21.314  14.168 -13.823
  472    HE1  PHE  65           HE1      PHE  65 -17.851  11.787 -11.169
  473    HE2  PHE  65           HE2      PHE  65 -21.907  12.101 -12.608
  474    HZ   PHE  65           HZ       PHE  65 -20.175  10.883 -11.311
  475    H    ASN  66           H        ASN  66 -16.077  15.416 -14.656
  476    HA   ASN  66           HA       ASN  66 -15.015  13.045 -16.102
  477   1HB   ASN  66          HB2       ASN  66 -12.994  14.269 -16.296
  478   2HB   ASN  66          HB3       ASN  66 -14.294  15.395 -16.630
  479   1HD2  ASN  66          1HD2      ASN  66 -11.829  17.029 -14.331
  480   2HD2  ASN  66          2HD2      ASN  66 -11.785  16.344 -15.937
  481    H    TYR  67           H        TYR  67 -12.642  12.593 -15.004
  482    HA   TYR  67           HA       TYR  67 -13.063  11.195 -12.490
  483   1HB   TYR  67          HB2       TYR  67 -10.597  10.762 -12.708
  484   2HB   TYR  67          HB3       TYR  67 -11.604  10.236 -14.044
  485    HD1  TYR  67           HD1      TYR  67 -11.184  10.937 -16.280
  486    HD2  TYR  67           HD2      TYR  67  -9.300  12.982 -12.992
  487    HE1  TYR  67           HE1      TYR  67  -9.811  12.245 -17.887
  488    HE2  TYR  67           HE2      TYR  67  -7.908  14.287 -14.588
  489    HH   TYR  67           HH       TYR  67  -8.199  13.817 -18.150
  490    H    ASP  68           H        ASP  68 -11.771  11.555 -10.549
  491    HA   ASP  68           HA       ASP  68 -11.338  12.763  -8.673
  492   1HB   ASP  68          HB2       ASP  68 -10.439  15.007 -10.504
  493   2HB   ASP  68          HB3       ASP  68 -10.139  14.909  -8.802
  494    H    GLY  69           H        GLY  69 -13.931  13.232 -10.460
  495   1HA   GLY  69          HA2       GLY  69 -15.878  14.393 -10.411
  496   2HA   GLY  69          HA3       GLY  69 -15.593  14.585  -8.677
  497    H    SER  70           H        SER  70 -13.570  15.917 -11.308
  498    HA   SER  70           HA       SER  70 -13.516  18.457  -9.867
  499   1HB   SER  70          HB2       SER  70 -11.428  17.432 -10.532
  500   2HB   SER  70          HB3       SER  70 -12.005  17.247 -12.199
  501    HG   SER  70           HG       SER  70 -10.567  18.982 -11.971
  502    H    GLU  71           H        GLU  71 -13.867  17.753 -13.388
  503    HA   GLU  71           HA       GLU  71 -15.072  20.426 -13.808
  504   1HB   GLU  71          HB2       GLU  71 -14.461  18.166 -15.758
  505   2HB   GLU  71          HB3       GLU  71 -15.122  19.749 -16.173
  506   1HG   GLU  71          HG2       GLU  71 -13.108  20.832 -15.271
  507   2HG   GLU  71          HG3       GLU  71 -12.380  19.277 -14.948
  508    H    LEU  72           H        LEU  72 -17.179  20.656 -13.282
  509    HA   LEU  72           HA       LEU  72 -19.105  18.539 -14.154
  510   1HB   LEU  72          HB2       LEU  72 -19.167  19.179 -11.753
  511   2HB   LEU  72          HB3       LEU  72 -19.434  20.877 -12.262
  512    HG   LEU  72           HG       LEU  72 -21.586  20.133 -13.330
  513   1HD1  LEU  72          1HD1      LEU  72 -20.809  17.467 -12.124
  514   2HD1  LEU  72          2HD1      LEU  72 -22.481  17.904 -12.504
  515   3HD1  LEU  72          3HD1      LEU  72 -21.292  17.838 -13.798
  516   1HD2  LEU  72          1HD2      LEU  72 -21.346  19.428 -10.360
  517   2HD2  LEU  72          2HD2      LEU  72 -21.555  21.072 -11.010
  518   3HD2  LEU  72          3HD2      LEU  72 -22.841  19.865 -11.221
  519    H    ILE  73           H        ILE  73 -20.236  18.932 -15.956
  520    HA   ILE  73           HA       ILE  73 -20.419  21.723 -17.004
  521    HB   ILE  73           HB       ILE  73 -20.914  19.144 -18.496
  522   1HG1  ILE  73          2HG1      ILE  73 -18.361  20.691 -18.948
  523   2HG1  ILE  73          3HG1      ILE  73 -18.411  19.505 -17.625
  524   1HG2  ILE  73          1HG2      ILE  73 -20.307  22.021 -19.391
  525   2HG2  ILE  73          2HG2      ILE  73 -20.758  20.698 -20.472
  526   3HG2  ILE  73          3HG2      ILE  73 -21.947  21.324 -19.336
  527   1HD1  ILE  73          1HD1      ILE  73 -17.543  18.510 -19.678
  528   2HD1  ILE  73          2HD1      ILE  73 -18.997  17.710 -19.054
  529   3HD1  ILE  73          3HD1      ILE  73 -19.088  18.784 -20.492
  530    H    ILE  74           H        ILE  74 -22.276  22.650 -16.686
  531    HA   ILE  74           HA       ILE  74 -24.746  21.055 -16.169
  532    HB   ILE  74           HB       ILE  74 -23.889  23.825 -15.274
  533   1HG1  ILE  74          2HG1      ILE  74 -24.828  21.376 -13.686
  534   2HG1  ILE  74          3HG1      ILE  74 -23.117  21.703 -14.033
  535   1HG2  ILE  74          1HG2      ILE  74 -26.293  23.977 -15.873
  536   2HG2  ILE  74          2HG2      ILE  74 -26.623  22.547 -14.894
  537   3HG2  ILE  74          3HG2      ILE  74 -26.083  24.022 -14.130
  538   1HD1  ILE  74          1HD1      ILE  74 -24.938  23.376 -12.306
  539   2HD1  ILE  74          2HD1      ILE  74 -23.511  22.475 -11.816
  540   3HD1  ILE  74          3HD1      ILE  74 -23.339  23.916 -12.838
  541    H    LYS  75           H        LYS  75 -26.536  21.387 -17.406
  542    HA   LYS  75           HA       LYS  75 -26.241  23.233 -19.743
  543   1HB   LYS  75          HB2       LYS  75 -28.413  21.157 -19.625
  544   2HB   LYS  75          HB3       LYS  75 -27.547  21.817 -21.018
  545   1HG   LYS  75          HG2       LYS  75 -26.559  19.750 -19.011
  546   2HG   LYS  75          HG3       LYS  75 -27.065  19.434 -20.653
  547   1HD   LYS  75          HD2       LYS  75 -25.120  20.280 -21.632
  548   2HD   LYS  75          HD3       LYS  75 -24.786  21.357 -20.275
  549   1HE   LYS  75          HE2       LYS  75 -23.140  19.646 -20.272
  550   2HE   LYS  75          HE3       LYS  75 -24.143  19.476 -18.858
  551   1HZ   LYS  75          HZ1       LYS  75 -24.429  17.849 -21.337
  552   2HZ   LYS  75          HZ2       LYS  75 -23.698  17.341 -19.953
  553   3HZ   LYS  75          HZ3       LYS  75 -25.302  17.633 -19.980
  554    H    LYS  76           H        LYS  76 -28.061  24.447 -20.416
  555    HA   LYS  76           HA       LYS  76 -29.884  25.807 -20.231
  556   1HB   LYS  76          HB2       LYS  76 -31.197  23.605 -18.599
  557   2HB   LYS  76          HB3       LYS  76 -32.001  24.793 -19.598
  558   1HG   LYS  76          HG2       LYS  76 -30.271  22.469 -20.545
  559   2HG   LYS  76          HG3       LYS  76 -32.027  22.602 -20.640
  560   1HD   LYS  76          HD2       LYS  76 -31.800  24.493 -22.231
  561   2HD   LYS  76          HD3       LYS  76 -30.027  24.381 -22.124
  562   1HE   LYS  76          HE2       LYS  76 -30.081  22.090 -22.970
  563   2HE   LYS  76          HE3       LYS  76 -31.837  22.084 -22.999
  564   1HZ   LYS  76          HZ1       LYS  76 -30.896  22.578 -25.194
  565   2HZ   LYS  76          HZ2       LYS  76 -31.747  23.861 -24.687
  566   3HZ   LYS  76          HZ3       LYS  76 -30.116  23.892 -24.634
  567    H    VAL  77           H        VAL  77 -28.078  26.696 -18.635
  568    HA   VAL  77           HA       VAL  77 -28.910  27.299 -15.924
  569    HB   VAL  77           HB       VAL  77 -26.960  28.672 -17.817
  570   1HG1  VAL  77          1HG1      VAL  77 -26.026  29.740 -15.795
  571   2HG1  VAL  77          2HG1      VAL  77 -27.664  30.339 -16.125
  572   3HG1  VAL  77          3HG1      VAL  77 -27.381  29.128 -14.831
  573   1HG2  VAL  77          1HG2      VAL  77 -25.250  27.584 -16.430
  574   2HG2  VAL  77          2HG2      VAL  77 -26.513  26.769 -15.475
  575   3HG2  VAL  77          3HG2      VAL  77 -26.280  26.378 -17.199
  576    H    ASP  78           H        ASP  78 -29.940  29.023 -15.071
  577    HA   ASP  78           HA       ASP  78 -30.883  31.273 -16.585
  578   1HB   ASP  78          HB2       ASP  78 -32.508  29.233 -17.009
  579   2HB   ASP  78          HB3       ASP  78 -33.098  29.616 -15.384
  580    H    LYS  79           H        LYS  79 -32.709  32.344 -14.941
  581    HA   LYS  79           HA       LYS  79 -31.104  33.510 -12.919
  582   1HB   LYS  79          HB2       LYS  79 -34.110  33.477 -13.381
  583   2HB   LYS  79          HB3       LYS  79 -33.348  34.526 -12.165
  584   1HG   LYS  79          HG2       LYS  79 -32.159  35.800 -13.813
  585   2HG   LYS  79          HG3       LYS  79 -32.516  34.620 -15.092
  586   1HD   LYS  79          HD2       LYS  79 -34.682  36.241 -13.727
  587   2HD   LYS  79          HD3       LYS  79 -33.839  36.761 -15.198
  588   1HE   LYS  79          HE2       LYS  79 -34.521  34.687 -16.366
  589   2HE   LYS  79          HE3       LYS  79 -35.364  34.129 -14.934
  590   1HZ   LYS  79          HZ1       LYS  79 -36.831  36.070 -15.118
  591   2HZ   LYS  79          HZ2       LYS  79 -36.041  36.577 -16.468
  592   3HZ   LYS  79          HZ3       LYS  79 -36.896  35.185 -16.489
  593    H    SER  80           H        SER  80 -33.329  30.781 -12.642
  594    HA   SER  80           HA       SER  80 -33.198  30.647  -9.717
  595   1HB   SER  80          HB2       SER  80 -34.570  28.588 -10.125
  596   2HB   SER  80          HB3       SER  80 -35.273  30.092 -10.764
  597    HG   SER  80           HG       SER  80 -35.399  28.389 -12.307
  598    H    ASP  81           H        ASP  81 -31.015  29.747 -12.115
  599    HA   ASP  81           HA       ASP  81 -30.067  27.278 -10.783
  600   1HB   ASP  81          HB2       ASP  81 -30.394  27.752 -13.351
  601   2HB   ASP  81          HB3       ASP  81 -28.836  28.553 -13.214
  602    H    GLU  82           H        GLU  82 -29.501  30.565 -10.433
  603    HA   GLU  82           HA       GLU  82 -26.751  30.905  -9.863
  604   1HB   GLU  82          HB2       GLU  82 -28.349  32.709  -9.970
  605   2HB   GLU  82          HB3       GLU  82 -29.327  32.050  -8.681
  606   1HG   GLU  82          HG2       GLU  82 -27.806  32.686  -7.022
  607   2HG   GLU  82          HG3       GLU  82 -26.454  32.843  -8.141
  608    H    ALA  83           H        ALA  83 -25.421  30.493  -8.073
  609    HA   ALA  83           HA       ALA  83 -26.426  28.962  -5.750
  610   1HB   ALA  83          HB1       ALA  83 -24.689  27.684  -7.933
  611   2HB   ALA  83          HB2       ALA  83 -25.177  26.897  -6.430
  612   3HB   ALA  83          HB3       ALA  83 -26.400  27.296  -7.640
  613    H    GLU  84           H        GLU  84 -24.800  28.272  -4.397
  614    HA   GLU  84           HA       GLU  84 -22.062  29.414  -4.538
  615   1HB   GLU  84          HB2       GLU  84 -23.301  30.761  -2.952
  616   2HB   GLU  84          HB3       GLU  84 -23.822  29.300  -2.081
  617   1HG   GLU  84          HG2       GLU  84 -21.511  28.823  -1.433
  618   2HG   GLU  84          HG3       GLU  84 -20.920  30.077  -2.517
  619    H    TYR  85           H        TYR  85 -20.932  27.684  -5.033
  620    HA   TYR  85           HA       TYR  85 -21.902  24.952  -4.498
  621   1HB   TYR  85          HB2       TYR  85 -19.615  25.995  -6.166
  622   2HB   TYR  85          HB3       TYR  85 -20.103  24.326  -6.057
  623    HD1  TYR  85           HD1      TYR  85 -20.468  27.280  -7.990
  624    HD2  TYR  85           HD2      TYR  85 -22.611  23.849  -6.575
  625    HE1  TYR  85           HE1      TYR  85 -22.003  27.410  -9.961
  626    HE2  TYR  85           HE2      TYR  85 -24.094  23.929  -8.601
  627    HH   TYR  85           HH       TYR  85 -23.733  26.394 -11.124
  628    H    ILE  86           H        ILE  86 -21.525  24.987  -2.197
  629    HA   ILE  86           HA       ILE  86 -18.733  24.927  -1.243
  630    HB   ILE  86           HB       ILE  86 -21.263  24.003   0.152
  631   1HG1  ILE  86          2HG1      ILE  86 -19.693  26.614   0.367
  632   2HG1  ILE  86          3HG1      ILE  86 -21.302  26.432  -0.348
  633   1HG2  ILE  86          1HG2      ILE  86 -19.806  24.023   2.172
  634   2HG2  ILE  86          2HG2      ILE  86 -19.185  22.910   0.970
  635   3HG2  ILE  86          3HG2      ILE  86 -18.412  24.469   1.164
  636   1HD1  ILE  86          1HD1      ILE  86 -21.628  27.326   1.829
  637   2HD1  ILE  86          2HD1      ILE  86 -22.172  25.652   1.860
  638   3HD1  ILE  86          3HD1      ILE  86 -20.599  26.110   2.576
  639    H    CYS  87           H        CYS  87 -17.424  23.293  -1.535
  640    HA   CYS  87           HA       CYS  87 -18.430  20.599  -2.252
  641   1HB   CYS  87          HB2       CYS  87 -16.142  20.381  -3.394
  642   2HB   CYS  87          HB3       CYS  87 -17.392  21.323  -4.205
  643    H    ILE  88           H        ILE  88 -17.733  18.867  -1.402
  644    HA   ILE  88           HA       ILE  88 -15.974  19.045   1.006
  645    HB   ILE  88           HB       ILE  88 -18.751  17.791   0.868
  646   1HG1  ILE  88          2HG1      ILE  88 -17.834  20.288   2.368
  647   2HG1  ILE  88          3HG1      ILE  88 -18.887  20.267   0.974
  648   1HG2  ILE  88          1HG2      ILE  88 -16.813  18.049   3.235
  649   2HG2  ILE  88          2HG2      ILE  88 -18.453  17.388   3.308
  650   3HG2  ILE  88          3HG2      ILE  88 -17.239  16.519   2.379
  651   1HD1  ILE  88          1HD1      ILE  88 -20.279  20.600   2.856
  652   2HD1  ILE  88          2HD1      ILE  88 -20.568  18.933   2.320
  653   3HD1  ILE  88          3HD1      ILE  88 -19.547  19.262   3.738
  654    H    ALA  89           H        ALA  89 -14.782  17.228   1.368
  655    HA   ALA  89           HA       ALA  89 -15.360  14.745  -0.158
  656   1HB   ALA  89          HB1       ALA  89 -12.658  16.148  -0.055
  657   2HB   ALA  89          HB2       ALA  89 -12.993  14.546  -0.757
  658   3HB   ALA  89          HB3       ALA  89 -13.706  15.981  -1.506
  659    H    GLU  90           H        GLU  90 -14.746  12.867   0.863
  660    HA   GLU  90           HA       GLU  90 -13.582  12.987   3.628
  661   1HB   GLU  90          HB2       GLU  90 -16.057  13.240   3.737
  662   2HB   GLU  90          HB3       GLU  90 -16.256  11.728   2.857
  663   1HG   GLU  90          HG2       GLU  90 -15.071  10.510   4.679
  664   2HG   GLU  90          HG3       GLU  90 -14.895  12.067   5.554
  665    H    ASN  91           H        ASN  91 -12.444  11.132   4.156
  666    HA   ASN  91           HA       ASN  91 -12.875   8.671   2.630
  667   1HB   ASN  91          HB2       ASN  91 -10.731   8.272   1.806
  668   2HB   ASN  91          HB3       ASN  91 -11.082   9.905   1.365
  669   1HD2  ASN  91          1HD2      ASN  91  -7.591   9.927   2.426
  670   2HD2  ASN  91          2HD2      ASN  91  -8.521   9.094   1.190
  671    H    LYS  92           H        LYS  92 -10.912   7.110   3.680
  672    HA   LYS  92           HA       LYS  92 -11.777   6.651   6.423
  673   1HB   LYS  92          HB2       LYS  92  -9.910   4.943   6.391
  674   2HB   LYS  92          HB3       LYS  92 -11.245   4.716   5.257
  675   1HG   LYS  92          HG2       LYS  92  -8.744   6.129   4.294
  676   2HG   LYS  92          HG3       LYS  92  -8.655   4.399   4.597
  677   1HD   LYS  92          HD2       LYS  92 -10.765   5.569   2.757
  678   2HD   LYS  92          HD3       LYS  92  -9.175   5.034   2.240
  679   1HE   LYS  92          HE2       LYS  92  -9.615   2.767   3.031
  680   2HE   LYS  92          HE3       LYS  92 -11.167   3.283   3.735
  681   1HZ   LYS  92          HZ1       LYS  92 -10.526   3.297   0.847
  682   2HZ   LYS  92          HZ2       LYS  92 -11.511   2.216   1.602
  683   3HZ   LYS  92          HZ3       LYS  92 -11.952   3.773   1.475
  684    H    ALA  93           H        ALA  93  -9.209   8.554   5.155
  685    HA   ALA  93           HA       ALA  93  -7.684   8.622   7.691
  686   1HB   ALA  93          HB1       ALA  93  -6.077   9.862   6.374
  687   2HB   ALA  93          HB2       ALA  93  -6.559   8.382   5.539
  688   3HB   ALA  93          HB3       ALA  93  -7.199   9.949   5.006
  689    H    GLY  94           H        GLY  94 -10.016  10.725   5.967
  690   1HA   GLY  94          HA2       GLY  94 -10.487  12.401   8.193
  691   2HA   GLY  94          HA3       GLY  94  -9.254  13.197   7.171
  692    H    GLU  95           H        GLU  95 -10.743  14.928   6.929
  693    HA   GLU  95           HA       GLU  95 -12.709  14.643   4.749
  694   1HB   GLU  95          HB2       GLU  95 -13.876  14.244   6.942
  695   2HB   GLU  95          HB3       GLU  95 -13.374  15.854   7.443
  696   1HG   GLU  95          HG2       GLU  95 -14.699  16.830   5.561
  697   2HG   GLU  95          HG3       GLU  95 -15.130  15.185   5.047
  698    H    GLN  96           H        GLN  96 -13.008  16.641   3.599
  699    HA   GLN  96           HA       GLN  96 -11.679  19.120   4.536
  700   1HB   GLN  96          HB2       GLN  96 -10.202  17.326   3.120
  701   2HB   GLN  96          HB3       GLN  96 -10.966  18.148   1.771
  702   1HG   GLN  96          HG2       GLN  96  -8.909  19.229   2.063
  703   2HG   GLN  96          HG3       GLN  96 -10.090  20.349   2.771
  704   1HE2  GLN  96          1HE2      GLN  96  -7.432  18.319   5.231
  705   2HE2  GLN  96          2HE2      GLN  96  -7.757  17.718   3.605
  706    H    ASP  97           H        ASP  97 -12.031  20.985   2.921
  707    HA   ASP  97           HA       ASP  97 -14.357  20.751   1.199
  708   1HB   ASP  97          HB2       ASP  97 -15.756  22.326   2.398
  709   2HB   ASP  97          HB3       ASP  97 -15.398  20.915   3.391
  710    H    ALA  98           H        ALA  98 -14.879  22.641  -0.016
  711    HA   ALA  98           HA       ALA  98 -13.397  25.169   0.195
  712   1HB   ALA  98          HB1       ALA  98 -11.839  23.796  -1.171
  713   2HB   ALA  98          HB2       ALA  98 -13.125  23.426  -2.326
  714   3HB   ALA  98          HB3       ALA  98 -12.544  25.108  -2.148
  715    H    THR  99           H        THR  99 -14.174  26.611  -1.875
  716    HA   THR  99           HA       THR  99 -17.118  26.242  -2.289
  717    HB   THR  99           HB       THR  99 -15.841  28.718  -1.096
  718    HG1  THR  99           HG1      THR  99 -16.834  28.172   0.785
  719   1HG2  THR  99          1HG2      THR  99 -18.770  27.985  -1.642
  720   2HG2  THR  99          2HG2      THR  99 -18.219  29.375  -0.636
  721   3HG2  THR  99          3HG2      THR  99 -17.862  29.333  -2.351
  722    H    ILE 100           H        ILE 100 -17.853  26.953  -4.179
  723    HA   ILE 100           HA       ILE 100 -16.384  29.052  -5.743
  724    HB   ILE 100           HB       ILE 100 -18.361  27.339  -7.155
  725   1HG1  ILE 100          2HG1      ILE 100 -15.594  26.114  -6.719
  726   2HG1  ILE 100          3HG1      ILE 100 -17.085  25.548  -5.982
  727   1HG2  ILE 100          1HG2      ILE 100 -15.690  28.440  -7.972
  728   2HG2  ILE 100          2HG2      ILE 100 -16.856  27.682  -9.061
  729   3HG2  ILE 100          3HG2      ILE 100 -17.247  29.206  -8.304
  730   1HD1  ILE 100          1HD1      ILE 100 -18.087  25.196  -8.240
  731   2HD1  ILE 100          2HD1      ILE 100 -16.468  25.520  -8.933
  732   3HD1  ILE 100          3HD1      ILE 100 -16.719  24.164  -7.842
  733    H    HIS 101           H        HIS 101 -17.815  30.543  -6.915
  734    HA   HIS 101           HA       HIS 101 -20.679  30.624  -5.998
  735   1HB   HIS 101          HB2       HIS 101 -18.934  32.963  -6.763
  736   2HB   HIS 101          HB3       HIS 101 -20.565  33.013  -6.119
  737    HD1  HIS 101           HD1      HIS 101 -20.730  32.298  -3.399
  738    HD2  HIS 101           HD2      HIS 101 -16.909  32.874  -5.059
  739    HE1  HIS 101           HE1      HIS 101 -19.136  32.498  -1.440
  740    H    LEU 102           H        LEU 102 -22.240  31.352  -7.575
  741    HA   LEU 102           HA       LEU 102 -21.354  31.802 -10.360
  742   1HB   LEU 102          HB2       LEU 102 -21.865  29.494 -10.410
  743   2HB   LEU 102          HB3       LEU 102 -23.273  29.674  -9.360
  744    HG   LEU 102           HG       LEU 102 -24.529  30.758 -11.198
  745   1HD1  LEU 102          1HD1      LEU 102 -22.670  31.889 -12.376
  746   2HD1  LEU 102          2HD1      LEU 102 -22.026  30.315 -12.889
  747   3HD1  LEU 102          3HD1      LEU 102 -23.590  30.888 -13.493
  748   1HD2  LEU 102          1HD2      LEU 102 -24.594  28.349 -11.011
  749   2HD2  LEU 102          2HD2      LEU 102 -24.741  28.866 -12.684
  750   3HD2  LEU 102          3HD2      LEU 102 -23.175  28.217 -12.091
  751    H    LYS 103           H        LYS 103 -21.932  33.849 -10.581
  752    HA   LYS 103           HA       LYS 103 -24.527  34.870  -9.477
  753   1HB   LYS 103          HB2       LYS 103 -22.055  36.294 -10.519
  754   2HB   LYS 103          HB3       LYS 103 -23.539  37.082  -9.988
  755   1HG   LYS 103          HG2       LYS 103 -23.270  36.079  -7.723
  756   2HG   LYS 103          HG3       LYS 103 -21.790  35.304  -8.242
  757   1HD   LYS 103          HD2       LYS 103 -21.214  37.253  -6.975
  758   2HD   LYS 103          HD3       LYS 103 -20.784  37.587  -8.665
  759   1HE   LYS 103          HE2       LYS 103 -22.887  38.882  -8.907
  760   2HE   LYS 103          HE3       LYS 103 -23.330  38.483  -7.241
  761   1HZ   LYS 103          HZ1       LYS 103 -20.939  40.088  -8.018
  762   2HZ   LYS 103          HZ2       LYS 103 -22.324  40.689  -7.383
  763   3HZ   LYS 103          HZ3       LYS 103 -21.373  39.720  -6.488
  764    H    VAL 104           H        VAL 104 -26.220  34.976 -10.751
  765    HA   VAL 104           HA       VAL 104 -25.822  34.821 -13.715
  766    HB   VAL 104           HB       VAL 104 -28.226  34.002 -12.065
  767   1HG1  VAL 104          1HG1      VAL 104 -28.935  34.619 -14.323
  768   2HG1  VAL 104          2HG1      VAL 104 -27.603  33.661 -15.014
  769   3HG1  VAL 104          3HG1      VAL 104 -28.940  32.870 -14.170
  770   1HG2  VAL 104          1HG2      VAL 104 -27.488  31.679 -12.696
  771   2HG2  VAL 104          2HG2      VAL 104 -26.035  32.352 -13.446
  772   3HG2  VAL 104          3HG2      VAL 104 -26.289  32.481 -11.690
  773    H    PHE 105           H        PHE 105 -26.603  36.350 -15.085
  774    HA   PHE 105           HA       PHE 105 -28.570  38.349 -14.175
  775   1HB   PHE 105          HB2       PHE 105 -27.205  39.889 -15.673
  776   2HB   PHE 105          HB3       PHE 105 -26.603  39.542 -14.059
  777    HD1  PHE 105           HD1      PHE 105 -24.402  38.799 -13.733
  778    HD2  PHE 105           HD2      PHE 105 -26.164  38.508 -17.670
  779    HE1  PHE 105           HE1      PHE 105 -22.185  38.177 -14.701
  780    HE2  PHE 105           HE2      PHE 105 -23.970  37.849 -18.601
  781    HZ   PHE 105           HZ       PHE 105 -21.964  37.722 -17.128
  782    H    ALA 106           H        ALA 106 -29.566  39.539 -16.056
  783    HA   ALA 106           HA       ALA 106 -30.120  37.616 -18.272
  784   1HB   ALA 106          HB1       ALA 106 -32.532  38.165 -17.955
  785   2HB   ALA 106          HB2       ALA 106 -31.792  37.528 -16.455
  786   3HB   ALA 106          HB3       ALA 106 -32.134  39.268 -16.625
  787    H    LYS 107           H        LYS 107 -28.279  39.642 -18.538
  788    HA   LYS 107           HA       LYS 107 -29.208  41.066 -20.903
  789   1HB   LYS 107          HB2       LYS 107 -28.828  43.331 -20.123
  790   2HB   LYS 107          HB3       LYS 107 -30.133  42.579 -19.213
  791   1HG   LYS 107          HG2       LYS 107 -28.624  42.169 -17.303
  792   2HG   LYS 107          HG3       LYS 107 -27.276  42.912 -18.203
  793   1HD   LYS 107          HD2       LYS 107 -29.879  44.296 -17.362
  794   2HD   LYS 107          HD3       LYS 107 -28.332  44.393 -16.504
  795   1HE   LYS 107          HE2       LYS 107 -27.288  45.352 -18.604
  796   2HE   LYS 107          HE3       LYS 107 -28.888  45.348 -19.358
  797   1HZ   LYS 107          HZ1       LYS 107 -28.164  46.885 -16.906
  798   2HZ   LYS 107          HZ2       LYS 107 -28.384  47.536 -18.376
  799   3HZ   LYS 107          HZ3       LYS 107 -29.648  46.870 -17.612
  Start of MODEL   13
    1   1H    GLY   1          H1        GLY   1  -5.464   2.737  11.193
    2   2H    GLY   1          H2        GLY   1  -5.844   4.266  11.684
    3   3H    GLY   1          H3        GLY   1  -6.355   3.736  10.245
    4   1HA   GLY   1          HA2       GLY   1  -3.554   4.214  10.972
    5   2HA   GLY   1          HA3       GLY   1  -4.078   3.573   9.411
    6    H    LYS   2           H        LYS   2  -2.614   5.983   9.884
    7    HA   LYS   2           HA       LYS   2  -4.203   7.948   8.421
    8   1HB   LYS   2          HB2       LYS   2  -4.525   8.121  11.147
    9   2HB   LYS   2          HB3       LYS   2  -3.059   9.034  10.994
   10   1HG   LYS   2          HG2       LYS   2  -4.428  10.298   9.067
   11   2HG   LYS   2          HG3       LYS   2  -5.810   9.588   9.868
   12   1HD   LYS   2          HD2       LYS   2  -5.032  10.656  12.023
   13   2HD   LYS   2          HD3       LYS   2  -3.677  11.361  11.150
   14   1HE   LYS   2          HE2       LYS   2  -6.631  11.995  10.733
   15   2HE   LYS   2          HE3       LYS   2  -5.433  13.011  11.551
   16   1HZ   LYS   2          HZ1       LYS   2  -5.528  13.856   9.356
   17   2HZ   LYS   2          HZ2       LYS   2  -4.225  12.852   9.278
   18   3HZ   LYS   2          HZ3       LYS   2  -5.634  12.367   8.672
   19    H    ASP   3           H        ASP   3  -2.703  10.132   8.526
   20    HA   ASP   3           HA       ASP   3  -0.328   9.315   7.024
   21   1HB   ASP   3          HB2       ASP   3  -0.365  11.594   6.275
   22   2HB   ASP   3          HB3       ASP   3  -1.983  10.963   6.244
   23    H    ILE   4           H        ILE   4  -0.617   9.711  10.261
   24    HA   ILE   4           HA       ILE   4   1.482  11.600  10.808
   25    HB   ILE   4           HB       ILE   4   0.230   9.574  12.672
   26   1HG1  ILE   4          2HG1      ILE   4  -1.578  10.846  11.741
   27   2HG1  ILE   4          3HG1      ILE   4  -1.321  11.301  13.394
   28   1HG2  ILE   4          1HG2      ILE   4   1.720  12.183  13.246
   29   2HG2  ILE   4          2HG2      ILE   4   0.772  11.281  14.430
   30   3HG2  ILE   4          3HG2      ILE   4   2.203  10.521  13.734
   31   1HD1  ILE   4          1HD1      ILE   4  -1.808  13.269  11.998
   32   2HD1  ILE   4          2HD1      ILE   4  -0.170  13.411  12.646
   33   3HD1  ILE   4          3HD1      ILE   4  -0.431  12.911  10.962
   34    H    GLN   5           H        GLN   5   1.454   8.082  10.622
   35    HA   GLN   5           HA       GLN   5   4.384   8.000  10.665
   36   1HB   GLN   5          HB2       GLN   5   4.533   6.414  12.527
   37   2HB   GLN   5          HB3       GLN   5   3.857   7.952  13.059
   38   1HG   GLN   5          HG2       GLN   5   1.584   7.052  13.017
   39   2HG   GLN   5          HG3       GLN   5   2.142   5.488  12.429
   40   1HE2  GLN   5          1HE2      GLN   5   1.815   5.713  16.310
   41   2HE2  GLN   5          2HE2      GLN   5   0.789   6.488  15.112
   42    H    VAL   6           H        VAL   6   2.351   7.384   8.789
   43    HA   VAL   6           HA       VAL   6   3.268   4.715   7.865
   44    HB   VAL   6           HB       VAL   6   0.293   5.275   7.980
   45   1HG1  VAL   6          1HG1      VAL   6   0.936   3.926   6.068
   46   2HG1  VAL   6          2HG1      VAL   6   1.886   2.833   7.118
   47   3HG1  VAL   6          3HG1      VAL   6   0.106   2.939   7.262
   48   1HG2  VAL   6          1HG2      VAL   6   1.972   3.400   9.686
   49   2HG2  VAL   6          2HG2      VAL   6   0.940   4.756  10.247
   50   3HG2  VAL   6          3HG2      VAL   6   0.204   3.311   9.535
   51    H    ILE   7           H        ILE   7   4.324   5.483   6.130
   52    HA   ILE   7           HA       ILE   7   3.275   7.755   4.631
   53    HB   ILE   7           HB       ILE   7   5.786   6.226   3.980
   54   1HG1  ILE   7          2HG1      ILE   7   5.362   8.629   5.829
   55   2HG1  ILE   7          3HG1      ILE   7   5.877   7.011   6.342
   56   1HG2  ILE   7          1HG2      ILE   7   4.813   9.091   3.392
   57   2HG2  ILE   7          2HG2      ILE   7   6.319   8.324   2.805
   58   3HG2  ILE   7          3HG2      ILE   7   4.757   7.774   2.243
   59   1HD1  ILE   7          1HD1      ILE   7   7.539   8.883   4.615
   60   2HD1  ILE   7          2HD1      ILE   7   7.836   8.414   6.285
   61   3HD1  ILE   7          3HD1      ILE   7   7.955   7.198   5.026
   62    H    VAL   8           H        VAL   8   1.416   6.823   4.044
   63    HA   VAL   8           HA       VAL   8   1.236   5.623   1.387
   64    HB   VAL   8           HB       VAL   8  -0.084   4.215   3.772
   65   1HG1  VAL   8          1HG1      VAL   8  -0.873   2.544   2.057
   66   2HG1  VAL   8          2HG1      VAL   8  -1.540   4.132   1.824
   67   3HG1  VAL   8          3HG1      VAL   8  -0.199   3.576   0.775
   68   1HG2  VAL   8          1HG2      VAL   8   2.106   3.202   1.941
   69   2HG2  VAL   8          2HG2      VAL   8   2.210   3.447   3.712
   70   3HG2  VAL   8          3HG2      VAL   8   1.181   2.198   3.097
   71    H    ASN   9           H        ASN   9  -0.399   6.592   4.387
   72    HA   ASN   9           HA       ASN   9  -2.903   7.315   3.172
   73   1HB   ASN   9          HB2       ASN   9  -1.707   7.899   5.894
   74   2HB   ASN   9          HB3       ASN   9  -3.422   8.075   5.470
   75   1HD2  ASN   9          1HD2      ASN   9  -2.135   4.526   6.704
   76   2HD2  ASN   9          2HD2      ASN   9  -1.377   6.058   7.062
   77    H    VAL  10           H        VAL  10  -3.712   9.186   2.578
   78    HA   VAL  10           HA       VAL  10  -2.299  11.798   2.851
   79    HB   VAL  10           HB       VAL  10  -3.219  10.613   0.221
   80   1HG1  VAL  10          1HG1      VAL  10  -3.519  13.040   0.306
   81   2HG1  VAL  10          2HG1      VAL  10  -1.832  13.241   0.895
   82   3HG1  VAL  10          3HG1      VAL  10  -2.154  12.635  -0.760
   83   1HG2  VAL  10          1HG2      VAL  10  -1.123   9.546   0.797
   84   2HG2  VAL  10          2HG2      VAL  10  -0.840  10.717  -0.461
   85   3HG2  VAL  10          3HG2      VAL  10  -0.386  11.116   1.212
   86    HA   PRO  11           HA       PRO  11  -6.717  12.430   3.784
   87   1HB   PRO  11          HB2       PRO  11  -5.575  15.189   4.261
   88   2HB   PRO  11          HB3       PRO  11  -6.805  14.317   5.225
   89   1HG   PRO  11          HG2       PRO  11  -4.267  14.458   6.077
   90   2HG   PRO  11          HG3       PRO  11  -5.074  12.857   6.097
   91   1HD   PRO  11          HD2       PRO  11  -3.175  13.939   3.987
   92   2HD   PRO  11          HD3       PRO  11  -3.183  12.329   4.794
   93    HA   PRO  12           HA       PRO  12  -8.231  14.171   0.117
   94   1HB   PRO  12          HB2       PRO  12 -10.445  15.620   1.510
   95   2HB   PRO  12          HB3       PRO  12 -10.530  14.338   0.264
   96   1HG   PRO  12          HG2       PRO  12 -11.093  13.804   2.878
   97   2HG   PRO  12          HG3       PRO  12 -10.199  12.634   1.863
   98   1HD   PRO  12          HD2       PRO  12  -9.089  14.686   3.792
   99   2HD   PRO  12          HD3       PRO  12  -8.719  12.958   3.702
  100    H    SER  13           H        SER  13  -8.302  15.939  -1.194
  101    HA   SER  13           HA       SER  13  -7.549  18.645  -0.149
  102   1HB   SER  13          HB2       SER  13  -6.166  16.999  -2.299
  103   2HB   SER  13          HB3       SER  13  -5.859  18.707  -1.974
  104    HG   SER  13           HG       SER  13  -5.502  16.534  -0.196
  105    H    VAL  14           H        VAL  14 -10.132  18.220  -0.748
  106    HA   VAL  14           HA       VAL  14 -10.739  18.758  -3.510
  107    HB   VAL  14           HB       VAL  14 -12.352  17.750  -1.974
  108   1HG1  VAL  14          1HG1      VAL  14 -13.032  20.547  -0.966
  109   2HG1  VAL  14          2HG1      VAL  14 -13.661  18.985  -0.411
  110   3HG1  VAL  14          3HG1      VAL  14 -12.015  19.457  -0.031
  111   1HG2  VAL  14          1HG2      VAL  14 -13.399  20.287  -3.320
  112   2HG2  VAL  14          2HG2      VAL  14 -13.045  18.761  -4.123
  113   3HG2  VAL  14          3HG2      VAL  14 -14.320  18.820  -2.909
  114    H    ARG  15           H        ARG  15 -10.949  20.617  -4.641
  115    HA   ARG  15           HA       ARG  15 -10.666  23.234  -3.247
  116   1HB   ARG  15          HB2       ARG  15  -8.904  22.152  -5.490
  117   2HB   ARG  15          HB3       ARG  15  -9.036  23.886  -5.128
  118   1HG   ARG  15          HG2       ARG  15  -8.269  23.530  -2.822
  119   2HG   ARG  15          HG3       ARG  15  -8.104  21.787  -3.124
  120   1HD   ARG  15          HD2       ARG  15  -6.485  22.240  -4.934
  121   2HD   ARG  15          HD3       ARG  15  -6.585  23.975  -4.596
  122    HE   ARG  15           HE       ARG  15  -5.232  21.874  -3.010
  123   1HH1  ARG  15          1HH1      ARG  15  -3.921  22.411  -1.318
  124   2HH1  ARG  15          2HH1      ARG  15  -3.921  24.041  -0.698
  125   1HH2  ARG  15          1HH2      ARG  15  -6.301  25.211  -2.857
  126   2HH2  ARG  15          2HH2      ARG  15  -5.286  25.565  -1.480
  127    H    ALA  16           H        ALA  16 -11.234  25.054  -4.442
  128    HA   ALA  16           HA       ALA  16 -13.430  24.543  -6.390
  129   1HB   ALA  16          HB1       ALA  16 -14.057  25.887  -4.469
  130   2HB   ALA  16          HB2       ALA  16 -12.669  26.973  -4.698
  131   3HB   ALA  16          HB3       ALA  16 -13.984  26.960  -5.877
  132    H    ARG  17           H        ARG  17 -12.566  24.322  -8.319
  133    HA   ARG  17           HA       ARG  17 -10.083  25.215  -9.309
  134   1HB   ARG  17          HB2       ARG  17 -11.469  23.438 -10.274
  135   2HB   ARG  17          HB3       ARG  17 -12.604  24.656 -10.908
  136   1HG   ARG  17          HG2       ARG  17 -10.809  25.587 -12.340
  137   2HG   ARG  17          HG3       ARG  17  -9.638  24.483 -11.631
  138   1HD   ARG  17          HD2       ARG  17 -12.124  23.570 -13.155
  139   2HD   ARG  17          HD3       ARG  17 -10.553  23.841 -13.917
  140    HE   ARG  17           HE       ARG  17 -11.355  21.575 -12.247
  141   1HH1  ARG  17          1HH1      ARG  17  -9.982  19.846 -12.033
  142   2HH1  ARG  17          2HH1      ARG  17  -8.304  20.024 -12.443
  143   1HH2  ARG  17          1HH2      ARG  17  -8.492  23.271 -13.494
  144   2HH2  ARG  17          2HH2      ARG  17  -7.517  21.848 -13.244
  145    H    GLN  18           H        GLN  18 -13.139  26.920  -9.361
  146    HA   GLN  18           HA       GLN  18 -11.789  29.516  -9.931
  147   1HB   GLN  18          HB2       GLN  18 -14.482  28.456 -10.938
  148   2HB   GLN  18          HB3       GLN  18 -14.072  30.178 -10.970
  149   1HG   GLN  18          HG2       GLN  18 -12.379  28.083 -12.395
  150   2HG   GLN  18          HG3       GLN  18 -13.774  28.845 -13.149
  151   1HE2  GLN  18          1HE2      GLN  18 -12.177  31.970 -13.677
  152   2HE2  GLN  18          2HE2      GLN  18 -13.742  31.171 -13.550
  153    H    SER  19           H        SER  19 -12.470  31.160  -8.472
  154    HA   SER  19           HA       SER  19 -13.849  30.217  -6.045
  155   1HB   SER  19          HB2       SER  19 -12.827  32.963  -6.768
  156   2HB   SER  19          HB3       SER  19 -13.314  32.410  -5.156
  157    HG   SER  19           HG       SER  19 -11.014  32.331  -5.484
  158    H    THR  20           H        THR  20 -14.514  32.392  -8.733
  159    HA   THR  20           HA       THR  20 -17.394  32.574  -8.079
  160    HB   THR  20           HB       THR  20 -15.689  35.004  -8.718
  161    HG1  THR  20           HG1      THR  20 -16.145  35.605  -6.598
  162   1HG2  THR  20          1HG2      THR  20 -17.960  35.282  -9.551
  163   2HG2  THR  20          2HG2      THR  20 -18.648  34.723  -8.017
  164   3HG2  THR  20          3HG2      THR  20 -17.755  36.252  -8.100
  165    H    MET  21           H        MET  21 -18.598  32.469  -9.823
  166    HA   MET  21           HA       MET  21 -17.426  32.751 -12.567
  167   1HB   MET  21          HB2       MET  21 -19.341  30.654 -11.449
  168   2HB   MET  21          HB3       MET  21 -19.124  30.930 -13.164
  169   1HG   MET  21          HG2       MET  21 -16.862  30.221 -11.298
  170   2HG   MET  21          HG3       MET  21 -17.742  29.039 -12.237
  171   1HE   MET  21          HE1       MET  21 -17.686  28.715 -14.791
  172   2HE   MET  21          HE2       MET  21 -18.146  30.405 -15.173
  173   3HE   MET  21          HE3       MET  21 -16.708  29.679 -15.924
  174    H    ASN  22           H        ASN  22 -18.829  33.582 -14.136
  175    HA   ASN  22           HA       ASN  22 -21.423  34.746 -13.279
  176   1HB   ASN  22          HB2       ASN  22 -19.220  36.140 -14.845
  177   2HB   ASN  22          HB3       ASN  22 -20.863  36.741 -14.635
  178   1HD2  ASN  22          1HD2      ASN  22 -18.134  37.362 -11.732
  179   2HD2  ASN  22          2HD2      ASN  22 -17.731  36.457 -13.184
  180    H    ALA  23           H        ALA  23 -23.042  34.708 -14.877
  181    HA   ALA  23           HA       ALA  23 -22.399  33.949 -17.642
  182   1HB   ALA  23          HB1       ALA  23 -24.041  32.132 -15.808
  183   2HB   ALA  23          HB2       ALA  23 -23.751  31.884 -17.558
  184   3HB   ALA  23          HB3       ALA  23 -22.396  31.766 -16.428
  185    H    THR  24           H        THR  24 -24.042  34.212 -19.088
  186    HA   THR  24           HA       THR  24 -26.176  36.089 -18.332
  187    HB   THR  24           HB       THR  24 -25.698  34.920 -21.104
  188    HG1  THR  24           HG1      THR  24 -24.401  37.147 -19.934
  189   1HG2  THR  24          1HG2      THR  24 -26.811  37.577 -20.072
  190   2HG2  THR  24          2HG2      THR  24 -26.534  37.150 -21.788
  191   3HG2  THR  24          3HG2      THR  24 -27.726  36.263 -20.845
  192    H    ALA  25           H        ALA  25 -28.189  35.524 -17.902
  193    HA   ALA  25           HA       ALA  25 -29.084  32.751 -18.161
  194   1HB   ALA  25          HB1       ALA  25 -29.455  34.523 -16.233
  195   2HB   ALA  25          HB2       ALA  25 -30.849  35.001 -17.211
  196   3HB   ALA  25          HB3       ALA  25 -30.695  33.328 -16.651
  197    H    ASN  26           H        ASN  26 -31.197  32.222 -18.936
  198    HA   ASN  26           HA       ASN  26 -32.793  31.977 -20.456
  199   1HB   ASN  26          HB2       ASN  26 -33.451  34.050 -19.204
  200   2HB   ASN  26          HB3       ASN  26 -32.815  35.015 -20.521
  201   1HD2  ASN  26          1HD2      ASN  26 -36.249  32.801 -21.198
  202   2HD2  ASN  26          2HD2      ASN  26 -35.030  32.124 -20.114
  203    H    LEU  27           H        LEU  27 -29.934  32.523 -21.577
  204    HA   LEU  27           HA       LEU  27 -30.685  32.666 -24.470
  205   1HB   LEU  27          HB2       LEU  27 -27.963  32.705 -23.130
  206   2HB   LEU  27          HB3       LEU  27 -28.270  32.846 -24.865
  207    HG   LEU  27           HG       LEU  27 -29.044  34.864 -22.730
  208   1HD1  LEU  27          1HD1      LEU  27 -26.670  34.823 -23.390
  209   2HD1  LEU  27          2HD1      LEU  27 -27.162  35.065 -25.098
  210   3HD1  LEU  27          3HD1      LEU  27 -27.490  36.310 -23.883
  211   1HD2  LEU  27          1HD2      LEU  27 -30.812  34.904 -24.443
  212   2HD2  LEU  27          2HD2      LEU  27 -29.769  36.302 -24.673
  213   3HD2  LEU  27          3HD2      LEU  27 -29.601  34.914 -25.739
  214    H    SER  28           H        SER  28 -30.541  30.311 -22.139
  215    HA   SER  28           HA       SER  28 -30.379  28.075 -22.123
  216   1HB   SER  28          HB2       SER  28 -30.562  28.192 -25.169
  217   2HB   SER  28          HB3       SER  28 -30.804  26.780 -24.137
  218    HG   SER  28           HG       SER  28 -32.795  27.861 -24.721
  219    H    GLN  29           H        GLN  29 -27.978  29.677 -22.130
  220    HA   GLN  29           HA       GLN  29 -25.944  28.461 -23.765
  221   1HB   GLN  29          HB2       GLN  29 -26.119  30.630 -21.749
  222   2HB   GLN  29          HB3       GLN  29 -24.575  29.800 -21.713
  223   1HG   GLN  29          HG2       GLN  29 -25.882  30.894 -24.213
  224   2HG   GLN  29          HG3       GLN  29 -24.647  31.759 -23.263
  225   1HE2  GLN  29          1HE2      GLN  29 -22.779  30.260 -26.057
  226   2HE2  GLN  29          2HE2      GLN  29 -23.994  31.515 -25.847
  227    H    SER  30           H        SER  30 -23.811  27.804 -22.588
  228    HA   SER  30           HA       SER  30 -24.356  25.865 -20.384
  229   1HB   SER  30          HB2       SER  30 -22.880  24.197 -21.389
  230   2HB   SER  30          HB3       SER  30 -24.318  24.475 -22.388
  231    HG   SER  30           HG       SER  30 -22.460  24.457 -23.686
  232    H    VAL  31           H        VAL  31 -22.719  25.388 -19.064
  233    HA   VAL  31           HA       VAL  31 -20.301  27.171 -18.993
  234    HB   VAL  31           HB       VAL  31 -22.472  27.112 -16.836
  235   1HG1  VAL  31          1HG1      VAL  31 -21.129  28.829 -15.653
  236   2HG1  VAL  31          2HG1      VAL  31 -20.303  27.278 -15.731
  237   3HG1  VAL  31          3HG1      VAL  31 -19.799  28.598 -16.817
  238   1HG2  VAL  31          1HG2      VAL  31 -21.503  29.377 -18.626
  239   2HG2  VAL  31          2HG2      VAL  31 -23.088  28.567 -18.703
  240   3HG2  VAL  31          3HG2      VAL  31 -22.665  29.523 -17.296
  241    H    THR  32           H        THR  32 -18.525  26.107 -18.147
  242    HA   THR  32           HA       THR  32 -18.986  23.669 -16.441
  243    HB   THR  32           HB       THR  32 -16.382  24.442 -17.809
  244    HG1  THR  32           HG1      THR  32 -17.978  23.989 -19.325
  245   1HG2  THR  32          1HG2      THR  32 -17.389  21.818 -16.567
  246   2HG2  THR  32          2HG2      THR  32 -15.873  22.010 -17.434
  247   3HG2  THR  32          3HG2      THR  32 -16.087  22.819 -15.913
  248    H    LEU  33           H        LEU  33 -18.068  23.462 -14.463
  249    HA   LEU  33           HA       LEU  33 -16.017  25.189 -13.425
  250   1HB   LEU  33          HB2       LEU  33 -17.320  25.965 -11.441
  251   2HB   LEU  33          HB3       LEU  33 -17.766  26.670 -12.975
  252    HG   LEU  33           HG       LEU  33 -19.787  25.339 -13.115
  253   1HD1  LEU  33          1HD1      LEU  33 -20.615  24.089 -11.124
  254   2HD1  LEU  33          2HD1      LEU  33 -19.282  23.304 -11.928
  255   3HD1  LEU  33          3HD1      LEU  33 -18.982  24.168 -10.428
  256   1HD2  LEU  33          1HD2      LEU  33 -19.487  26.734 -10.428
  257   2HD2  LEU  33          2HD2      LEU  33 -19.804  27.514 -12.008
  258   3HD2  LEU  33          3HD2      LEU  33 -20.980  26.415 -11.296
  259    H    ALA  34           H        ALA  34 -15.605  24.388 -10.927
  260    HA   ALA  34           HA       ALA  34 -16.195  21.532 -10.671
  261   1HB   ALA  34          HB1       ALA  34 -13.386  22.434 -11.326
  262   2HB   ALA  34          HB2       ALA  34 -13.960  20.773 -11.048
  263   3HB   ALA  34          HB3       ALA  34 -14.483  21.679 -12.485
  264    H    CYS  35           H        CYS  35 -15.899  20.684  -8.863
  265    HA   CYS  35           HA       CYS  35 -14.397  22.026  -6.638
  266   1HB   CYS  35          HB2       CYS  35 -17.080  20.726  -6.790
  267   2HB   CYS  35          HB3       CYS  35 -16.117  20.339  -5.372
  268    H    ASP  36           H        ASP  36 -12.551  20.923  -7.818
  269    HA   ASP  36           HA       ASP  36 -12.697  18.045  -8.227
  270   1HB   ASP  36          HB2       ASP  36 -10.658  18.264  -9.401
  271   2HB   ASP  36          HB3       ASP  36 -11.685  19.600  -9.852
  272    H    ALA  37           H        ALA  37 -11.914  16.454  -7.034
  273    HA   ALA  37           HA       ALA  37 -10.379  17.125  -4.567
  274   1HB   ALA  37          HB1       ALA  37 -12.716  16.358  -4.123
  275   2HB   ALA  37          HB2       ALA  37 -12.354  14.858  -5.008
  276   3HB   ALA  37          HB3       ALA  37 -11.523  15.238  -3.494
  277    H    ASP  38           H        ASP  38  -8.988  15.630  -3.718
  278    HA   ASP  38           HA       ASP  38  -8.063  13.273  -5.183
  279   1HB   ASP  38          HB2       ASP  38  -6.835  15.155  -6.305
  280   2HB   ASP  38          HB3       ASP  38  -6.258  15.701  -4.732
  281    H    GLY  39           H        GLY  39  -6.639  11.977  -3.844
  282   1HA   GLY  39          HA2       GLY  39  -5.568  12.457  -1.328
  283   2HA   GLY  39          HA3       GLY  39  -7.251  12.022  -1.006
  284    H    PHE  40           H        PHE  40  -5.488  10.283   0.059
  285    HA   PHE  40           HA       PHE  40  -5.930   7.874  -1.553
  286   1HB   PHE  40          HB2       PHE  40  -3.745   8.806  -2.320
  287   2HB   PHE  40          HB3       PHE  40  -3.107   8.394  -0.721
  288    HD1  PHE  40           HD1      PHE  40  -2.913   6.024   0.002
  289    HD2  PHE  40           HD2      PHE  40  -4.323   7.060  -3.928
  290    HE1  PHE  40           HE1      PHE  40  -2.642   3.646  -0.725
  291    HE2  PHE  40           HE2      PHE  40  -4.075   4.709  -4.658
  292    HZ   PHE  40           HZ       PHE  40  -3.244   2.986  -3.055
  293    HA   PRO  41           HA       PRO  41  -5.983   5.489  -1.245
  294   1HB   PRO  41          HB2       PRO  41  -8.066   4.425   0.653
  295   2HB   PRO  41          HB3       PRO  41  -7.021   3.551  -0.524
  296   1HG   PRO  41          HG2       PRO  41  -6.443   3.554   2.150
  297   2HG   PRO  41          HG3       PRO  41  -5.138   3.732   0.934
  298   1HD   PRO  41          HD2       PRO  41  -6.523   5.888   2.543
  299   2HD   PRO  41          HD3       PRO  41  -4.774   5.646   2.254
  300    H    GLU  42           H        GLU  42  -7.876   5.324  -2.549
  301    HA   GLU  42           HA       GLU  42  -8.813   7.563  -3.501
  302   1HB   GLU  42          HB2       GLU  42 -10.677   6.412  -4.579
  303   2HB   GLU  42          HB3       GLU  42  -9.135   5.581  -4.662
  304   1HG   GLU  42          HG2       GLU  42  -9.882   4.014  -2.867
  305   2HG   GLU  42          HG3       GLU  42 -11.416   4.860  -2.764
  306    HA   PRO  43           HA       PRO  43 -11.612   9.346  -0.550
  307   1HB   PRO  43          HB2       PRO  43 -11.897  11.851  -1.524
  308   2HB   PRO  43          HB3       PRO  43 -10.279  11.237  -1.002
  309   1HG   PRO  43          HG2       PRO  43 -11.438  11.251  -3.794
  310   2HG   PRO  43          HG3       PRO  43  -9.878  11.914  -3.284
  311   1HD   PRO  43          HD2       PRO  43 -10.056   9.395  -4.325
  312   2HD   PRO  43          HD3       PRO  43  -8.930   9.773  -2.972
  313    H    THR  44           H        THR  44 -13.614  10.299  -0.315
  314    HA   THR  44           HA       THR  44 -15.726   9.743  -2.377
  315    HB   THR  44           HB       THR  44 -15.998   9.752   0.641
  316    HG1  THR  44           HG1      THR  44 -16.064   7.533  -1.149
  317   1HG2  THR  44          1HG2      THR  44 -18.190   8.584   0.109
  318   2HG2  THR  44          2HG2      THR  44 -18.147  10.288  -0.328
  319   3HG2  THR  44          3HG2      THR  44 -17.950   9.031  -1.584
  320    H    MET  45           H        MET  45 -17.366  11.429  -2.545
  321    HA   MET  45           HA       MET  45 -16.983  13.956  -1.086
  322   1HB   MET  45          HB2       MET  45 -16.434  15.237  -3.102
  323   2HB   MET  45          HB3       MET  45 -15.199  14.047  -2.810
  324   1HG   MET  45          HG2       MET  45 -16.399  12.500  -4.483
  325   2HG   MET  45          HG3       MET  45 -17.367  13.895  -4.926
  326   1HE   MET  45          HE1       MET  45 -14.820  16.222  -6.693
  327   2HE   MET  45          HE2       MET  45 -16.464  16.006  -6.045
  328   3HE   MET  45          HE3       MET  45 -15.122  16.310  -4.935
  329    H    THR  46           H        THR  46 -18.580  15.502  -1.459
  330    HA   THR  46           HA       THR  46 -20.720  15.187  -3.420
  331    HB   THR  46           HB       THR  46 -22.575  15.378  -1.771
  332    HG1  THR  46           HG1      THR  46 -22.180  14.813   0.372
  333   1HG2  THR  46          1HG2      THR  46 -21.110  12.768  -1.305
  334   2HG2  THR  46          2HG2      THR  46 -22.855  13.104  -1.199
  335   3HG2  THR  46          3HG2      THR  46 -22.041  13.187  -2.769
  336    H    TRP  47           H        TRP  47 -22.349  17.041  -3.200
  337    HA   TRP  47           HA       TRP  47 -21.409  19.417  -1.833
  338   1HB   TRP  47          HB2       TRP  47 -20.907  20.735  -3.845
  339   2HB   TRP  47          HB3       TRP  47 -19.783  19.455  -3.431
  340    HD1  TRP  47           HD1      TRP  47 -20.442  17.049  -5.105
  341    HE1  TRP  47           HE1      TRP  47 -19.741  17.178  -7.570
  342    HE3  TRP  47           HE3      TRP  47 -20.773  22.114  -5.812
  343    HZ2  TRP  47           HZ2      TRP  47 -19.138  19.236  -9.515
  344    HZ3  TRP  47           HZ3      TRP  47 -20.165  23.127  -8.019
  345    HH2  TRP  47           HH2      TRP  47 -19.329  21.681  -9.838
  346    H    THR  48           H        THR  48 -22.631  21.386  -2.289
  347    HA   THR  48           HA       THR  48 -25.496  20.710  -2.852
  348    HB   THR  48           HB       THR  48 -26.179  21.908  -0.915
  349    HG1  THR  48           HG1      THR  48 -24.665  22.867   0.489
  350   1HG2  THR  48          1HG2      THR  48 -23.795  20.268   0.055
  351   2HG2  THR  48          2HG2      THR  48 -25.299  20.638   0.917
  352   3HG2  THR  48          3HG2      THR  48 -25.346  19.547  -0.476
  353    H    LYS  49           H        LYS  49 -26.901  22.348  -3.280
  354    HA   LYS  49           HA       LYS  49 -25.790  24.669  -4.809
  355   1HB   LYS  49          HB2       LYS  49 -27.317  22.818  -5.828
  356   2HB   LYS  49          HB3       LYS  49 -28.615  23.522  -4.890
  357   1HG   LYS  49          HG2       LYS  49 -28.053  25.754  -6.046
  358   2HG   LYS  49          HG3       LYS  49 -26.883  24.862  -7.036
  359   1HD   LYS  49          HD2       LYS  49 -28.680  23.383  -7.871
  360   2HD   LYS  49          HD3       LYS  49 -29.858  24.265  -6.914
  361   1HE   LYS  49          HE2       LYS  49 -28.199  25.484  -9.149
  362   2HE   LYS  49          HE3       LYS  49 -29.856  24.881  -9.325
  363   1HZ   LYS  49          HZ1       LYS  49 -29.050  27.244  -7.747
  364   2HZ   LYS  49          HZ2       LYS  49 -30.086  27.148  -8.996
  365   3HZ   LYS  49          HZ3       LYS  49 -30.505  26.502  -7.559
  366    H    ASP  50           H        ASP  50 -25.347  25.674  -2.716
  367    HA   ASP  50           HA       ASP  50 -25.664  27.179  -1.092
  368   1HB   ASP  50          HB2       ASP  50 -27.014  28.446  -2.709
  369   2HB   ASP  50          HB3       ASP  50 -28.471  27.642  -2.144
  370    H    GLY  51           H        GLY  51 -27.751  24.426  -1.252
  371   1HA   GLY  51          HA2       GLY  51 -27.455  23.835   1.511
  372   2HA   GLY  51          HA3       GLY  51 -29.060  24.529   1.276
  373    H    GLU  52           H        GLU  52 -29.376  23.258  -1.446
  374    HA   GLU  52           HA       GLU  52 -30.196  20.572  -0.486
  375   1HB   GLU  52          HB2       GLU  52 -31.521  20.428  -2.519
  376   2HB   GLU  52          HB3       GLU  52 -31.876  21.878  -1.582
  377   1HG   GLU  52          HG2       GLU  52 -30.436  23.180  -3.190
  378   2HG   GLU  52          HG3       GLU  52 -30.227  21.724  -4.145
  379    HA   PRO  53           HA       PRO  53 -26.704  18.707  -2.288
  380   1HB   PRO  53          HB2       PRO  53 -27.387  16.053  -2.528
  381   2HB   PRO  53          HB3       PRO  53 -27.274  16.901  -0.956
  382   1HG   PRO  53          HG2       PRO  53 -29.770  16.399  -2.639
  383   2HG   PRO  53          HG3       PRO  53 -29.544  16.043  -0.903
  384   1HD   PRO  53          HD2       PRO  53 -30.752  18.338  -1.775
  385   2HD   PRO  53          HD3       PRO  53 -29.666  18.336  -0.342
  386    H    ILE  54           H        ILE  54 -25.630  18.346  -4.095
  387    HA   ILE  54           HA       ILE  54 -26.984  17.928  -6.696
  388    HB   ILE  54           HB       ILE  54 -24.165  18.942  -6.167
  389   1HG1  ILE  54          2HG1      ILE  54 -26.480  20.758  -6.988
  390   2HG1  ILE  54          3HG1      ILE  54 -26.054  20.501  -5.306
  391   1HG2  ILE  54          1HG2      ILE  54 -24.214  19.775  -8.493
  392   2HG2  ILE  54          2HG2      ILE  54 -24.546  18.068  -8.523
  393   3HG2  ILE  54          3HG2      ILE  54 -25.883  19.221  -8.695
  394   1HD1  ILE  54          1HD1      ILE  54 -23.868  21.359  -5.575
  395   2HD1  ILE  54          2HD1      ILE  54 -24.077  21.571  -7.315
  396   3HD1  ILE  54          3HD1      ILE  54 -25.034  22.538  -6.206
  397    H    GLU  55           H        GLU  55 -26.646  15.917  -4.735
  398    HA   GLU  55           HA       GLU  55 -24.772  14.019  -4.798
  399   1HB   GLU  55          HB2       GLU  55 -26.630  12.310  -4.885
  400   2HB   GLU  55          HB3       GLU  55 -26.645  13.525  -3.581
  401   1HG   GLU  55          HG2       GLU  55 -28.426  14.775  -4.872
  402   2HG   GLU  55          HG3       GLU  55 -28.456  13.446  -6.028
  403    H    GLN  56           H        GLN  56 -23.469  13.224  -6.241
  404    HA   GLN  56           HA       GLN  56 -23.938  13.228  -8.996
  405   1HB   GLN  56          HB2       GLN  56 -21.820  11.608  -7.529
  406   2HB   GLN  56          HB3       GLN  56 -21.791  12.148  -9.193
  407   1HG   GLN  56          HG2       GLN  56 -20.423  13.734  -8.284
  408   2HG   GLN  56          HG3       GLN  56 -21.956  14.580  -8.091
  409   1HE2  GLN  56          1HE2      GLN  56 -19.839  13.173  -4.851
  410   2HE2  GLN  56          2HE2      GLN  56 -19.323  12.824  -6.490
  411    H    GLU  57           H        GLU  57 -25.291  11.031  -6.896
  412    HA   GLU  57           HA       GLU  57 -25.312   8.749  -8.794
  413   1HB   GLU  57          HB2       GLU  57 -26.275   8.960  -5.913
  414   2HB   GLU  57          HB3       GLU  57 -26.289   7.464  -6.857
  415   1HG   GLU  57          HG2       GLU  57 -23.791   7.644  -7.102
  416   2HG   GLU  57          HG3       GLU  57 -23.832   9.048  -6.010
  417    H    ASP  58           H        ASP  58 -27.250  11.414  -8.291
  418    HA   ASP  58           HA       ASP  58 -29.528  10.186  -9.669
  419   1HB   ASP  58          HB2       ASP  58 -29.897   9.634  -7.227
  420   2HB   ASP  58          HB3       ASP  58 -29.856  11.352  -6.874
  421    H    ASN  59           H        ASN  59 -28.010  13.104  -8.324
  422    HA   ASN  59           HA       ASN  59 -30.065  14.735  -9.682
  423   1HB   ASN  59          HB2       ASN  59 -29.397  15.259  -7.331
  424   2HB   ASN  59          HB3       ASN  59 -27.811  15.768  -7.932
  425   1HD2  ASN  59          1HD2      ASN  59 -29.911  18.819  -7.772
  426   2HD2  ASN  59          2HD2      ASN  59 -29.175  17.735  -6.603
  427    H    GLU  60           H        GLU  60 -29.856  14.849 -11.751
  428    HA   GLU  60           HA       GLU  60 -27.350  15.898 -13.026
  429   1HB   GLU  60          HB2       GLU  60 -29.149  13.644 -14.001
  430   2HB   GLU  60          HB3       GLU  60 -27.769  14.301 -14.859
  431   1HG   GLU  60          HG2       GLU  60 -26.258  13.506 -13.063
  432   2HG   GLU  60          HG3       GLU  60 -27.647  12.824 -12.194
  433    H    GLU  61           H        GLU  61 -30.306  16.814 -12.395
  434    HA   GLU  61           HA       GLU  61 -32.085  17.107 -14.276
  435   1HB   GLU  61          HB2       GLU  61 -31.132  19.305 -12.441
  436   2HB   GLU  61          HB3       GLU  61 -32.537  19.513 -13.510
  437   1HG   GLU  61          HG2       GLU  61 -33.575  17.441 -12.501
  438   2HG   GLU  61          HG3       GLU  61 -32.250  17.378 -11.363
  439    H    LYS  62           H        LYS  62 -29.278  19.223 -14.520
  440    HA   LYS  62           HA       LYS  62 -29.420  19.118 -17.383
  441   1HB   LYS  62          HB2       LYS  62 -29.546  21.461 -17.946
  442   2HB   LYS  62          HB3       LYS  62 -31.029  20.907 -17.208
  443   1HG   LYS  62          HG2       LYS  62 -30.249  21.910 -14.990
  444   2HG   LYS  62          HG3       LYS  62 -28.907  22.656 -15.889
  445   1HD   LYS  62          HD2       LYS  62 -30.686  23.676 -17.443
  446   2HD   LYS  62          HD3       LYS  62 -31.909  23.106 -16.303
  447   1HE   LYS  62          HE2       LYS  62 -30.920  24.407 -14.456
  448   2HE   LYS  62          HE3       LYS  62 -29.511  24.795 -15.500
  449   1HZ   LYS  62          HZ1       LYS  62 -32.285  25.835 -15.823
  450   2HZ   LYS  62          HZ2       LYS  62 -30.891  26.677 -15.522
  451   3HZ   LYS  62          HZ3       LYS  62 -31.097  25.968 -16.973
  452    H    TYR  63           H        TYR  63 -27.602  18.060 -15.799
  453    HA   TYR  63           HA       TYR  63 -25.189  19.414 -16.685
  454   1HB   TYR  63          HB2       TYR  63 -24.341  19.198 -14.108
  455   2HB   TYR  63          HB3       TYR  63 -24.936  20.657 -14.845
  456    HD1  TYR  63           HD1      TYR  63 -26.923  21.730 -14.110
  457    HD2  TYR  63           HD2      TYR  63 -25.820  17.862 -12.566
  458    HE1  TYR  63           HE1      TYR  63 -28.607  21.992 -12.298
  459    HE2  TYR  63           HE2      TYR  63 -27.490  18.132 -10.712
  460    HH   TYR  63           HH       TYR  63 -29.479  21.101 -10.375
  461    H    SER  64           H        SER  64 -23.283  18.326 -16.509
  462    HA   SER  64           HA       SER  64 -23.313  15.409 -15.872
  463   1HB   SER  64          HB2       SER  64 -22.436  16.629 -18.526
  464   2HB   SER  64          HB3       SER  64 -22.213  14.962 -18.004
  465    HG   SER  64           HG       SER  64 -24.058  15.118 -19.296
  466    H    PHE  65           H        PHE  65 -21.431  14.749 -14.982
  467    HA   PHE  65           HA       PHE  65 -18.975  16.411 -14.956
  468   1HB   PHE  65          HB2       PHE  65 -19.245  16.039 -12.475
  469   2HB   PHE  65          HB3       PHE  65 -20.489  16.979 -13.318
  470    HD1  PHE  65           HD1      PHE  65 -22.697  16.653 -12.705
  471    HD2  PHE  65           HD2      PHE  65 -19.953  13.337 -12.366
  472    HE1  PHE  65           HE1      PHE  65 -24.528  15.196 -11.873
  473    HE2  PHE  65           HE2      PHE  65 -21.798  11.895 -11.605
  474    HZ   PHE  65           HZ       PHE  65 -24.096  12.797 -11.383
  475    H    ASN  66           H        ASN  66 -17.398  15.129 -13.266
  476    HA   ASN  66           HA       ASN  66 -17.219  12.316 -14.122
  477   1HB   ASN  66          HB2       ASN  66 -15.333  12.433 -15.429
  478   2HB   ASN  66          HB3       ASN  66 -16.259  13.851 -15.939
  479   1HD2  ASN  66          1HD2      ASN  66 -13.725  16.019 -14.264
  480   2HD2  ASN  66          2HD2      ASN  66 -15.463  15.861 -14.077
  481    H    TYR  67           H        TYR  67 -15.341  11.133 -13.319
  482    HA   TYR  67           HA       TYR  67 -14.895  11.686 -10.440
  483   1HB   TYR  67          HB2       TYR  67 -14.252   9.252 -10.461
  484   2HB   TYR  67          HB3       TYR  67 -15.881   9.564 -11.020
  485    HD1  TYR  67           HD1      TYR  67 -16.645   9.099 -13.248
  486    HD2  TYR  67           HD2      TYR  67 -12.480   8.601 -12.197
  487    HE1  TYR  67           HE1      TYR  67 -16.253   7.880 -15.363
  488    HE2  TYR  67           HE2      TYR  67 -12.102   7.380 -14.313
  489    HH   TYR  67           HH       TYR  67 -14.759   6.871 -16.710
  490    H    ASP  68           H        ASP  68 -12.736  10.766  -9.601
  491    HA   ASP  68           HA       ASP  68 -10.631  11.391  -9.096
  492   1HB   ASP  68          HB2       ASP  68 -10.176  10.695 -11.997
  493   2HB   ASP  68          HB3       ASP  68  -8.871  11.004 -10.867
  494    H    GLY  69           H        GLY  69 -12.410  13.481  -9.611
  495   1HA   GLY  69          HA2       GLY  69 -10.935  15.859  -9.778
  496   2HA   GLY  69          HA3       GLY  69 -11.493  15.488 -11.404
  497    H    SER  70           H        SER  70 -13.269  16.686 -11.810
  498    HA   SER  70           HA       SER  70 -15.725  16.272 -10.366
  499   1HB   SER  70          HB2       SER  70 -14.973  17.814  -8.758
  500   2HB   SER  70          HB3       SER  70 -14.305  18.929  -9.974
  501    HG   SER  70           HG       SER  70 -17.049  18.359  -9.447
  502    H    GLU  71           H        GLU  71 -14.158  18.733 -12.454
  503    HA   GLU  71           HA       GLU  71 -15.388  20.251 -13.788
  504   1HB   GLU  71          HB2       GLU  71 -14.642  17.902 -15.526
  505   2HB   GLU  71          HB3       GLU  71 -14.928  19.539 -16.078
  506   1HG   GLU  71          HG2       GLU  71 -13.068  20.331 -14.580
  507   2HG   GLU  71          HG3       GLU  71 -12.686  18.645 -14.201
  508    H    LEU  72           H        LEU  72 -17.482  20.360 -12.910
  509    HA   LEU  72           HA       LEU  72 -19.596  18.743 -14.174
  510   1HB   LEU  72          HB2       LEU  72 -19.603  19.006 -11.779
  511   2HB   LEU  72          HB3       LEU  72 -19.718  20.755 -11.907
  512    HG   LEU  72           HG       LEU  72 -21.807  18.918 -13.133
  513   1HD1  LEU  72          1HD1      LEU  72 -21.570  18.263 -10.777
  514   2HD1  LEU  72          2HD1      LEU  72 -21.850  19.970 -10.287
  515   3HD1  LEU  72          3HD1      LEU  72 -23.133  19.028 -11.086
  516   1HD2  LEU  72          1HD2      LEU  72 -21.935  21.816 -12.164
  517   2HD2  LEU  72          2HD2      LEU  72 -22.132  21.183 -13.824
  518   3HD2  LEU  72          3HD2      LEU  72 -23.349  20.828 -12.600
  519    H    ILE  73           H        ILE  73 -20.488  19.309 -15.887
  520    HA   ILE  73           HA       ILE  73 -20.332  22.055 -16.953
  521    HB   ILE  73           HB       ILE  73 -21.106  19.447 -18.365
  522   1HG1  ILE  73          2HG1      ILE  73 -18.351  20.596 -18.845
  523   2HG1  ILE  73          3HG1      ILE  73 -18.592  19.661 -17.373
  524   1HG2  ILE  73          1HG2      ILE  73 -21.850  21.578 -19.411
  525   2HG2  ILE  73          2HG2      ILE  73 -20.196  22.198 -19.372
  526   3HG2  ILE  73          3HG2      ILE  73 -20.594  20.779 -20.394
  527   1HD1  ILE  73          1HD1      ILE  73 -17.824  18.269 -19.210
  528   2HD1  ILE  73          2HD1      ILE  73 -19.392  17.752 -18.548
  529   3HD1  ILE  73          3HD1      ILE  73 -19.295  18.622 -20.115
  530    H    ILE  74           H        ILE  74 -22.111  23.243 -16.932
  531    HA   ILE  74           HA       ILE  74 -24.799  22.066 -16.408
  532    HB   ILE  74           HB       ILE  74 -23.757  24.920 -16.190
  533   1HG1  ILE  74          2HG1      ILE  74 -24.780  23.165 -13.913
  534   2HG1  ILE  74          3HG1      ILE  74 -23.072  23.264 -14.330
  535   1HG2  ILE  74          1HG2      ILE  74 -26.534  23.829 -15.543
  536   2HG2  ILE  74          2HG2      ILE  74 -25.987  25.472 -15.234
  537   3HG2  ILE  74          3HG2      ILE  74 -26.130  24.916 -16.894
  538   1HD1  ILE  74          1HD1      ILE  74 -23.426  24.741 -12.526
  539   2HD1  ILE  74          2HD1      ILE  74 -23.105  25.724 -13.976
  540   3HD1  ILE  74          3HD1      ILE  74 -24.759  25.569 -13.333
  541    H    LYS  75           H        LYS  75 -26.230  22.152 -18.008
  542    HA   LYS  75           HA       LYS  75 -25.693  23.898 -20.365
  543   1HB   LYS  75          HB2       LYS  75 -26.685  22.308 -21.851
  544   2HB   LYS  75          HB3       LYS  75 -25.385  21.504 -20.986
  545   1HG   LYS  75          HG2       LYS  75 -27.231  20.687 -19.364
  546   2HG   LYS  75          HG3       LYS  75 -28.381  21.182 -20.587
  547   1HD   LYS  75          HD2       LYS  75 -26.142  19.156 -20.939
  548   2HD   LYS  75          HD3       LYS  75 -27.863  18.790 -20.743
  549   1HE   LYS  75          HE2       LYS  75 -28.355  19.994 -22.843
  550   2HE   LYS  75          HE3       LYS  75 -26.633  20.360 -23.055
  551   1HZ   LYS  75          HZ1       LYS  75 -27.271  18.402 -24.336
  552   2HZ   LYS  75          HZ2       LYS  75 -26.201  17.987 -23.191
  553   3HZ   LYS  75          HZ3       LYS  75 -27.790  17.626 -23.011
  554    H    LYS  76           H        LYS  76 -27.396  24.831 -21.301
  555    HA   LYS  76           HA       LYS  76 -29.437  25.845 -21.580
  556   1HB   LYS  76          HB2       LYS  76 -30.207  23.491 -21.615
  557   2HB   LYS  76          HB3       LYS  76 -30.643  23.614 -19.898
  558   1HG   LYS  76          HG2       LYS  76 -32.272  25.402 -20.399
  559   2HG   LYS  76          HG3       LYS  76 -31.795  25.387 -22.108
  560   1HD   LYS  76          HD2       LYS  76 -32.529  23.019 -22.290
  561   2HD   LYS  76          HD3       LYS  76 -33.058  23.084 -20.585
  562   1HE   LYS  76          HE2       LYS  76 -34.633  24.875 -21.090
  563   2HE   LYS  76          HE3       LYS  76 -34.073  24.930 -22.787
  564   1HZ   LYS  76          HZ1       LYS  76 -34.875  22.623 -23.030
  565   2HZ   LYS  76          HZ2       LYS  76 -35.434  22.601 -21.506
  566   3HZ   LYS  76          HZ3       LYS  76 -36.101  23.595 -22.605
  567    H    VAL  77           H        VAL  77 -27.906  27.153 -20.030
  568    HA   VAL  77           HA       VAL  77 -28.869  27.795 -17.413
  569    HB   VAL  77           HB       VAL  77 -27.061  29.333 -19.307
  570   1HG1  VAL  77          1HG1      VAL  77 -27.567  29.771 -16.323
  571   2HG1  VAL  77          2HG1      VAL  77 -26.300  30.562 -17.262
  572   3HG1  VAL  77          3HG1      VAL  77 -27.998  30.913 -17.624
  573   1HG2  VAL  77          1HG2      VAL  77 -26.466  27.618 -16.831
  574   2HG2  VAL  77          2HG2      VAL  77 -26.191  27.099 -18.507
  575   3HG2  VAL  77          3HG2      VAL  77 -25.278  28.460 -17.835
  576    H    ASP  78           H        ASP  78 -30.555  28.969 -16.810
  577    HA   ASP  78           HA       ASP  78 -32.017  30.650 -18.814
  578   1HB   ASP  78          HB2       ASP  78 -32.941  28.388 -18.737
  579   2HB   ASP  78          HB3       ASP  78 -33.236  28.572 -17.012
  580    H    LYS  79           H        LYS  79 -31.525  30.014 -15.397
  581    HA   LYS  79           HA       LYS  79 -31.342  32.421 -14.249
  582   1HB   LYS  79          HB2       LYS  79 -34.210  32.203 -15.009
  583   2HB   LYS  79          HB3       LYS  79 -33.959  32.497 -13.318
  584   1HG   LYS  79          HG2       LYS  79 -32.534  34.434 -13.773
  585   2HG   LYS  79          HG3       LYS  79 -32.635  34.141 -15.496
  586   1HD   LYS  79          HD2       LYS  79 -34.134  35.933 -14.995
  587   2HD   LYS  79          HD3       LYS  79 -35.134  34.522 -15.366
  588   1HE   LYS  79          HE2       LYS  79 -35.423  34.076 -12.920
  589   2HE   LYS  79          HE3       LYS  79 -34.436  35.507 -12.564
  590   1HZ   LYS  79          HZ1       LYS  79 -37.032  35.544 -14.003
  591   2HZ   LYS  79          HZ2       LYS  79 -36.794  36.016 -12.460
  592   3HZ   LYS  79          HZ3       LYS  79 -36.125  36.882 -13.679
  593    H    SER  80           H        SER  80 -32.849  29.254 -13.975
  594    HA   SER  80           HA       SER  80 -32.896  29.152 -11.086
  595   1HB   SER  80          HB2       SER  80 -33.172  26.684 -11.555
  596   2HB   SER  80          HB3       SER  80 -34.380  27.759 -12.282
  597    HG   SER  80           HG       SER  80 -33.665  26.220 -13.778
  598    H    ASP  81           H        ASP  81 -30.354  29.094 -13.269
  599    HA   ASP  81           HA       ASP  81 -28.615  27.153 -12.129
  600   1HB   ASP  81          HB2       ASP  81 -28.071  29.544 -13.939
  601   2HB   ASP  81          HB3       ASP  81 -27.036  28.121 -13.758
  602    H    GLU  82           H        GLU  82 -29.262  30.291 -10.884
  603    HA   GLU  82           HA       GLU  82 -26.629  30.995  -9.911
  604   1HB   GLU  82          HB2       GLU  82 -28.604  32.567 -10.116
  605   2HB   GLU  82          HB3       GLU  82 -29.334  31.732  -8.744
  606   1HG   GLU  82          HG2       GLU  82 -27.394  32.381  -7.322
  607   2HG   GLU  82          HG3       GLU  82 -26.601  33.071  -8.731
  608    H    ALA  83           H        ALA  83 -25.517  30.334  -8.095
  609    HA   ALA  83           HA       ALA  83 -26.755  28.793  -5.963
  610   1HB   ALA  83          HB1       ALA  83 -26.647  27.067  -7.789
  611   2HB   ALA  83          HB2       ALA  83 -24.960  27.479  -8.060
  612   3HB   ALA  83          HB3       ALA  83 -25.460  26.668  -6.551
  613    H    GLU  84           H        GLU  84 -25.359  28.213  -4.314
  614    HA   GLU  84           HA       GLU  84 -22.537  29.238  -4.407
  615   1HB   GLU  84          HB2       GLU  84 -23.972  30.487  -2.793
  616   2HB   GLU  84          HB3       GLU  84 -24.274  28.971  -1.906
  617   1HG   GLU  84          HG2       GLU  84 -21.927  28.764  -1.329
  618   2HG   GLU  84          HG3       GLU  84 -21.437  29.961  -2.519
  619    H    TYR  85           H        TYR  85 -21.463  27.540  -5.031
  620    HA   TYR  85           HA       TYR  85 -22.411  24.827  -4.538
  621   1HB   TYR  85          HB2       TYR  85 -20.205  26.057  -6.166
  622   2HB   TYR  85          HB3       TYR  85 -20.423  24.329  -6.068
  623    HD1  TYR  85           HD1      TYR  85 -22.964  23.563  -6.419
  624    HD2  TYR  85           HD2      TYR  85 -21.189  27.078  -8.126
  625    HE1  TYR  85           HE1      TYR  85 -24.647  23.513  -8.303
  626    HE2  TYR  85           HE2      TYR  85 -22.827  27.014  -9.979
  627    HH   TYR  85           HH       TYR  85 -24.733  25.992 -10.840
  628    H    ILE  86           H        ILE  86 -22.061  24.848  -2.214
  629    HA   ILE  86           HA       ILE  86 -19.276  24.821  -1.201
  630    HB   ILE  86           HB       ILE  86 -21.843  24.054   0.240
  631   1HG1  ILE  86          2HG1      ILE  86 -20.387  26.732   0.039
  632   2HG1  ILE  86          3HG1      ILE  86 -22.036  26.364  -0.493
  633   1HG2  ILE  86          1HG2      ILE  86 -19.697  23.152   1.214
  634   2HG2  ILE  86          2HG2      ILE  86 -19.093  24.821   1.302
  635   3HG2  ILE  86          3HG2      ILE  86 -20.489  24.314   2.263
  636   1HD1  ILE  86          1HD1      ILE  86 -22.667  25.926   1.899
  637   2HD1  ILE  86          2HD1      ILE  86 -21.064  26.572   2.364
  638   3HD1  ILE  86          3HD1      ILE  86 -22.220  27.603   1.526
  639    H    CYS  87           H        CYS  87 -18.013  23.065  -1.138
  640    HA   CYS  87           HA       CYS  87 -19.216  20.407  -1.636
  641   1HB   CYS  87          HB2       CYS  87 -17.444  19.995  -3.296
  642   2HB   CYS  87          HB3       CYS  87 -18.554  21.301  -3.745
  643    H    ILE  88           H        ILE  88 -18.229  18.606  -0.928
  644    HA   ILE  88           HA       ILE  88 -16.106  18.975   1.129
  645    HB   ILE  88           HB       ILE  88 -18.780  17.557   1.435
  646   1HG1  ILE  88          2HG1      ILE  88 -17.711  20.014   2.893
  647   2HG1  ILE  88          3HG1      ILE  88 -18.925  20.049   1.631
  648   1HG2  ILE  88          1HG2      ILE  88 -18.095  17.047   3.781
  649   2HG2  ILE  88          2HG2      ILE  88 -17.032  16.263   2.633
  650   3HG2  ILE  88          3HG2      ILE  88 -16.508  17.763   3.439
  651   1HD1  ILE  88          1HD1      ILE  88 -19.313  18.792   4.371
  652   2HD1  ILE  88          2HD1      ILE  88 -20.099  20.244   3.706
  653   3HD1  ILE  88          3HD1      ILE  88 -20.449  18.663   3.006
  654    H    ALA  89           H        ALA  89 -14.750  17.314   1.403
  655    HA   ALA  89           HA       ALA  89 -15.237  14.743   0.013
  656   1HB   ALA  89          HB1       ALA  89 -12.590  16.251  -0.019
  657   2HB   ALA  89          HB2       ALA  89 -12.870  14.636  -0.670
  658   3HB   ALA  89          HB3       ALA  89 -13.710  16.051  -1.383
  659    H    GLU  90           H        GLU  90 -14.273  12.971   0.949
  660    HA   GLU  90           HA       GLU  90 -13.118  13.143   3.657
  661   1HB   GLU  90          HB2       GLU  90 -15.657  13.233   3.795
  662   2HB   GLU  90          HB3       GLU  90 -15.714  11.656   2.999
  663   1HG   GLU  90          HG2       GLU  90 -14.287  10.771   4.925
  664   2HG   GLU  90          HG3       GLU  90 -14.470  12.338   5.727
  665    H    ASN  91           H        ASN  91 -11.846  11.308   4.130
  666    HA   ASN  91           HA       ASN  91 -12.260   8.844   2.630
  667   1HB   ASN  91          HB2       ASN  91 -10.314   8.624   1.437
  668   2HB   ASN  91          HB3       ASN  91 -10.697  10.328   1.159
  669   1HD2  ASN  91          1HD2      ASN  91  -7.039   9.970   1.864
  670   2HD2  ASN  91          2HD2      ASN  91  -8.143   9.083   0.795
  671    H    LYS  92           H        LYS  92  -9.999   7.476   3.209
  672    HA   LYS  92           HA       LYS  92 -10.522   6.653   5.909
  673   1HB   LYS  92          HB2       LYS  92  -8.159   5.404   4.907
  674   2HB   LYS  92          HB3       LYS  92  -9.758   4.736   5.148
  675   1HG   LYS  92          HG2       LYS  92  -8.809   6.090   2.606
  676   2HG   LYS  92          HG3       LYS  92  -8.843   4.347   2.894
  677   1HD   LYS  92          HD2       LYS  92 -11.413   4.563   3.193
  678   2HD   LYS  92          HD3       LYS  92 -11.252   6.193   2.510
  679   1HE   LYS  92          HE2       LYS  92 -10.103   5.186   0.510
  680   2HE   LYS  92          HE3       LYS  92 -10.406   3.587   1.193
  681   1HZ   LYS  92          HZ1       LYS  92 -12.815   4.142   1.113
  682   2HZ   LYS  92          HZ2       LYS  92 -12.472   5.556   0.377
  683   3HZ   LYS  92          HZ3       LYS  92 -12.128   4.155  -0.372
  684    H    ALA  93           H        ALA  93  -8.392   8.983   4.704
  685    HA   ALA  93           HA       ALA  93  -6.675   8.951   7.148
  686   1HB   ALA  93          HB1       ALA  93  -5.612   8.642   4.897
  687   2HB   ALA  93          HB2       ALA  93  -6.233  10.229   4.404
  688   3HB   ALA  93          HB3       ALA  93  -5.057  10.123   5.723
  689    H    GLY  94           H        GLY  94  -9.236  10.904   5.652
  690   1HA   GLY  94          HA2       GLY  94  -9.390  12.730   7.810
  691   2HA   GLY  94          HA3       GLY  94  -8.369  13.464   6.594
  692    H    GLU  95           H        GLU  95  -9.895  15.151   6.435
  693    HA   GLU  95           HA       GLU  95 -12.199  14.797   4.627
  694   1HB   GLU  95          HB2       GLU  95 -12.966  14.306   7.012
  695   2HB   GLU  95          HB3       GLU  95 -12.481  15.938   7.432
  696   1HG   GLU  95          HG2       GLU  95 -14.155  16.821   5.792
  697   2HG   GLU  95          HG3       GLU  95 -14.652  15.156   5.464
  698    H    GLN  96           H        GLN  96 -12.864  16.793   3.644
  699    HA   GLN  96           HA       GLN  96 -11.448  19.298   4.290
  700   1HB   GLN  96          HB2       GLN  96 -10.058  17.558   2.795
  701   2HB   GLN  96          HB3       GLN  96 -11.098  18.137   1.523
  702   1HG   GLN  96          HG2       GLN  96  -9.091  19.464   1.448
  703   2HG   GLN  96          HG3       GLN  96 -10.301  20.522   2.154
  704   1HE2  GLN  96          1HE2      GLN  96  -7.299  19.066   4.594
  705   2HE2  GLN  96          2HE2      GLN  96  -7.687  18.236   3.091
  706    H    ASP  97           H        ASP  97 -12.101  21.073   2.683
  707    HA   ASP  97           HA       ASP  97 -14.514  20.664   1.117
  708   1HB   ASP  97          HB2       ASP  97 -15.965  22.127   2.358
  709   2HB   ASP  97          HB3       ASP  97 -15.433  20.822   3.421
  710    H    ALA  98           H        ALA  98 -15.236  22.442  -0.110
  711    HA   ALA  98           HA       ALA  98 -13.718  24.980  -0.189
  712   1HB   ALA  98          HB1       ALA  98 -13.122  24.796  -2.543
  713   2HB   ALA  98          HB2       ALA  98 -12.395  23.473  -1.627
  714   3HB   ALA  98          HB3       ALA  98 -13.838  23.167  -2.629
  715    H    THR  99           H        THR  99 -14.758  26.431  -2.096
  716    HA   THR  99           HA       THR  99 -17.663  26.036  -2.426
  717    HB   THR  99           HB       THR  99 -16.411  28.355  -0.943
  718    HG1  THR  99           HG1      THR  99 -17.139  26.163  -0.031
  719   1HG2  THR  99          1HG2      THR  99 -18.201  29.315  -2.301
  720   2HG2  THR  99          2HG2      THR  99 -19.293  27.976  -1.896
  721   3HG2  THR  99          3HG2      THR  99 -18.803  29.128  -0.652
  722    H    ILE 100           H        ILE 100 -18.397  26.866  -4.307
  723    HA   ILE 100           HA       ILE 100 -16.834  28.998  -5.749
  724    HB   ILE 100           HB       ILE 100 -18.765  27.165  -7.150
  725   1HG1  ILE 100          2HG1      ILE 100 -15.768  26.612  -7.208
  726   2HG1  ILE 100          3HG1      ILE 100 -16.858  25.755  -6.116
  727   1HG2  ILE 100          1HG2      ILE 100 -16.551  28.975  -8.136
  728   2HG2  ILE 100          2HG2      ILE 100 -17.474  27.887  -9.169
  729   3HG2  ILE 100          3HG2      ILE 100 -18.309  29.187  -8.312
  730   1HD1  ILE 100          1HD1      ILE 100 -16.690  24.349  -8.014
  731   2HD1  ILE 100          2HD1      ILE 100 -18.252  25.138  -8.193
  732   3HD1  ILE 100          3HD1      ILE 100 -16.879  25.681  -9.149
  733    H    HIS 101           H        HIS 101 -18.005  30.875  -6.279
  734    HA   HIS 101           HA       HIS 101 -20.956  30.902  -5.677
  735   1HB   HIS 101          HB2       HIS 101 -19.150  33.266  -6.150
  736   2HB   HIS 101          HB3       HIS 101 -20.777  33.266  -5.523
  737    HD1  HIS 101           HD1      HIS 101 -20.989  32.414  -2.848
  738    HD2  HIS 101           HD2      HIS 101 -17.158  32.984  -4.480
  739    HE1  HIS 101           HE1      HIS 101 -19.384  32.410  -0.895
  740    H    LEU 102           H        LEU 102 -22.163  30.400  -7.494
  741    HA   LEU 102           HA       LEU 102 -21.225  31.428 -10.142
  742   1HB   LEU 102          HB2       LEU 102 -21.624  29.072 -10.214
  743   2HB   LEU 102          HB3       LEU 102 -23.232  29.245  -9.479
  744    HG   LEU 102           HG       LEU 102 -24.034  30.470 -11.482
  745   1HD1  LEU 102          1HD1      LEU 102 -21.914  31.523 -12.265
  746   2HD1  LEU 102          2HD1      LEU 102 -21.274  29.911 -12.682
  747   3HD1  LEU 102          3HD1      LEU 102 -22.679  30.597 -13.526
  748   1HD2  LEU 102          1HD2      LEU 102 -24.241  28.018 -11.434
  749   2HD2  LEU 102          2HD2      LEU 102 -24.046  28.637 -13.075
  750   3HD2  LEU 102          3HD2      LEU 102 -22.676  27.852 -12.254
  751    H    LYS 103           H        LYS 103 -21.841  33.440 -10.313
  752    HA   LYS 103           HA       LYS 103 -24.588  34.359  -9.564
  753   1HB   LYS 103          HB2       LYS 103 -22.178  35.856 -10.724
  754   2HB   LYS 103          HB3       LYS 103 -23.708  36.586 -10.214
  755   1HG   LYS 103          HG2       LYS 103 -23.264  35.728  -7.882
  756   2HG   LYS 103          HG3       LYS 103 -21.687  35.124  -8.425
  757   1HD   LYS 103          HD2       LYS 103 -21.006  37.390  -9.080
  758   2HD   LYS 103          HD3       LYS 103 -22.584  38.016  -8.592
  759   1HE   LYS 103          HE2       LYS 103 -22.173  37.304  -6.272
  760   2HE   LYS 103          HE3       LYS 103 -20.581  36.696  -6.708
  761   1HZ   LYS 103          HZ1       LYS 103 -21.403  39.541  -6.948
  762   2HZ   LYS 103          HZ2       LYS 103 -20.409  38.950  -5.806
  763   3HZ   LYS 103          HZ3       LYS 103 -19.936  38.931  -7.365
  764    H    VAL 104           H        VAL 104 -26.136  34.981 -11.059
  765    HA   VAL 104           HA       VAL 104 -25.667  34.414 -13.951
  766    HB   VAL 104           HB       VAL 104 -27.784  33.145 -12.199
  767   1HG1  VAL 104          1HG1      VAL 104 -28.837  33.611 -14.296
  768   2HG1  VAL 104          2HG1      VAL 104 -27.437  33.024 -15.210
  769   3HG1  VAL 104          3HG1      VAL 104 -28.444  31.897 -14.246
  770   1HG2  VAL 104          1HG2      VAL 104 -26.717  31.029 -12.950
  771   2HG2  VAL 104          2HG2      VAL 104 -25.465  31.968 -13.759
  772   3HG2  VAL 104          3HG2      VAL 104 -25.650  32.001 -11.981
  773    H    PHE 105           H        PHE 105 -26.232  36.232 -15.041
  774    HA   PHE 105           HA       PHE 105 -28.231  38.069 -13.791
  775   1HB   PHE 105          HB2       PHE 105 -27.175  39.688 -15.278
  776   2HB   PHE 105          HB3       PHE 105 -26.122  39.086 -14.035
  777    HD1  PHE 105           HD1      PHE 105 -26.708  39.464 -17.625
  778    HD2  PHE 105           HD2      PHE 105 -24.205  37.613 -14.661
  779    HE1  PHE 105           HE1      PHE 105 -24.908  39.195 -19.313
  780    HE2  PHE 105           HE2      PHE 105 -22.413  37.343 -16.352
  781    HZ   PHE 105           HZ       PHE 105 -22.731  38.137 -18.671
  782    H    ALA 106           H        ALA 106 -29.946  38.880 -14.820
  783    HA   ALA 106           HA       ALA 106 -31.068  37.173 -16.902
  784   1HB   ALA 106          HB1       ALA 106 -32.245  37.696 -14.779
  785   2HB   ALA 106          HB2       ALA 106 -32.283  39.418 -15.237
  786   3HB   ALA 106          HB3       ALA 106 -33.150  38.212 -16.212
  787    H    LYS 107           H        LYS 107 -29.074  38.559 -18.054
  788    HA   LYS 107           HA       LYS 107 -28.547  39.544 -20.035
  789   1HB   LYS 107          HB2       LYS 107 -31.529  39.887 -20.561
  790   2HB   LYS 107          HB3       LYS 107 -30.218  39.977 -21.729
  791   1HG   LYS 107          HG2       LYS 107 -29.639  37.604 -21.358
  792   2HG   LYS 107          HG3       LYS 107 -30.886  37.473 -20.114
  793   1HD   LYS 107          HD2       LYS 107 -31.361  37.999 -23.081
  794   2HD   LYS 107          HD3       LYS 107 -31.563  36.469 -22.252
  795   1HE   LYS 107          HE2       LYS 107 -33.285  37.579 -20.705
  796   2HE   LYS 107          HE3       LYS 107 -33.168  39.033 -21.722
  797   1HZ   LYS 107          HZ1       LYS 107 -35.002  37.750 -22.424
  798   2HZ   LYS 107          HZ2       LYS 107 -33.881  37.593 -23.630
  799   3HZ   LYS 107          HZ3       LYS 107 -34.152  36.369 -22.544
  Start of MODEL   14
    1   1H    GLY   1          H1        GLY   1   4.513  11.757   0.442
    2   2H    GLY   1          H2        GLY   1   5.710  10.777  -0.047
    3   3H    GLY   1          H3        GLY   1   4.597  11.277  -1.127
    4   1HA   GLY   1          HA2       GLY   1   4.081   9.468   1.150
    5   2HA   GLY   1          HA3       GLY   1   2.853  10.031  -0.004
    6    H    LYS   2           H        LYS   2   3.130   7.388   0.291
    7    HA   LYS   2           HA       LYS   2   3.875   6.471  -2.361
    8   1HB   LYS   2          HB2       LYS   2   6.044   6.512  -1.058
    9   2HB   LYS   2          HB3       LYS   2   5.408   5.296   0.017
   10   1HG   LYS   2          HG2       LYS   2   6.971   4.406  -1.701
   11   2HG   LYS   2          HG3       LYS   2   5.398   3.646  -1.799
   12   1HD   LYS   2          HD2       LYS   2   6.306   4.099  -4.021
   13   2HD   LYS   2          HD3       LYS   2   4.766   4.868  -3.741
   14   1HE   LYS   2          HE2       LYS   2   6.215   6.409  -4.923
   15   2HE   LYS   2          HE3       LYS   2   5.946   7.051  -3.303
   16   1HZ   LYS   2          HZ1       LYS   2   8.384   5.615  -4.210
   17   2HZ   LYS   2          HZ2       LYS   2   8.279   7.200  -3.924
   18   3HZ   LYS   2          HZ3       LYS   2   8.153   6.139  -2.683
   19    H    ASP   3           H        ASP   3   1.407   6.577  -1.364
   20    HA   ASP   3           HA       ASP   3   0.560   4.042  -0.209
   21   1HB   ASP   3          HB2       ASP   3  -0.564   6.312   0.102
   22   2HB   ASP   3          HB3       ASP   3  -1.237   6.105  -1.530
   23    H    ILE   4           H        ILE   4   1.947   4.253  -2.962
   24    HA   ILE   4           HA       ILE   4  -0.026   3.122  -4.855
   25    HB   ILE   4           HB       ILE   4   2.945   3.681  -5.221
   26   1HG1  ILE   4          2HG1      ILE   4   2.011   5.779  -4.551
   27   2HG1  ILE   4          3HG1      ILE   4   2.310   5.816  -6.283
   28   1HG2  ILE   4          1HG2      ILE   4   2.048   2.248  -6.972
   29   2HG2  ILE   4          2HG2      ILE   4   0.678   3.341  -7.237
   30   3HG2  ILE   4          3HG2      ILE   4   2.333   3.882  -7.624
   31   1HD1  ILE   4          1HD1      ILE   4   0.200   6.931  -5.695
   32   2HD1  ILE   4          2HD1      ILE   4  -0.097   5.510  -6.730
   33   3HD1  ILE   4          3HD1      ILE   4  -0.431   5.437  -4.986
   34    H    GLN   5           H        GLN   5   2.688   1.943  -2.920
   35    HA   GLN   5           HA       GLN   5   1.839  -0.785  -3.500
   36   1HB   GLN   5          HB2       GLN   5   3.668   0.075  -5.189
   37   2HB   GLN   5          HB3       GLN   5   4.814  -0.152  -3.853
   38   1HG   GLN   5          HG2       GLN   5   4.165  -2.580  -3.753
   39   2HG   GLN   5          HG3       GLN   5   2.965  -2.311  -5.009
   40   1HE2  GLN   5          1HE2      GLN   5   5.352  -2.932  -7.544
   41   2HE2  GLN   5          2HE2      GLN   5   3.662  -2.993  -7.024
   42    H    VAL   6           H        VAL   6   1.799   0.971  -1.308
   43    HA   VAL   6           HA       VAL   6   2.646  -0.745   0.904
   44    HB   VAL   6           HB       VAL   6   3.548   2.167   0.970
   45   1HG1  VAL   6          1HG1      VAL   6   4.216  -0.211   2.754
   46   2HG1  VAL   6          2HG1      VAL   6   4.878   1.411   2.912
   47   3HG1  VAL   6          3HG1      VAL   6   3.187   1.157   3.219
   48   1HG2  VAL   6          1HG2      VAL   6   5.895   1.429   0.820
   49   2HG2  VAL   6          2HG2      VAL   6   5.365  -0.217   0.444
   50   3HG2  VAL   6          3HG2      VAL   6   4.992   1.115  -0.657
   51    H    ILE   7           H        ILE   7   1.375  -0.156   2.833
   52    HA   ILE   7           HA       ILE   7  -1.023   1.490   2.222
   53    HB   ILE   7           HB       ILE   7  -0.424  -0.267   4.618
   54   1HG1  ILE   7          2HG1      ILE   7  -2.176  -0.775   2.157
   55   2HG1  ILE   7          3HG1      ILE   7  -0.636  -1.577   2.493
   56   1HG2  ILE   7          1HG2      ILE   7  -1.998   1.576   5.113
   57   2HG2  ILE   7          2HG2      ILE   7  -3.018   1.067   3.728
   58   3HG2  ILE   7          3HG2      ILE   7  -2.834   0.042   5.162
   59   1HD1  ILE   7          1HD1      ILE   7  -1.678  -2.519   4.612
   60   2HD1  ILE   7          2HD1      ILE   7  -3.238  -1.914   4.041
   61   3HD1  ILE   7          3HD1      ILE   7  -2.370  -3.137   3.086
   62    H    VAL   8           H        VAL   8  -0.852   3.601   2.561
   63    HA   VAL   8           HA       VAL   8   0.450   4.679   5.056
   64    HB   VAL   8           HB       VAL   8   0.931   5.758   2.241
   65   1HG1  VAL   8          1HG1      VAL   8   2.274   6.456   4.900
   66   2HG1  VAL   8          2HG1      VAL   8   2.648   7.143   3.309
   67   3HG1  VAL   8          3HG1      VAL   8   1.079   7.442   4.071
   68   1HG2  VAL   8          1HG2      VAL   8   2.819   4.141   4.023
   69   2HG2  VAL   8          2HG2      VAL   8   2.213   3.630   2.435
   70   3HG2  VAL   8          3HG2      VAL   8   3.314   5.013   2.539
   71    H    ASN   9           H        ASN   9  -1.611   5.185   2.262
   72    HA   ASN   9           HA       ASN   9  -3.173   6.597   1.616
   73   1HB   ASN   9          HB2       ASN   9  -3.922   6.734   4.553
   74   2HB   ASN   9          HB3       ASN   9  -4.996   7.049   3.177
   75   1HD2  ASN   9          1HD2      ASN   9  -4.645   3.361   2.324
   76   2HD2  ASN   9          2HD2      ASN   9  -4.148   4.785   1.471
   77    H    VAL  10           H        VAL  10  -4.264   8.609   1.729
   78    HA   VAL  10           HA       VAL  10  -2.658  10.956   2.601
   79    HB   VAL  10           HB       VAL  10  -3.547  10.453  -0.247
   80   1HG1  VAL  10          1HG1      VAL  10  -2.243  12.920   0.966
   81   2HG1  VAL  10          2HG1      VAL  10  -2.416  12.600  -0.769
   82   3HG1  VAL  10          3HG1      VAL  10  -3.839  12.817   0.225
   83   1HG2  VAL  10          1HG2      VAL  10  -1.483   9.255   0.210
   84   2HG2  VAL  10          2HG2      VAL  10  -1.107  10.661  -0.761
   85   3HG2  VAL  10          3HG2      VAL  10  -0.782  10.701   0.986
   86    HA   PRO  11           HA       PRO  11  -6.903  12.101   3.640
   87   1HB   PRO  11          HB2       PRO  11  -5.671  14.868   3.696
   88   2HB   PRO  11          HB3       PRO  11  -6.813  14.133   4.857
   89   1HG   PRO  11          HG2       PRO  11  -4.137  14.246   5.449
   90   2HG   PRO  11          HG3       PRO  11  -5.071  12.757   5.769
   91   1HD   PRO  11          HD2       PRO  11  -3.284  13.378   3.389
   92   2HD   PRO  11          HD3       PRO  11  -3.368  11.906   4.409
   93    HA   PRO  12           HA       PRO  12  -8.575  13.806  -0.155
   94   1HB   PRO  12          HB2       PRO  12 -10.574  15.364   1.400
   95   2HB   PRO  12          HB3       PRO  12 -10.848  14.153   0.129
   96   1HG   PRO  12          HG2       PRO  12 -11.278  13.591   2.762
   97   2HG   PRO  12          HG3       PRO  12 -10.574  12.342   1.665
   98   1HD   PRO  12          HD2       PRO  12  -9.187  14.269   3.582
   99   2HD   PRO  12          HD3       PRO  12  -8.959  12.497   3.417
  100    H    SER  13           H        SER  13  -8.528  15.650  -1.448
  101    HA   SER  13           HA       SER  13  -7.585  18.239  -0.284
  102   1HB   SER  13          HB2       SER  13  -6.515  16.757  -2.719
  103   2HB   SER  13          HB3       SER  13  -6.012  18.372  -2.216
  104    HG   SER  13           HG       SER  13  -4.603  16.703  -1.462
  105    H    VAL  14           H        VAL  14 -10.273  18.050  -0.732
  106    HA   VAL  14           HA       VAL  14 -10.796  18.982  -3.457
  107    HB   VAL  14           HB       VAL  14 -12.555  17.852  -2.169
  108   1HG1  VAL  14          1HG1      VAL  14 -12.968  20.515  -0.725
  109   2HG1  VAL  14          2HG1      VAL  14 -14.004  19.090  -0.621
  110   3HG1  VAL  14          3HG1      VAL  14 -12.365  19.017   0.021
  111   1HG2  VAL  14          1HG2      VAL  14 -14.378  19.166  -3.077
  112   2HG2  VAL  14          2HG2      VAL  14 -13.372  20.622  -3.106
  113   3HG2  VAL  14          3HG2      VAL  14 -12.994  19.280  -4.195
  114    H    ARG  15           H        ARG  15 -10.749  20.839  -4.277
  115    HA   ARG  15           HA       ARG  15 -10.327  23.337  -2.670
  116   1HB   ARG  15          HB2       ARG  15  -8.837  22.260  -5.096
  117   2HB   ARG  15          HB3       ARG  15  -8.781  23.959  -4.650
  118   1HG   ARG  15          HG2       ARG  15  -7.512  23.588  -2.780
  119   2HG   ARG  15          HG3       ARG  15  -8.100  21.960  -2.508
  120   1HD   ARG  15          HD2       ARG  15  -6.212  22.731  -4.780
  121   2HD   ARG  15          HD3       ARG  15  -5.707  22.017  -3.240
  122    HE   ARG  15           HE       ARG  15  -7.631  20.259  -4.158
  123   1HH1  ARG  15          1HH1      ARG  15  -6.133  18.426  -6.577
  124   2HH1  ARG  15          2HH1      ARG  15  -7.586  18.734  -5.643
  125   1HH2  ARG  15          1HH2      ARG  15  -4.591  21.324  -5.548
  126   2HH2  ARG  15          2HH2      ARG  15  -4.507  19.918  -6.588
  127    H    ALA  16           H        ALA  16 -10.654  25.271  -4.054
  128    HA   ALA  16           HA       ALA  16 -12.991  24.975  -5.889
  129   1HB   ALA  16          HB1       ALA  16 -13.269  26.616  -4.121
  130   2HB   ALA  16          HB2       ALA  16 -11.721  27.397  -4.567
  131   3HB   ALA  16          HB3       ALA  16 -13.103  27.462  -5.676
  132    H    ARG  17           H        ARG  17 -12.640  24.888  -8.055
  133    HA   ARG  17           HA       ARG  17 -10.000  25.347  -9.182
  134   1HB   ARG  17          HB2       ARG  17 -11.685  23.645  -9.978
  135   2HB   ARG  17          HB3       ARG  17 -12.584  24.950 -10.729
  136   1HG   ARG  17          HG2       ARG  17 -10.591  25.551 -12.078
  137   2HG   ARG  17          HG3       ARG  17  -9.680  24.223 -11.335
  138   1HD   ARG  17          HD2       ARG  17 -12.190  23.931 -13.050
  139   2HD   ARG  17          HD3       ARG  17 -10.564  23.785 -13.650
  140    HE   ARG  17           HE       ARG  17 -12.046  21.793 -12.146
  141   1HH1  ARG  17          1HH1      ARG  17  -8.755  22.763 -12.889
  142   2HH1  ARG  17          2HH1      ARG  17  -8.172  21.129 -12.822
  143   1HH2  ARG  17          1HH2      ARG  17 -11.218  19.738 -12.062
  144   2HH2  ARG  17          2HH2      ARG  17  -9.512  19.463 -12.335
  145    H    GLN  18           H        GLN  18 -12.871  27.311  -8.862
  146    HA   GLN  18           HA       GLN  18 -11.397  29.738  -9.248
  147   1HB   GLN  18          HB2       GLN  18 -11.915  29.101 -11.642
  148   2HB   GLN  18          HB3       GLN  18 -13.639  29.254 -11.248
  149   1HG   GLN  18          HG2       GLN  18 -13.302  31.604 -10.589
  150   2HG   GLN  18          HG3       GLN  18 -11.566  31.464 -10.899
  151   1HE2  GLN  18          1HE2      GLN  18 -13.984  32.479 -13.938
  152   2HE2  GLN  18          2HE2      GLN  18 -14.521  32.426 -12.247
  153    H    SER  19           H        SER  19 -12.238  31.034  -7.637
  154    HA   SER  19           HA       SER  19 -14.389  30.064  -6.057
  155   1HB   SER  19          HB2       SER  19 -13.115  32.817  -5.869
  156   2HB   SER  19          HB3       SER  19 -13.990  31.912  -4.606
  157    HG   SER  19           HG       SER  19 -11.708  31.741  -4.422
  158    H    THR  20           H        THR  20 -14.592  32.315  -8.694
  159    HA   THR  20           HA       THR  20 -17.502  32.627  -8.158
  160    HB   THR  20           HB       THR  20 -15.745  34.919  -9.112
  161    HG1  THR  20           HG1      THR  20 -15.468  34.543  -6.894
  162   1HG2  THR  20          1HG2      THR  20 -18.037  35.019 -10.020
  163   2HG2  THR  20          2HG2      THR  20 -18.695  34.779  -8.385
  164   3HG2  THR  20          3HG2      THR  20 -17.769  36.239  -8.781
  165    H    MET  21           H        MET  21 -18.652  32.025  -9.776
  166    HA   MET  21           HA       MET  21 -17.617  32.098 -12.577
  167   1HB   MET  21          HB2       MET  21 -19.574  30.175 -11.230
  168   2HB   MET  21          HB3       MET  21 -19.311  30.229 -12.975
  169   1HG   MET  21          HG2       MET  21 -17.238  29.520 -10.885
  170   2HG   MET  21          HG3       MET  21 -18.056  28.420 -11.991
  171   1HE   MET  21          HE1       MET  21 -17.854  30.201 -14.866
  172   2HE   MET  21          HE2       MET  21 -16.418  29.388 -15.468
  173   3HE   MET  21          HE3       MET  21 -17.692  28.437 -14.658
  174    H    ASN  22           H        ASN  22 -19.369  32.379 -14.203
  175    HA   ASN  22           HA       ASN  22 -21.876  33.595 -13.391
  176   1HB   ASN  22          HB2       ASN  22 -21.476  35.801 -14.405
  177   2HB   ASN  22          HB3       ASN  22 -20.352  35.522 -13.094
  178   1HD2  ASN  22          1HD2      ASN  22 -17.519  35.847 -15.222
  179   2HD2  ASN  22          2HD2      ASN  22 -18.099  35.544 -13.586
  180    H    ALA  23           H        ALA  23 -23.250  34.137 -15.231
  181    HA   ALA  23           HA       ALA  23 -22.647  33.074 -17.883
  182   1HB   ALA  23          HB1       ALA  23 -24.483  31.537 -15.975
  183   2HB   ALA  23          HB2       ALA  23 -24.254  31.182 -17.700
  184   3HB   ALA  23          HB3       ALA  23 -22.902  30.979 -16.563
  185    H    THR  24           H        THR  24 -24.411  33.338 -19.366
  186    HA   THR  24           HA       THR  24 -26.276  35.509 -18.546
  187    HB   THR  24           HB       THR  24 -25.761  34.569 -21.375
  188    HG1  THR  24           HG1      THR  24 -24.308  36.415 -19.810
  189   1HG2  THR  24          1HG2      THR  24 -26.382  36.888 -21.894
  190   2HG2  THR  24          2HG2      THR  24 -27.678  36.072 -21.019
  191   3HG2  THR  24          3HG2      THR  24 -26.643  37.213 -20.151
  192    H    ALA  25           H        ALA  25 -28.269  34.954 -18.055
  193    HA   ALA  25           HA       ALA  25 -29.505  32.434 -18.894
  194   1HB   ALA  25          HB1       ALA  25 -29.774  33.197 -16.632
  195   2HB   ALA  25          HB2       ALA  25 -30.417  34.770 -17.135
  196   3HB   ALA  25          HB3       ALA  25 -31.342  33.289 -17.420
  197    H    ASN  26           H        ASN  26 -31.824  32.508 -19.629
  198    HA   ASN  26           HA       ASN  26 -33.388  32.873 -21.129
  199   1HB   ASN  26          HB2       ASN  26 -32.352  35.653 -21.745
  200   2HB   ASN  26          HB3       ASN  26 -33.942  34.995 -22.043
  201   1HD2  ASN  26          1HD2      ASN  26 -33.258  36.755 -18.507
  202   2HD2  ASN  26          2HD2      ASN  26 -32.032  36.678 -19.775
  203    H    LEU  27           H        LEU  27 -30.146  32.925 -21.918
  204    HA   LEU  27           HA       LEU  27 -30.579  32.410 -24.819
  205   1HB   LEU  27          HB2       LEU  27 -28.022  32.806 -23.202
  206   2HB   LEU  27          HB3       LEU  27 -28.115  32.637 -24.953
  207    HG   LEU  27           HG       LEU  27 -29.191  34.963 -23.325
  208   1HD1  LEU  27          1HD1      LEU  27 -26.726  34.814 -23.552
  209   2HD1  LEU  27          2HD1      LEU  27 -26.902  34.758 -25.313
  210   3HD1  LEU  27          3HD1      LEU  27 -27.404  36.212 -24.418
  211   1HD2  LEU  27          1HD2      LEU  27 -30.582  34.639 -25.310
  212   2HD2  LEU  27          2HD2      LEU  27 -29.557  36.063 -25.526
  213   3HD2  LEU  27          3HD2      LEU  27 -29.130  34.558 -26.349
  214    H    SER  28           H        SER  28 -30.453  30.634 -21.977
  215    HA   SER  28           HA       SER  28 -30.031  28.479 -21.390
  216   1HB   SER  28          HB2       SER  28 -30.738  27.945 -24.293
  217   2HB   SER  28          HB3       SER  28 -30.701  26.744 -23.000
  218    HG   SER  28           HG       SER  28 -32.394  29.037 -23.185
  219    H    GLN  29           H        GLN  29 -27.677  29.697 -21.586
  220    HA   GLN  29           HA       GLN  29 -25.738  28.528 -23.358
  221   1HB   GLN  29          HB2       GLN  29 -25.506  29.951 -20.649
  222   2HB   GLN  29          HB3       GLN  29 -24.116  29.419 -21.583
  223   1HG   GLN  29          HG2       GLN  29 -24.798  30.744 -23.514
  224   2HG   GLN  29          HG3       GLN  29 -26.200  31.374 -22.624
  225   1HE2  GLN  29          1HE2      GLN  29 -23.414  33.871 -22.327
  226   2HE2  GLN  29          2HE2      GLN  29 -24.266  33.142 -23.682
  227    H    SER  30           H        SER  30 -23.925  27.266 -22.825
  228    HA   SER  30           HA       SER  30 -24.302  25.160 -20.753
  229   1HB   SER  30          HB2       SER  30 -22.846  23.730 -22.118
  230   2HB   SER  30          HB3       SER  30 -24.355  24.099 -22.906
  231    HG   SER  30           HG       SER  30 -22.577  24.316 -24.355
  232    H    VAL  31           H        VAL  31 -22.622  24.789 -19.390
  233    HA   VAL  31           HA       VAL  31 -20.256  26.650 -19.392
  234    HB   VAL  31           HB       VAL  31 -22.307  26.624 -17.133
  235   1HG1  VAL  31          1HG1      VAL  31 -20.019  27.111 -16.299
  236   2HG1  VAL  31          2HG1      VAL  31 -19.806  28.336 -17.587
  237   3HG1  VAL  31          3HG1      VAL  31 -20.995  28.577 -16.267
  238   1HG2  VAL  31          1HG2      VAL  31 -23.274  27.911 -18.981
  239   2HG2  VAL  31          2HG2      VAL  31 -22.759  29.004 -17.706
  240   3HG2  VAL  31          3HG2      VAL  31 -21.773  28.828 -19.169
  241    H    THR  32           H        THR  32 -18.493  25.699 -18.440
  242    HA   THR  32           HA       THR  32 -18.904  23.329 -16.672
  243    HB   THR  32           HB       THR  32 -16.285  24.225 -17.898
  244    HG1  THR  32           HG1      THR  32 -16.676  22.691 -19.461
  245   1HG2  THR  32          1HG2      THR  32 -16.015  22.684 -15.998
  246   2HG2  THR  32          2HG2      THR  32 -17.215  21.583 -16.659
  247   3HG2  THR  32          3HG2      THR  32 -15.665  21.808 -17.497
  248    H    LEU  33           H        LEU  33 -18.189  23.314 -14.597
  249    HA   LEU  33           HA       LEU  33 -16.290  25.229 -13.546
  250   1HB   LEU  33          HB2       LEU  33 -17.786  26.132 -11.784
  251   2HB   LEU  33          HB3       LEU  33 -18.136  26.630 -13.419
  252    HG   LEU  33           HG       LEU  33 -20.032  24.877 -13.434
  253   1HD1  LEU  33          1HD1      LEU  33 -19.504  25.023 -10.436
  254   2HD1  LEU  33          2HD1      LEU  33 -20.984  24.394 -11.196
  255   3HD1  LEU  33          3HD1      LEU  33 -19.455  23.558 -11.471
  256   1HD2  LEU  33          1HD2      LEU  33 -20.147  27.247 -11.526
  257   2HD2  LEU  33          2HD2      LEU  33 -20.405  27.315 -13.274
  258   3HD2  LEU  33          3HD2      LEU  33 -21.562  26.425 -12.266
  259    H    ALA  34           H        ALA  34 -15.825  24.684 -11.137
  260    HA   ALA  34           HA       ALA  34 -16.405  21.876 -10.461
  261   1HB   ALA  34          HB1       ALA  34 -14.789  21.836 -12.467
  262   2HB   ALA  34          HB2       ALA  34 -13.649  22.730 -11.480
  263   3HB   ALA  34          HB3       ALA  34 -14.111  21.094 -11.016
  264    H    CYS  35           H        CYS  35 -15.625  21.022  -8.698
  265    HA   CYS  35           HA       CYS  35 -13.834  22.582  -6.854
  266   1HB   CYS  35          HB2       CYS  35 -16.168  20.710  -6.180
  267   2HB   CYS  35          HB3       CYS  35 -14.825  21.036  -5.081
  268    H    ASP  36           H        ASP  36 -11.833  21.698  -7.297
  269    HA   ASP  36           HA       ASP  36 -11.604  19.051  -8.415
  270   1HB   ASP  36          HB2       ASP  36  -9.250  19.627  -8.774
  271   2HB   ASP  36          HB3       ASP  36 -10.396  20.746  -9.472
  272    H    ALA  37           H        ALA  37 -12.397  17.827  -6.684
  273    HA   ALA  37           HA       ALA  37 -10.768  17.273  -4.352
  274   1HB   ALA  37          HB1       ALA  37 -12.311  15.400  -4.006
  275   2HB   ALA  37          HB2       ALA  37 -13.224  16.845  -4.427
  276   3HB   ALA  37          HB3       ALA  37 -12.969  15.584  -5.648
  277    H    ASP  38           H        ASP  38  -9.490  15.645  -3.867
  278    HA   ASP  38           HA       ASP  38  -8.690  13.493  -5.693
  279   1HB   ASP  38          HB2       ASP  38  -7.469  15.527  -6.519
  280   2HB   ASP  38          HB3       ASP  38  -6.776  15.725  -4.899
  281    H    GLY  39           H        GLY  39  -6.897  12.142  -4.551
  282   1HA   GLY  39          HA2       GLY  39  -5.943  12.304  -2.002
  283   2HA   GLY  39          HA3       GLY  39  -7.583  11.677  -1.750
  284    H    PHE  40           H        PHE  40  -5.675  10.040  -0.896
  285    HA   PHE  40           HA       PHE  40  -5.801   7.791  -2.823
  286   1HB   PHE  40          HB2       PHE  40  -3.270   8.487  -1.328
  287   2HB   PHE  40          HB3       PHE  40  -3.590   7.008  -2.234
  288    HD1  PHE  40           HD1      PHE  40  -3.006  10.667  -2.552
  289    HD2  PHE  40           HD2      PHE  40  -3.383   6.898  -4.622
  290    HE1  PHE  40           HE1      PHE  40  -2.144  11.718  -4.630
  291    HE2  PHE  40           HE2      PHE  40  -2.553   7.957  -6.700
  292    HZ   PHE  40           HZ       PHE  40  -1.956  10.405  -6.708
  293    HA   PRO  41           HA       PRO  41  -6.891   5.952  -2.815
  294   1HB   PRO  41          HB2       PRO  41  -9.291   4.919  -2.108
  295   2HB   PRO  41          HB3       PRO  41  -7.730   4.068  -1.836
  296   1HG   PRO  41          HG2       PRO  41  -9.313   5.746   0.115
  297   2HG   PRO  41          HG3       PRO  41  -8.679   4.085   0.367
  298   1HD   PRO  41          HD2       PRO  41  -7.306   6.298   1.242
  299   2HD   PRO  41          HD3       PRO  41  -6.443   4.902   0.545
  300    H    GLU  42           H        GLU  42  -8.503   6.710  -4.220
  301    HA   GLU  42           HA       GLU  42  -9.270   9.280  -4.414
  302   1HB   GLU  42          HB2       GLU  42 -10.883   6.861  -5.250
  303   2HB   GLU  42          HB3       GLU  42 -11.171   8.535  -5.780
  304   1HG   GLU  42          HG2       GLU  42  -8.888   8.605  -6.725
  305   2HG   GLU  42          HG3       GLU  42  -8.602   6.949  -6.234
  306    HA   PRO  43           HA       PRO  43 -11.887   9.965  -0.951
  307   1HB   PRO  43          HB2       PRO  43 -12.667  12.527  -1.285
  308   2HB   PRO  43          HB3       PRO  43 -10.942  12.092  -1.062
  309   1HG   PRO  43          HG2       PRO  43 -12.424  12.589  -3.697
  310   2HG   PRO  43          HG3       PRO  43 -10.880  13.331  -3.114
  311   1HD   PRO  43          HD2       PRO  43 -10.896  11.108  -4.727
  312   2HD   PRO  43          HD3       PRO  43  -9.662  11.313  -3.447
  313    H    THR  44           H        THR  44 -13.933  10.248  -0.169
  314    HA   THR  44           HA       THR  44 -16.231   9.841  -2.085
  315    HB   THR  44           HB       THR  44 -16.183   9.724   0.965
  316    HG1  THR  44           HG1      THR  44 -16.324   7.489   0.639
  317   1HG2  THR  44          1HG2      THR  44 -18.440  10.266   0.121
  318   2HG2  THR  44          2HG2      THR  44 -18.314   8.941  -1.070
  319   3HG2  THR  44          3HG2      THR  44 -18.383   8.570   0.680
  320    H    MET  45           H        MET  45 -17.202  11.693  -2.816
  321    HA   MET  45           HA       MET  45 -17.192  14.072  -1.031
  322   1HB   MET  45          HB2       MET  45 -16.154  15.448  -2.631
  323   2HB   MET  45          HB3       MET  45 -15.144  14.020  -2.499
  324   1HG   MET  45          HG2       MET  45 -15.195  14.298  -4.779
  325   2HG   MET  45          HG3       MET  45 -16.527  13.175  -4.579
  326   1HE   MET  45          HE1       MET  45 -15.295  16.678  -5.589
  327   2HE   MET  45          HE2       MET  45 -16.776  17.640  -5.734
  328   3HE   MET  45          HE3       MET  45 -16.181  17.186  -4.141
  329    H    THR  46           H        THR  46 -18.588  15.735  -1.514
  330    HA   THR  46           HA       THR  46 -20.642  15.440  -3.608
  331    HB   THR  46           HB       THR  46 -22.526  15.756  -2.026
  332    HG1  THR  46           HG1      THR  46 -22.183  15.182   0.169
  333   1HG2  THR  46          1HG2      THR  46 -22.848  13.527  -1.336
  334   2HG2  THR  46          2HG2      THR  46 -22.056  13.523  -2.913
  335   3HG2  THR  46          3HG2      THR  46 -21.130  13.139  -1.442
  336    H    TRP  47           H        TRP  47 -22.204  17.359  -3.517
  337    HA   TRP  47           HA       TRP  47 -21.304  19.720  -2.094
  338   1HB   TRP  47          HB2       TRP  47 -20.937  21.078  -4.199
  339   2HB   TRP  47          HB3       TRP  47 -19.685  20.040  -3.575
  340    HD1  TRP  47           HD1      TRP  47 -19.585  17.504  -5.007
  341    HE1  TRP  47           HE1      TRP  47 -18.727  17.524  -7.405
  342    HE3  TRP  47           HE3      TRP  47 -21.004  22.227  -6.369
  343    HZ2  TRP  47           HZ2      TRP  47 -18.534  19.350  -9.567
  344    HZ3  TRP  47           HZ3      TRP  47 -20.236  23.192  -8.521
  345    HH2  TRP  47           HH2      TRP  47 -18.995  21.776 -10.127
  346    H    THR  48           H        THR  48 -22.658  21.664  -2.486
  347    HA   THR  48           HA       THR  48 -25.464  20.803  -3.103
  348    HB   THR  48           HB       THR  48 -26.231  22.080  -1.174
  349    HG1  THR  48           HG1      THR  48 -24.709  23.034   0.204
  350   1HG2  THR  48          1HG2      THR  48 -25.289  20.827   0.648
  351   2HG2  THR  48          2HG2      THR  48 -25.391  19.722  -0.742
  352   3HG2  THR  48          3HG2      THR  48 -23.829  20.459  -0.255
  353    H    LYS  49           H        LYS  49 -27.004  22.401  -3.647
  354    HA   LYS  49           HA       LYS  49 -25.986  24.818  -5.053
  355   1HB   LYS  49          HB2       LYS  49 -27.377  23.071  -6.262
  356   2HB   LYS  49          HB3       LYS  49 -28.730  23.489  -5.201
  357   1HG   LYS  49          HG2       LYS  49 -28.474  25.888  -6.057
  358   2HG   LYS  49          HG3       LYS  49 -27.298  25.258  -7.237
  359   1HD   LYS  49          HD2       LYS  49 -29.080  23.757  -8.104
  360   2HD   LYS  49          HD3       LYS  49 -30.218  24.424  -6.952
  361   1HE   LYS  49          HE2       LYS  49 -28.812  26.040  -9.138
  362   2HE   LYS  49          HE3       LYS  49 -30.428  25.340  -9.255
  363   1HZ   LYS  49          HZ1       LYS  49 -30.919  26.717  -7.183
  364   2HZ   LYS  49          HZ2       LYS  49 -29.571  27.594  -7.561
  365   3HZ   LYS  49          HZ3       LYS  49 -30.819  27.505  -8.617
  366    H    ASP  50           H        ASP  50 -25.589  25.718  -2.910
  367    HA   ASP  50           HA       ASP  50 -25.978  27.086  -1.156
  368   1HB   ASP  50          HB2       ASP  50 -27.178  28.467  -2.827
  369   2HB   ASP  50          HB3       ASP  50 -28.689  27.642  -2.410
  370    H    GLY  51           H        GLY  51 -27.935  24.352  -1.529
  371   1HA   GLY  51          HA2       GLY  51 -27.921  23.753   1.255
  372   2HA   GLY  51          HA3       GLY  51 -29.510  24.385   0.842
  373    H    GLU  52           H        GLU  52 -29.549  23.132  -1.872
  374    HA   GLU  52           HA       GLU  52 -30.284  20.423  -0.990
  375   1HB   GLU  52          HB2       GLU  52 -31.564  20.228  -2.999
  376   2HB   GLU  52          HB3       GLU  52 -31.960  21.721  -2.138
  377   1HG   GLU  52          HG2       GLU  52 -30.588  22.995  -3.760
  378   2HG   GLU  52          HG3       GLU  52 -30.222  21.505  -4.623
  379    HA   PRO  53           HA       PRO  53 -26.716  18.633  -2.633
  380   1HB   PRO  53          HB2       PRO  53 -28.038  16.037  -3.232
  381   2HB   PRO  53          HB3       PRO  53 -26.785  16.399  -2.046
  382   1HG   PRO  53          HG2       PRO  53 -29.349  15.915  -1.300
  383   2HG   PRO  53          HG3       PRO  53 -28.340  17.128  -0.438
  384   1HD   PRO  53          HD2       PRO  53 -30.409  17.593  -2.612
  385   2HD   PRO  53          HD3       PRO  53 -30.206  18.429  -1.055
  386    H    ILE  54           H        ILE  54 -25.536  18.609  -4.364
  387    HA   ILE  54           HA       ILE  54 -26.612  17.992  -7.072
  388    HB   ILE  54           HB       ILE  54 -23.957  19.296  -6.358
  389   1HG1  ILE  54          2HG1      ILE  54 -26.383  20.909  -7.300
  390   2HG1  ILE  54          3HG1      ILE  54 -26.066  20.702  -5.589
  391   1HG2  ILE  54          1HG2      ILE  54 -24.147  18.410  -8.718
  392   2HG2  ILE  54          2HG2      ILE  54 -25.573  19.448  -8.962
  393   3HG2  ILE  54          3HG2      ILE  54 -23.979  20.159  -8.684
  394   1HD1  ILE  54          1HD1      ILE  54 -23.846  21.667  -5.808
  395   2HD1  ILE  54          2HD1      ILE  54 -24.087  21.933  -7.541
  396   3HD1  ILE  54          3HD1      ILE  54 -25.066  22.810  -6.376
  397    H    GLU  55           H        GLU  55 -26.335  15.950  -5.279
  398    HA   GLU  55           HA       GLU  55 -23.928  14.687  -4.865
  399   1HB   GLU  55          HB2       GLU  55 -25.297  12.575  -4.719
  400   2HB   GLU  55          HB3       GLU  55 -25.692  13.925  -3.629
  401   1HG   GLU  55          HG2       GLU  55 -27.630  14.459  -5.199
  402   2HG   GLU  55          HG3       GLU  55 -27.266  12.962  -6.050
  403    H    GLN  56           H        GLN  56 -22.395  14.163  -6.182
  404    HA   GLN  56           HA       GLN  56 -22.673  13.551  -8.911
  405   1HB   GLN  56          HB2       GLN  56 -20.378  12.860  -7.049
  406   2HB   GLN  56          HB3       GLN  56 -20.256  13.004  -8.796
  407   1HG   GLN  56          HG2       GLN  56 -20.888  15.344  -6.900
  408   2HG   GLN  56          HG3       GLN  56 -19.342  14.987  -7.624
  409   1HE2  GLN  56          1HE2      GLN  56 -22.093  16.897  -9.908
  410   2HE2  GLN  56          2HE2      GLN  56 -22.508  16.384  -8.271
  411    H    GLU  57           H        GLU  57 -23.675  11.605  -6.505
  412    HA   GLU  57           HA       GLU  57 -22.950   9.001  -7.698
  413   1HB   GLU  57          HB2       GLU  57 -24.289   9.790  -5.097
  414   2HB   GLU  57          HB3       GLU  57 -23.986   8.117  -5.582
  415   1HG   GLU  57          HG2       GLU  57 -21.799  10.194  -5.126
  416   2HG   GLU  57          HG3       GLU  57 -22.325   9.036  -3.932
  417    H    ASP  58           H        ASP  58 -25.517  11.181  -7.921
  418    HA   ASP  58           HA       ASP  58 -27.278   9.191  -9.246
  419   1HB   ASP  58          HB2       ASP  58 -27.677   8.792  -6.783
  420   2HB   ASP  58          HB3       ASP  58 -28.141  10.471  -6.612
  421    H    ASN  59           H        ASN  59 -26.698  12.538  -8.299
  422    HA   ASN  59           HA       ASN  59 -29.149  13.397  -9.763
  423   1HB   ASN  59          HB2       ASN  59 -28.392  14.356  -7.497
  424   2HB   ASN  59          HB3       ASN  59 -27.176  15.240  -8.387
  425   1HD2  ASN  59          1HD2      ASN  59 -30.141  17.458  -8.076
  426   2HD2  ASN  59          2HD2      ASN  59 -28.936  16.799  -7.008
  427    H    GLU  60           H        GLU  60 -29.248  14.642 -11.524
  428    HA   GLU  60           HA       GLU  60 -26.881  15.162 -13.272
  429   1HB   GLU  60          HB2       GLU  60 -29.151  13.240 -13.905
  430   2HB   GLU  60          HB3       GLU  60 -27.985  13.816 -15.096
  431   1HG   GLU  60          HG2       GLU  60 -26.148  12.726 -13.780
  432   2HG   GLU  60          HG3       GLU  60 -27.362  12.051 -12.697
  433    H    GLU  61           H        GLU  61 -29.583  16.436 -12.041
  434    HA   GLU  61           HA       GLU  61 -31.613  17.106 -13.368
  435   1HB   GLU  61          HB2       GLU  61 -30.528  18.188 -11.302
  436   2HB   GLU  61          HB3       GLU  61 -29.982  19.476 -12.377
  437   1HG   GLU  61          HG2       GLU  61 -32.867  18.541 -12.140
  438   2HG   GLU  61          HG3       GLU  61 -32.181  19.701 -11.028
  439    H    LYS  62           H        LYS  62 -28.732  18.879 -14.365
  440    HA   LYS  62           HA       LYS  62 -29.399  18.715 -17.161
  441   1HB   LYS  62          HB2       LYS  62 -29.439  21.141 -17.707
  442   2HB   LYS  62          HB3       LYS  62 -30.814  20.624 -16.756
  443   1HG   LYS  62          HG2       LYS  62 -29.627  21.501 -14.682
  444   2HG   LYS  62          HG3       LYS  62 -28.428  22.193 -15.762
  445   1HD   LYS  62          HD2       LYS  62 -30.175  23.478 -16.943
  446   2HD   LYS  62          HD3       LYS  62 -31.398  22.841 -15.833
  447   1HE   LYS  62          HE2       LYS  62 -28.909  24.255 -14.832
  448   2HE   LYS  62          HE3       LYS  62 -30.327  25.198 -15.323
  449   1HZ   LYS  62          HZ1       LYS  62 -30.025  24.419 -12.862
  450   2HZ   LYS  62          HZ2       LYS  62 -31.534  24.368 -13.544
  451   3HZ   LYS  62          HZ3       LYS  62 -30.650  22.987 -13.370
  452    H    TYR  63           H        TYR  63 -27.396  17.557 -15.862
  453    HA   TYR  63           HA       TYR  63 -25.000  18.848 -16.993
  454   1HB   TYR  63          HB2       TYR  63 -23.909  18.839 -14.674
  455   2HB   TYR  63          HB3       TYR  63 -24.959  20.153 -15.089
  456    HD1  TYR  63           HD1      TYR  63 -25.013  16.901 -13.201
  457    HD2  TYR  63           HD2      TYR  63 -26.618  20.874 -13.685
  458    HE1  TYR  63           HE1      TYR  63 -26.259  16.675 -11.046
  459    HE2  TYR  63           HE2      TYR  63 -27.886  20.625 -11.564
  460    HH   TYR  63           HH       TYR  63 -28.340  19.273  -9.749
  461    H    SER  64           H        SER  64 -23.006  17.814 -16.655
  462    HA   SER  64           HA       SER  64 -22.992  14.857 -16.238
  463   1HB   SER  64          HB2       SER  64 -22.220  16.285 -18.814
  464   2HB   SER  64          HB3       SER  64 -21.856  14.583 -18.433
  465    HG   SER  64           HG       SER  64 -23.732  14.774 -19.706
  466    H    PHE  65           H        PHE  65 -21.065  14.220 -15.372
  467    HA   PHE  65           HA       PHE  65 -18.699  16.009 -15.433
  468   1HB   PHE  65          HB2       PHE  65 -18.802  15.680 -12.946
  469   2HB   PHE  65          HB3       PHE  65 -20.207  16.467 -13.675
  470    HD1  PHE  65           HD1      PHE  65 -22.392  15.736 -13.336
  471    HD2  PHE  65           HD2      PHE  65 -19.098  13.152 -12.290
  472    HE1  PHE  65           HE1      PHE  65 -23.976  14.082 -12.392
  473    HE2  PHE  65           HE2      PHE  65 -20.674  11.510 -11.326
  474    HZ   PHE  65           HZ       PHE  65 -23.127  11.950 -11.425
  475    H    ASN  66           H        ASN  66 -16.892  15.109 -14.072
  476    HA   ASN  66           HA       ASN  66 -15.966  12.691 -15.416
  477   1HB   ASN  66          HB2       ASN  66 -13.792  13.513 -14.963
  478   2HB   ASN  66          HB3       ASN  66 -14.765  14.882 -15.453
  479   1HD2  ASN  66          1HD2      ASN  66 -13.002  16.303 -12.659
  480   2HD2  ASN  66          2HD2      ASN  66 -12.853  16.073 -14.392
  481    H    TYR  67           H        TYR  67 -14.121  11.512 -14.022
  482    HA   TYR  67           HA       TYR  67 -15.580  10.061 -11.975
  483   1HB   TYR  67          HB2       TYR  67 -13.710   8.541 -12.028
  484   2HB   TYR  67          HB3       TYR  67 -14.362   8.836 -13.632
  485    HD1  TYR  67           HD1      TYR  67 -12.996   9.777 -15.398
  486    HD2  TYR  67           HD2      TYR  67 -11.479   9.613 -11.354
  487    HE1  TYR  67           HE1      TYR  67 -10.704  10.311 -16.221
  488    HE2  TYR  67           HE2      TYR  67  -9.209  10.163 -12.181
  489    HH   TYR  67           HH       TYR  67  -7.911  10.624 -14.004
  490    H    ASP  68           H        ASP  68 -13.416  12.730 -11.727
  491    HA   ASP  68           HA       ASP  68 -12.494  12.198  -8.945
  492   1HB   ASP  68          HB2       ASP  68 -12.395  14.661 -10.705
  493   2HB   ASP  68          HB3       ASP  68 -11.702  14.515  -9.099
  494    H    GLY  69           H        GLY  69 -15.342  13.361 -10.503
  495   1HA   GLY  69          HA2       GLY  69 -17.395  14.095  -9.638
  496   2HA   GLY  69          HA3       GLY  69 -16.713  14.128  -8.010
  497    H    SER  70           H        SER  70 -14.913  15.794 -10.498
  498    HA   SER  70           HA       SER  70 -15.429  18.322  -9.068
  499   1HB   SER  70          HB2       SER  70 -13.267  19.029  -9.874
  500   2HB   SER  70          HB3       SER  70 -13.168  17.502  -8.985
  501    HG   SER  70           HG       SER  70 -11.935  17.272 -10.832
  502    H    GLU  71           H        GLU  71 -14.657  17.491 -12.487
  503    HA   GLU  71           HA       GLU  71 -15.552  20.081 -13.381
  504   1HB   GLU  71          HB2       GLU  71 -14.844  17.621 -14.972
  505   2HB   GLU  71          HB3       GLU  71 -15.139  19.230 -15.664
  506   1HG   GLU  71          HG2       GLU  71 -13.242  20.178 -14.497
  507   2HG   GLU  71          HG3       GLU  71 -12.980  18.677 -13.596
  508    H    LEU  72           H        LEU  72 -17.657  20.401 -12.756
  509    HA   LEU  72           HA       LEU  72 -19.800  18.705 -13.827
  510   1HB   LEU  72          HB2       LEU  72 -19.828  19.605 -11.506
  511   2HB   LEU  72          HB3       LEU  72 -19.948  21.244 -12.172
  512    HG   LEU  72           HG       LEU  72 -22.091  20.524 -13.307
  513   1HD1  LEU  72          1HD1      LEU  72 -21.896  18.121 -13.381
  514   2HD1  LEU  72          2HD1      LEU  72 -21.597  18.031 -11.627
  515   3HD1  LEU  72          3HD1      LEU  72 -23.196  18.466 -12.226
  516   1HD2  LEU  72          1HD2      LEU  72 -22.088  21.795 -11.220
  517   2HD2  LEU  72          2HD2      LEU  72 -23.445  20.636 -11.242
  518   3HD2  LEU  72          3HD2      LEU  72 -21.983  20.296 -10.288
  519    H    ILE  73           H        ILE  73 -20.014  18.915 -15.938
  520    HA   ILE  73           HA       ILE  73 -20.072  21.586 -17.240
  521    HB   ILE  73           HB       ILE  73 -20.555  18.899 -18.530
  522   1HG1  ILE  73          2HG1      ILE  73 -17.930  20.355 -18.880
  523   2HG1  ILE  73          3HG1      ILE  73 -18.134  19.343 -17.458
  524   1HG2  ILE  73          1HG2      ILE  73 -21.451  20.925 -19.722
  525   2HG2  ILE  73          2HG2      ILE  73 -19.895  21.703 -19.606
  526   3HG2  ILE  73          3HG2      ILE  73 -20.071  20.249 -20.607
  527   1HD1  ILE  73          1HD1      ILE  73 -18.655  17.402 -18.777
  528   2HD1  ILE  73          2HD1      ILE  73 -18.571  18.376 -20.302
  529   3HD1  ILE  73          3HD1      ILE  73 -17.114  18.107 -19.319
  530    H    ILE  74           H        ILE  74 -21.845  22.641 -17.209
  531    HA   ILE  74           HA       ILE  74 -24.488  21.336 -16.743
  532    HB   ILE  74           HB       ILE  74 -23.811  24.276 -16.410
  533   1HG1  ILE  74          2HG1      ILE  74 -23.729  22.165 -14.182
  534   2HG1  ILE  74          3HG1      ILE  74 -22.326  23.002 -14.870
  535   1HG2  ILE  74          1HG2      ILE  74 -25.857  24.288 -14.991
  536   2HG2  ILE  74          2HG2      ILE  74 -26.178  23.768 -16.642
  537   3HG2  ILE  74          3HG2      ILE  74 -26.085  22.578 -15.325
  538   1HD1  ILE  74          1HD1      ILE  74 -24.519  24.283 -13.224
  539   2HD1  ILE  74          2HD1      ILE  74 -22.809  24.063 -12.818
  540   3HD1  ILE  74          3HD1      ILE  74 -23.263  25.199 -14.097
  541    H    LYS  75           H        LYS  75 -26.139  21.719 -18.078
  542    HA   LYS  75           HA       LYS  75 -25.681  23.443 -20.479
  543   1HB   LYS  75          HB2       LYS  75 -27.194  21.908 -21.748
  544   2HB   LYS  75          HB3       LYS  75 -25.617  21.262 -21.345
  545   1HG   LYS  75          HG2       LYS  75 -26.575  19.894 -19.570
  546   2HG   LYS  75          HG3       LYS  75 -28.177  20.626 -19.808
  547   1HD   LYS  75          HD2       LYS  75 -28.286  19.743 -22.100
  548   2HD   LYS  75          HD3       LYS  75 -26.691  19.018 -21.961
  549   1HE   LYS  75          HE2       LYS  75 -29.036  18.304 -20.098
  550   2HE   LYS  75          HE3       LYS  75 -28.720  17.484 -21.644
  551   1HZ   LYS  75          HZ1       LYS  75 -26.546  16.831 -20.814
  552   2HZ   LYS  75          HZ2       LYS  75 -26.791  17.604 -19.395
  553   3HZ   LYS  75          HZ3       LYS  75 -27.721  16.302 -19.789
  554    H    LYS  76           H        LYS  76 -27.431  24.447 -21.321
  555    HA   LYS  76           HA       LYS  76 -29.100  25.950 -21.258
  556   1HB   LYS  76          HB2       LYS  76 -31.344  25.106 -21.048
  557   2HB   LYS  76          HB3       LYS  76 -30.333  24.044 -21.988
  558   1HG   LYS  76          HG2       LYS  76 -30.143  22.433 -20.159
  559   2HG   LYS  76          HG3       LYS  76 -31.038  23.532 -19.078
  560   1HD   LYS  76          HD2       LYS  76 -33.028  23.368 -20.547
  561   2HD   LYS  76          HD3       LYS  76 -32.130  22.255 -21.609
  562   1HE   LYS  76          HE2       LYS  76 -31.892  20.661 -19.723
  563   2HE   LYS  76          HE3       LYS  76 -32.699  21.794 -18.636
  564   1HZ   LYS  76          HZ1       LYS  76 -34.722  21.561 -20.007
  565   2HZ   LYS  76          HZ2       LYS  76 -33.942  20.588 -21.065
  566   3HZ   LYS  76          HZ3       LYS  76 -34.231  20.080 -19.535
  567    H    VAL  77           H        VAL  77 -27.513  26.578 -19.348
  568    HA   VAL  77           HA       VAL  77 -28.540  27.008 -16.710
  569    HB   VAL  77           HB       VAL  77 -26.616  28.662 -18.390
  570   1HG1  VAL  77          1HG1      VAL  77 -25.760  29.517 -16.205
  571   2HG1  VAL  77          2HG1      VAL  77 -27.390  30.103 -16.563
  572   3HG1  VAL  77          3HG1      VAL  77 -27.167  28.783 -15.398
  573   1HG2  VAL  77          1HG2      VAL  77 -26.152  26.535 -16.229
  574   2HG2  VAL  77          2HG2      VAL  77 -25.838  26.348 -17.984
  575   3HG2  VAL  77          3HG2      VAL  77 -24.881  27.472 -17.017
  576    H    ASP  78           H        ASP  78 -29.715  28.664 -15.785
  577    HA   ASP  78           HA       ASP  78 -30.532  31.020 -17.262
  578   1HB   ASP  78          HB2       ASP  78 -32.176  28.964 -17.814
  579   2HB   ASP  78          HB3       ASP  78 -32.903  29.439 -16.296
  580    H    LYS  79           H        LYS  79 -32.397  32.120 -15.780
  581    HA   LYS  79           HA       LYS  79 -31.093  33.333 -13.666
  582   1HB   LYS  79          HB2       LYS  79 -34.081  32.946 -14.042
  583   2HB   LYS  79          HB3       LYS  79 -33.376  34.175 -13.003
  584   1HG   LYS  79          HG2       LYS  79 -32.328  35.274 -14.915
  585   2HG   LYS  79          HG3       LYS  79 -32.898  34.044 -16.029
  586   1HD   LYS  79          HD2       LYS  79 -34.668  35.902 -14.407
  587   2HD   LYS  79          HD3       LYS  79 -34.255  36.109 -16.098
  588   1HE   LYS  79          HE2       LYS  79 -35.863  33.768 -14.955
  589   2HE   LYS  79          HE3       LYS  79 -36.539  35.154 -15.777
  590   1HZ   LYS  79          HZ1       LYS  79 -34.743  33.105 -16.995
  591   2HZ   LYS  79          HZ2       LYS  79 -36.332  33.315 -17.288
  592   3HZ   LYS  79          HZ3       LYS  79 -35.275  34.439 -17.799
  593    H    SER  80           H        SER  80 -33.105  30.431 -13.379
  594    HA   SER  80           HA       SER  80 -33.177  30.485 -10.480
  595   1HB   SER  80          HB2       SER  80 -34.389  28.330 -10.789
  596   2HB   SER  80          HB3       SER  80 -35.104  29.695 -11.656
  597    HG   SER  80           HG       SER  80 -34.969  27.805 -12.968
  598    H    ASP  81           H        ASP  81 -30.793  29.485 -12.677
  599    HA   ASP  81           HA       ASP  81 -29.898  27.187 -11.103
  600   1HB   ASP  81          HB2       ASP  81 -29.824  27.422 -13.658
  601   2HB   ASP  81          HB3       ASP  81 -28.452  28.487 -13.412
  602    H    GLU  82           H        GLU  82 -29.534  30.486 -10.662
  603    HA   GLU  82           HA       GLU  82 -26.903  31.004  -9.818
  604   1HB   GLU  82          HB2       GLU  82 -28.786  32.622  -9.918
  605   2HB   GLU  82          HB3       GLU  82 -29.549  31.802  -8.537
  606   1HG   GLU  82          HG2       GLU  82 -27.495  32.403  -7.176
  607   2HG   GLU  82          HG3       GLU  82 -26.869  33.257  -8.606
  608    H    ALA  83           H        ALA  83 -25.658  30.472  -8.015
  609    HA   ALA  83           HA       ALA  83 -26.780  28.783  -5.819
  610   1HB   ALA  83          HB1       ALA  83 -25.501  26.820  -6.422
  611   2HB   ALA  83          HB2       ALA  83 -26.534  27.270  -7.804
  612   3HB   ALA  83          HB3       ALA  83 -24.802  27.618  -7.819
  613    H    GLU  84           H        GLU  84 -25.287  28.099  -4.280
  614    HA   GLU  84           HA       GLU  84 -22.595  29.362  -4.274
  615   1HB   GLU  84          HB2       GLU  84 -24.171  30.635  -2.779
  616   2HB   GLU  84          HB3       GLU  84 -24.379  29.181  -1.809
  617   1HG   GLU  84          HG2       GLU  84 -21.986  29.130  -1.264
  618   2HG   GLU  84          HG3       GLU  84 -21.650  30.424  -2.373
  619    H    TYR  85           H        TYR  85 -21.394  27.673  -4.677
  620    HA   TYR  85           HA       TYR  85 -22.289  24.944  -4.097
  621   1HB   TYR  85          HB2       TYR  85 -19.915  25.997  -5.602
  622   2HB   TYR  85          HB3       TYR  85 -20.362  24.313  -5.491
  623    HD1  TYR  85           HD1      TYR  85 -20.376  27.028  -7.623
  624    HD2  TYR  85           HD2      TYR  85 -22.947  23.907  -6.207
  625    HE1  TYR  85           HE1      TYR  85 -21.623  27.076  -9.773
  626    HE2  TYR  85           HE2      TYR  85 -24.211  23.924  -8.399
  627    HH   TYR  85           HH       TYR  85 -24.387  24.881 -10.462
  628    H    ILE  86           H        ILE  86 -22.090  24.796  -1.831
  629    HA   ILE  86           HA       ILE  86 -19.345  24.847  -0.676
  630    HB   ILE  86           HB       ILE  86 -21.999  23.944   0.484
  631   1HG1  ILE  86          2HG1      ILE  86 -21.459  25.771   2.168
  632   2HG1  ILE  86          3HG1      ILE  86 -20.154  26.281   1.115
  633   1HG2  ILE  86          1HG2      ILE  86 -20.698  23.654   2.617
  634   2HG2  ILE  86          2HG2      ILE  86 -20.254  22.479   1.381
  635   3HG2  ILE  86          3HG2      ILE  86 -19.197  23.871   1.682
  636   1HD1  ILE  86          1HD1      ILE  86 -22.242  27.613   0.990
  637   2HD1  ILE  86          2HD1      ILE  86 -21.729  26.984  -0.575
  638   3HD1  ILE  86          3HD1      ILE  86 -23.097  26.213   0.320
  639    H    CYS  87           H        CYS  87 -17.980  23.214  -0.921
  640    HA   CYS  87           HA       CYS  87 -19.006  20.555  -1.740
  641   1HB   CYS  87          HB2       CYS  87 -17.149  20.426  -3.383
  642   2HB   CYS  87          HB3       CYS  87 -18.306  21.701  -3.738
  643    H    ILE  88           H        ILE  88 -18.169  18.837  -0.901
  644    HA   ILE  88           HA       ILE  88 -16.071  19.095   1.197
  645    HB   ILE  88           HB       ILE  88 -18.809  17.743   1.423
  646   1HG1  ILE  88          2HG1      ILE  88 -17.770  20.312   2.752
  647   2HG1  ILE  88          3HG1      ILE  88 -18.986  20.216   1.494
  648   1HG2  ILE  88          1HG2      ILE  88 -17.118  16.555   2.733
  649   2HG2  ILE  88          2HG2      ILE  88 -16.557  18.075   3.456
  650   3HG2  ILE  88          3HG2      ILE  88 -18.159  17.409   3.840
  651   1HD1  ILE  88          1HD1      ILE  88 -20.455  18.923   3.020
  652   2HD1  ILE  88          2HD1      ILE  88 -19.300  19.233   4.331
  653   3HD1  ILE  88          3HD1      ILE  88 -20.133  20.580   3.559
  654    H    ALA  89           H        ALA  89 -14.777  17.342   1.514
  655    HA   ALA  89           HA       ALA  89 -15.321  14.799   0.093
  656   1HB   ALA  89          HB1       ALA  89 -13.817  16.122  -1.329
  657   2HB   ALA  89          HB2       ALA  89 -12.700  16.320   0.042
  658   3HB   ALA  89          HB3       ALA  89 -13.014  14.721  -0.668
  659    H    GLU  90           H        GLU  90 -14.557  12.970   1.077
  660    HA   GLU  90           HA       GLU  90 -13.130  13.122   3.680
  661   1HB   GLU  90          HB2       GLU  90 -15.572  13.387   4.151
  662   2HB   GLU  90          HB3       GLU  90 -15.880  11.895   3.241
  663   1HG   GLU  90          HG2       GLU  90 -14.506  10.613   4.908
  664   2HG   GLU  90          HG3       GLU  90 -14.152  12.128   5.755
  665    H    ASN  91           H        ASN  91 -11.980  11.262   4.175
  666    HA   ASN  91           HA       ASN  91 -12.661   8.744   2.915
  667   1HB   ASN  91          HB2       ASN  91 -10.695   8.176   1.797
  668   2HB   ASN  91          HB3       ASN  91 -11.168   9.733   1.198
  669   1HD2  ASN  91          1HD2      ASN  91  -7.567  10.020   1.474
  670   2HD2  ASN  91          2HD2      ASN  91  -8.797   9.331   0.414
  671    H    LYS  92           H        LYS  92 -10.675   7.054   3.863
  672    HA   LYS  92           HA       LYS  92 -11.097   7.130   6.665
  673   1HB   LYS  92          HB2       LYS  92  -9.622   5.246   6.809
  674   2HB   LYS  92          HB3       LYS  92 -10.817   5.014   5.564
  675   1HG   LYS  92          HG2       LYS  92  -7.899   5.874   5.054
  676   2HG   LYS  92          HG3       LYS  92  -8.412   4.203   5.160
  677   1HD   LYS  92          HD2       LYS  92  -9.181   6.194   3.021
  678   2HD   LYS  92          HD3       LYS  92  -8.143   4.783   2.888
  679   1HE   LYS  92          HE2       LYS  92 -11.156   4.703   3.447
  680   2HE   LYS  92          HE3       LYS  92 -10.388   4.434   1.880
  681   1HZ   LYS  92          HZ1       LYS  92  -9.284   2.512   2.784
  682   2HZ   LYS  92          HZ2       LYS  92  -9.924   2.750   4.275
  683   3HZ   LYS  92          HZ3       LYS  92 -10.893   2.367   3.023
  684    H    ALA  93           H        ALA  93  -8.606   8.601   4.900
  685    HA   ALA  93           HA       ALA  93  -6.770   8.935   7.211
  686   1HB   ALA  93          HB1       ALA  93  -5.256   9.947   5.561
  687   2HB   ALA  93          HB2       ALA  93  -5.805   8.337   5.074
  688   3HB   ALA  93          HB3       ALA  93  -6.503   9.799   4.301
  689    H    GLY  94           H        GLY  94  -9.327  10.825   5.675
  690   1HA   GLY  94          HA2       GLY  94  -9.285  12.798   7.705
  691   2HA   GLY  94          HA3       GLY  94  -8.328  13.418   6.385
  692    H    GLU  95           H        GLU  95  -9.849  15.126   6.431
  693    HA   GLU  95           HA       GLU  95 -12.195  14.819   4.669
  694   1HB   GLU  95          HB2       GLU  95 -12.991  14.374   7.013
  695   2HB   GLU  95          HB3       GLU  95 -12.396  15.968   7.475
  696   1HG   GLU  95          HG2       GLU  95 -14.023  17.000   5.851
  697   2HG   GLU  95          HG3       GLU  95 -14.623  15.396   5.470
  698    H    GLN  96           H        GLN  96 -12.856  16.791   3.700
  699    HA   GLN  96           HA       GLN  96 -11.285  19.250   4.191
  700   1HB   GLN  96          HB2       GLN  96 -10.027  17.383   2.731
  701   2HB   GLN  96          HB3       GLN  96 -11.077  17.953   1.450
  702   1HG   GLN  96          HG2       GLN  96  -9.043  19.132   1.227
  703   2HG   GLN  96          HG3       GLN  96 -10.125  20.300   1.935
  704   1HE2  GLN  96          1HE2      GLN  96  -7.076  18.684   4.253
  705   2HE2  GLN  96          2HE2      GLN  96  -7.659  17.825   2.809
  706    H    ASP  97           H        ASP  97 -11.938  21.073   2.719
  707    HA   ASP  97           HA       ASP  97 -14.420  20.786   1.221
  708   1HB   ASP  97          HB2       ASP  97 -15.778  22.248   2.569
  709   2HB   ASP  97          HB3       ASP  97 -15.266  20.861   3.551
  710    H    ALA  98           H        ALA  98 -15.039  22.604   0.008
  711    HA   ALA  98           HA       ALA  98 -13.569  25.139   0.220
  712   1HB   ALA  98          HB1       ALA  98 -13.660  23.538  -2.404
  713   2HB   ALA  98          HB2       ALA  98 -13.049  25.173  -2.233
  714   3HB   ALA  98          HB3       ALA  98 -12.217  23.867  -1.407
  715    H    THR  99           H        THR  99 -14.592  26.761  -1.509
  716    HA   THR  99           HA       THR  99 -17.546  26.395  -1.766
  717    HB   THR  99           HB       THR  99 -16.184  28.790  -0.505
  718    HG1  THR  99           HG1      THR  99 -17.027  28.067   1.427
  719   1HG2  THR  99          1HG2      THR  99 -19.121  27.985  -0.875
  720   2HG2  THR  99          2HG2      THR  99 -18.592  29.279   0.231
  721   3HG2  THR  99          3HG2      THR  99 -18.299  29.437  -1.511
  722    H    ILE 100           H        ILE 100 -18.439  27.439  -3.516
  723    HA   ILE 100           HA       ILE 100 -16.899  29.503  -5.050
  724    HB   ILE 100           HB       ILE 100 -18.223  27.042  -6.210
  725   1HG1  ILE 100          2HG1      ILE 100 -15.322  27.901  -6.291
  726   2HG1  ILE 100          3HG1      ILE 100 -15.967  26.620  -5.297
  727   1HG2  ILE 100          1HG2      ILE 100 -18.740  28.911  -7.694
  728   2HG2  ILE 100          2HG2      ILE 100 -17.019  29.395  -7.698
  729   3HG2  ILE 100          3HG2      ILE 100 -17.529  27.869  -8.428
  730   1HD1  ILE 100          1HD1      ILE 100 -14.995  25.519  -7.085
  731   2HD1  ILE 100          2HD1      ILE 100 -16.743  25.423  -7.398
  732   3HD1  ILE 100          3HD1      ILE 100 -15.712  26.562  -8.307
  733    H    HIS 101           H        HIS 101 -18.220  31.058  -6.068
  734    HA   HIS 101           HA       HIS 101 -21.194  30.928  -5.552
  735   1HB   HIS 101          HB2       HIS 101 -19.495  33.353  -6.196
  736   2HB   HIS 101          HB3       HIS 101 -21.167  33.326  -5.670
  737    HD1  HIS 101           HD1      HIS 101 -21.575  32.886  -2.960
  738    HD2  HIS 101           HD2      HIS 101 -17.579  33.047  -4.297
  739    HE1  HIS 101           HE1      HIS 101 -20.118  33.066  -0.888
  740    H    LEU 102           H        LEU 102 -22.611  31.025  -7.290
  741    HA   LEU 102           HA       LEU 102 -21.462  31.563  -9.979
  742   1HB   LEU 102          HB2       LEU 102 -22.010  29.286  -9.899
  743   2HB   LEU 102          HB3       LEU 102 -23.590  29.579  -9.137
  744    HG   LEU 102           HG       LEU 102 -24.369  30.688 -11.218
  745   1HD1  LEU 102          1HD1      LEU 102 -22.193  31.442 -12.162
  746   2HD1  LEU 102          2HD1      LEU 102 -21.735  29.758 -12.428
  747   3HD1  LEU 102          3HD1      LEU 102 -23.093  30.451 -13.319
  748   1HD2  LEU 102          1HD2      LEU 102 -24.748  28.256 -10.857
  749   2HD2  LEU 102          2HD2      LEU 102 -24.630  28.672 -12.563
  750   3HD2  LEU 102          3HD2      LEU 102 -23.238  27.926 -11.734
  751    H    LYS 103           H        LYS 103 -21.927  33.526 -10.435
  752    HA   LYS 103           HA       LYS 103 -24.512  34.840  -9.742
  753   1HB   LYS 103          HB2       LYS 103 -21.953  35.997 -10.915
  754   2HB   LYS 103          HB3       LYS 103 -23.375  36.892 -10.376
  755   1HG   LYS 103          HG2       LYS 103 -21.471  35.242  -8.645
  756   2HG   LYS 103          HG3       LYS 103 -21.538  36.984  -8.735
  757   1HD   LYS 103          HD2       LYS 103 -23.928  36.880  -7.860
  758   2HD   LYS 103          HD3       LYS 103 -23.684  35.133  -7.626
  759   1HE   LYS 103          HE2       LYS 103 -21.760  35.557  -6.118
  760   2HE   LYS 103          HE3       LYS 103 -21.978  37.310  -6.373
  761   1HZ   LYS 103          HZ1       LYS 103 -23.053  36.589  -4.328
  762   2HZ   LYS 103          HZ2       LYS 103 -24.175  37.116  -5.366
  763   3HZ   LYS 103          HZ3       LYS 103 -23.990  35.507  -5.112
  764    H    VAL 104           H        VAL 104 -25.882  33.777 -11.154
  765    HA   VAL 104           HA       VAL 104 -25.554  34.063 -14.073
  766    HB   VAL 104           HB       VAL 104 -28.028  33.181 -12.532
  767   1HG1  VAL 104          1HG1      VAL 104 -28.593  32.099 -14.719
  768   2HG1  VAL 104          2HG1      VAL 104 -28.515  33.857 -14.831
  769   3HG1  VAL 104          3HG1      VAL 104 -27.155  32.857 -15.445
  770   1HG2  VAL 104          1HG2      VAL 104 -26.223  31.580 -12.028
  771   2HG2  VAL 104          2HG2      VAL 104 -27.344  30.858 -13.168
  772   3HG2  VAL 104          3HG2      VAL 104 -25.784  31.476 -13.743
  773    H    PHE 105           H        PHE 105 -26.208  35.797 -15.299
  774    HA   PHE 105           HA       PHE 105 -28.021  37.797 -14.101
  775   1HB   PHE 105          HB2       PHE 105 -26.704  39.406 -15.316
  776   2HB   PHE 105          HB3       PHE 105 -25.738  38.531 -14.144
  777    HD1  PHE 105           HD1      PHE 105 -23.925  37.043 -14.891
  778    HD2  PHE 105           HD2      PHE 105 -26.276  39.256 -17.743
  779    HE1  PHE 105           HE1      PHE 105 -22.200  36.651 -16.647
  780    HE2  PHE 105           HE2      PHE 105 -24.554  38.870 -19.479
  781    HZ   PHE 105           HZ       PHE 105 -22.535  37.546 -18.945
  782    H    ALA 106           H        ALA 106 -29.335  38.991 -15.482
  783    HA   ALA 106           HA       ALA 106 -30.326  37.487 -17.836
  784   1HB   ALA 106          HB1       ALA 106 -31.746  39.375 -15.892
  785   2HB   ALA 106          HB2       ALA 106 -32.516  38.491 -17.237
  786   3HB   ALA 106          HB3       ALA 106 -31.790  37.598 -15.877
  787    H    LYS 107           H        LYS 107 -28.190  39.058 -18.382
  788    HA   LYS 107           HA       LYS 107 -27.254  40.768 -19.539
  789   1HB   LYS 107          HB2       LYS 107 -29.878  40.815 -21.075
  790   2HB   LYS 107          HB3       LYS 107 -28.343  41.504 -21.580
  791   1HG   LYS 107          HG2       LYS 107 -27.343  39.202 -21.463
  792   2HG   LYS 107          HG3       LYS 107 -28.975  38.574 -21.243
  793   1HD   LYS 107          HD2       LYS 107 -27.865  40.163 -23.601
  794   2HD   LYS 107          HD3       LYS 107 -28.282  38.424 -23.600
  795   1HE   LYS 107          HE2       LYS 107 -30.259  40.717 -23.306
  796   2HE   LYS 107          HE3       LYS 107 -29.926  39.834 -24.777
  797   1HZ   LYS 107          HZ1       LYS 107 -31.076  38.659 -22.297
  798   2HZ   LYS 107          HZ2       LYS 107 -31.905  38.964 -23.651
  799   3HZ   LYS 107          HZ3       LYS 107 -30.737  37.815 -23.662
  Start of MODEL   15
    1   1H    GLY   1          H1        GLY   1  -5.483   2.094   6.782
    2   2H    GLY   1          H2        GLY   1  -3.887   1.715   6.732
    3   3H    GLY   1          H3        GLY   1  -4.384   3.236   6.379
    4   1HA   GLY   1          HA2       GLY   1  -5.027   0.823   4.810
    5   2HA   GLY   1          HA3       GLY   1  -5.463   2.492   4.362
    6    H    LYS   2           H        LYS   2  -3.918   0.614   2.822
    7    HA   LYS   2           HA       LYS   2  -1.169   1.812   2.734
    8   1HB   LYS   2          HB2       LYS   2  -0.382  -0.216   1.779
    9   2HB   LYS   2          HB3       LYS   2  -1.383  -0.672   3.181
   10   1HG   LYS   2          HG2       LYS   2  -3.280  -1.175   1.561
   11   2HG   LYS   2          HG3       LYS   2  -2.170  -0.842   0.222
   12   1HD   LYS   2          HD2       LYS   2  -0.648  -2.608   1.046
   13   2HD   LYS   2          HD3       LYS   2  -1.814  -2.972   2.370
   14   1HE   LYS   2          HE2       LYS   2  -3.555  -3.460   0.653
   15   2HE   LYS   2          HE3       LYS   2  -2.386  -3.162  -0.631
   16   1HZ   LYS   2          HZ1       LYS   2  -2.120  -5.275   1.404
   17   2HZ   LYS   2          HZ2       LYS   2  -2.563  -5.498  -0.154
   18   3HZ   LYS   2          HZ3       LYS   2  -1.049  -4.989   0.187
   19    H    ASP   3           H        ASP   3  -0.205   2.083   0.631
   20    HA   ASP   3           HA       ASP   3  -2.055   3.420  -1.237
   21   1HB   ASP   3          HB2       ASP   3  -0.042   4.554  -0.575
   22   2HB   ASP   3          HB3       ASP   3   0.971   3.217  -1.086
   23    H    ILE   4           H        ILE   4   0.298   0.802  -1.348
   24    HA   ILE   4           HA       ILE   4  -1.178  -0.732  -3.366
   25    HB   ILE   4           HB       ILE   4   1.690   0.164  -3.861
   26   1HG1  ILE   4          2HG1      ILE   4   0.024   1.692  -4.827
   27   2HG1  ILE   4          3HG1      ILE   4   0.998   0.864  -6.019
   28   1HG2  ILE   4          1HG2      ILE   4   0.181  -2.167  -5.088
   29   2HG2  ILE   4          2HG2      ILE   4   1.622  -1.402  -5.842
   30   3HG2  ILE   4          3HG2      ILE   4   1.766  -2.181  -4.292
   31   1HD1  ILE   4          1HD1      ILE   4  -1.378   1.056  -6.730
   32   2HD1  ILE   4          2HD1      ILE   4  -0.917  -0.658  -6.535
   33   3HD1  ILE   4          3HD1      ILE   4  -1.876   0.161  -5.293
   34    H    GLN   5           H        GLN   5   1.966  -0.646  -1.700
   35    HA   GLN   5           HA       GLN   5   1.340  -2.907   0.040
   36   1HB   GLN   5          HB2       GLN   5   2.310  -3.687  -2.315
   37   2HB   GLN   5          HB3       GLN   5   3.842  -3.094  -1.683
   38   1HG   GLN   5          HG2       GLN   5   3.818  -5.416  -1.247
   39   2HG   GLN   5          HG3       GLN   5   3.435  -4.713   0.329
   40   1HE2  GLN   5          1HE2      GLN   5   0.965  -7.471  -0.991
   41   2HE2  GLN   5          2HE2      GLN   5   2.616  -7.278  -1.571
   42    H    VAL   6           H        VAL   6   1.827  -0.157   0.375
   43    HA   VAL   6           HA       VAL   6   3.879  -0.092   2.472
   44    HB   VAL   6           HB       VAL   6   4.005   1.980   0.236
   45   1HG1  VAL   6          1HG1      VAL   6   5.837   1.380   2.584
   46   2HG1  VAL   6          2HG1      VAL   6   6.164   2.598   1.307
   47   3HG1  VAL   6          3HG1      VAL   6   4.806   2.815   2.418
   48   1HG2  VAL   6          1HG2      VAL   6   6.220   1.058  -0.385
   49   2HG2  VAL   6          2HG2      VAL   6   5.931  -0.323   0.712
   50   3HG2  VAL   6          3HG2      VAL   6   4.904  -0.081  -0.723
   51    H    ILE   7           H        ILE   7   3.399   1.594   3.949
   52    HA   ILE   7           HA       ILE   7   0.618   2.617   3.862
   53    HB   ILE   7           HB       ILE   7   2.700   2.967   6.042
   54   1HG1  ILE   7          2HG1      ILE   7   2.474   0.593   5.760
   55   2HG1  ILE   7          3HG1      ILE   7   1.596   1.088   7.195
   56   1HG2  ILE   7          1HG2      ILE   7  -0.366   3.191   6.040
   57   2HG2  ILE   7          2HG2      ILE   7   0.664   3.267   7.485
   58   3HG2  ILE   7          3HG2      ILE   7   0.786   4.515   6.230
   59   1HD1  ILE   7          1HD1      ILE   7  -0.543   0.867   5.917
   60   2HD1  ILE   7          2HD1      ILE   7   0.377   0.377   4.503
   61   3HD1  ILE   7          3HD1      ILE   7   0.358  -0.626   5.977
   62    H    VAL   8           H        VAL   8   0.444   4.236   2.405
   63    HA   VAL   8           HA       VAL   8   1.746   6.793   2.965
   64    HB   VAL   8           HB       VAL   8   1.811   5.870   0.064
   65   1HG1  VAL   8          1HG1      VAL   8   3.269   8.011   1.693
   66   2HG1  VAL   8          2HG1      VAL   8   3.405   7.761  -0.080
   67   3HG1  VAL   8          3HG1      VAL   8   1.881   8.317   0.670
   68   1HG2  VAL   8          1HG2      VAL   8   4.225   5.521   0.277
   69   2HG2  VAL   8          2HG2      VAL   8   4.083   5.598   2.057
   70   3HG2  VAL   8          3HG2      VAL   8   3.296   4.282   1.143
   71    H    ASN   9           H        ASN   9  -0.547   6.365   3.732
   72    HA   ASN   9           HA       ASN   9  -2.659   6.937   1.739
   73   1HB   ASN   9          HB2       ASN   9  -4.216   6.727   3.593
   74   2HB   ASN   9          HB3       ASN   9  -3.208   5.314   3.443
   75   1HD2  ASN   9          1HD2      ASN   9  -2.081   4.598   5.232
   76   2HD2  ASN   9          2HD2      ASN   9  -1.961   5.552   6.711
   77    H    VAL  10           H        VAL  10  -3.663   8.710   1.445
   78    HA   VAL  10           HA       VAL  10  -2.643  11.228   2.683
   79    HB   VAL  10           HB       VAL  10  -3.240  10.649  -0.254
   80   1HG1  VAL  10          1HG1      VAL  10  -2.432  13.248   1.096
   81   2HG1  VAL  10          2HG1      VAL  10  -2.332  12.951  -0.661
   82   3HG1  VAL  10          3HG1      VAL  10  -3.894  12.901   0.166
   83   1HG2  VAL  10          1HG2      VAL  10  -0.845  11.086  -0.586
   84   2HG2  VAL  10          2HG2      VAL  10  -0.633  11.288   1.165
   85   3HG2  VAL  10          3HG2      VAL  10  -1.076   9.724   0.472
   86    HA   PRO  11           HA       PRO  11  -7.092  11.822   3.488
   87   1HB   PRO  11          HB2       PRO  11  -5.977  14.578   4.120
   88   2HB   PRO  11          HB3       PRO  11  -7.195  13.636   5.019
   89   1HG   PRO  11          HG2       PRO  11  -4.621  13.733   5.860
   90   2HG   PRO  11          HG3       PRO  11  -5.538  12.165   5.875
   91   1HD   PRO  11          HD2       PRO  11  -3.540  13.219   3.848
   92   2HD   PRO  11          HD3       PRO  11  -3.618  11.589   4.588
   93    HA   PRO  12           HA       PRO  12  -8.407  13.931  -0.206
   94   1HB   PRO  12          HB2       PRO  12 -10.564  15.380   1.267
   95   2HB   PRO  12          HB3       PRO  12 -10.692  14.231  -0.089
   96   1HG   PRO  12          HG2       PRO  12 -11.412  13.532   2.440
   97   2HG   PRO  12          HG3       PRO  12 -10.600  12.369   1.338
   98   1HD   PRO  12          HD2       PRO  12  -9.330  14.072   3.513
   99   2HD   PRO  12          HD3       PRO  12  -9.129  12.339   3.207
  100    H    SER  13           H        SER  13  -8.044  15.811  -1.270
  101    HA   SER  13           HA       SER  13  -7.292  18.296   0.291
  102   1HB   SER  13          HB2       SER  13  -5.911  17.142  -2.156
  103   2HB   SER  13          HB3       SER  13  -5.498  18.654  -1.351
  104    HG   SER  13           HG       SER  13  -5.434  16.094  -0.162
  105    H    VAL  14           H        VAL  14  -9.893  18.109  -0.483
  106    HA   VAL  14           HA       VAL  14 -10.302  19.174  -3.127
  107    HB   VAL  14           HB       VAL  14 -12.052  17.958  -1.891
  108   1HG1  VAL  14          1HG1      VAL  14 -11.921  19.284   0.287
  109   2HG1  VAL  14          2HG1      VAL  14 -12.755  20.611  -0.524
  110   3HG1  VAL  14          3HG1      VAL  14 -13.563  19.045  -0.355
  111   1HG2  VAL  14          1HG2      VAL  14 -13.890  19.235  -2.873
  112   2HG2  VAL  14          2HG2      VAL  14 -12.914  20.720  -2.899
  113   3HG2  VAL  14          3HG2      VAL  14 -12.482  19.357  -3.927
  114    H    ARG  15           H        ARG  15 -10.379  21.100  -3.903
  115    HA   ARG  15           HA       ARG  15 -10.447  23.548  -2.193
  116   1HB   ARG  15          HB2       ARG  15  -8.471  22.893  -4.440
  117   2HB   ARG  15          HB3       ARG  15  -8.821  24.559  -3.935
  118   1HG   ARG  15          HG2       ARG  15  -8.154  24.054  -1.623
  119   2HG   ARG  15          HG3       ARG  15  -7.806  22.365  -2.079
  120   1HD   ARG  15          HD2       ARG  15  -6.093  23.256  -3.678
  121   2HD   ARG  15          HD3       ARG  15  -6.434  24.891  -3.098
  122    HE   ARG  15           HE       ARG  15  -5.802  22.936  -0.989
  123   1HH1  ARG  15          1HH1      ARG  15  -4.294  25.183  -3.185
  124   2HH1  ARG  15          2HH1      ARG  15  -2.872  25.378  -2.178
  125   1HH2  ARG  15          1HH2      ARG  15  -4.025  23.291   0.312
  126   2HH2  ARG  15          2HH2      ARG  15  -2.712  24.305  -0.269
  127    H    ALA  16           H        ALA  16 -10.861  25.461  -3.701
  128    HA   ALA  16           HA       ALA  16 -13.087  24.771  -5.582
  129   1HB   ALA  16          HB1       ALA  16 -12.414  27.460  -4.294
  130   2HB   ALA  16          HB2       ALA  16 -13.808  27.059  -5.318
  131   3HB   ALA  16          HB3       ALA  16 -13.637  26.289  -3.730
  132    H    ARG  17           H        ARG  17 -12.595  24.750  -7.681
  133    HA   ARG  17           HA       ARG  17  -9.962  25.480  -8.612
  134   1HB   ARG  17          HB2       ARG  17 -11.483  23.590  -9.423
  135   2HB   ARG  17          HB3       ARG  17 -12.335  24.853 -10.366
  136   1HG   ARG  17          HG2       ARG  17 -10.164  25.421 -11.462
  137   2HG   ARG  17          HG3       ARG  17  -9.409  24.081 -10.621
  138   1HD   ARG  17          HD2       ARG  17 -11.710  23.865 -12.587
  139   2HD   ARG  17          HD3       ARG  17 -10.036  23.589 -12.975
  140    HE   ARG  17           HE       ARG  17 -11.802  21.788 -11.463
  141   1HH1  ARG  17          1HH1      ARG  17  -8.480  22.340 -12.461
  142   2HH1  ARG  17          2HH1      ARG  17  -8.092  20.645 -12.359
  143   1HH2  ARG  17          1HH2      ARG  17 -11.227  19.650 -11.392
  144   2HH2  ARG  17          2HH2      ARG  17  -9.592  19.182 -11.740
  145    H    GLN  18           H        GLN  18 -12.999  27.114  -8.629
  146    HA   GLN  18           HA       GLN  18 -11.726  29.631  -9.659
  147   1HB   GLN  18          HB2       GLN  18 -14.643  28.870 -10.054
  148   2HB   GLN  18          HB3       GLN  18 -13.806  30.339 -10.586
  149   1HG   GLN  18          HG2       GLN  18 -13.816  29.163 -12.573
  150   2HG   GLN  18          HG3       GLN  18 -12.251  28.725 -11.931
  151   1HE2  GLN  18          1HE2      GLN  18 -13.410  25.460 -12.946
  152   2HE2  GLN  18          2HE2      GLN  18 -12.469  26.844 -13.474
  153    H    SER  19           H        SER  19 -13.173  31.580  -8.766
  154    HA   SER  19           HA       SER  19 -13.860  31.017  -5.916
  155   1HB   SER  19          HB2       SER  19 -13.486  33.446  -5.583
  156   2HB   SER  19          HB3       SER  19 -12.058  32.582  -6.151
  157    HG   SER  19           HG       SER  19 -12.411  34.571  -7.293
  158    H    THR  20           H        THR  20 -14.893  33.285  -8.471
  159    HA   THR  20           HA       THR  20 -17.789  32.691  -7.922
  160    HB   THR  20           HB       THR  20 -16.580  35.463  -8.171
  161    HG1  THR  20           HG1      THR  20 -16.268  34.644  -6.140
  162   1HG2  THR  20          1HG2      THR  20 -18.919  36.204  -7.590
  163   2HG2  THR  20          2HG2      THR  20 -18.806  35.472  -9.170
  164   3HG2  THR  20          3HG2      THR  20 -19.457  34.522  -7.837
  165    H    MET  21           H        MET  21 -18.629  31.998  -9.663
  166    HA   MET  21           HA       MET  21 -17.640  32.691 -12.376
  167   1HB   MET  21          HB2       MET  21 -19.571  30.626 -11.247
  168   2HB   MET  21          HB3       MET  21 -19.296  30.820 -12.983
  169   1HG   MET  21          HG2       MET  21 -17.119  30.189 -10.963
  170   2HG   MET  21          HG3       MET  21 -17.960  28.996 -11.944
  171   1HE   MET  21          HE1       MET  21 -18.117  30.448 -14.925
  172   2HE   MET  21          HE2       MET  21 -16.713  29.552 -15.550
  173   3HE   MET  21          HE3       MET  21 -17.863  28.760 -14.450
  174    H    ASN  22           H        ASN  22 -19.263  33.063 -14.062
  175    HA   ASN  22           HA       ASN  22 -21.751  34.453 -13.282
  176   1HB   ASN  22          HB2       ASN  22 -19.545  35.533 -15.088
  177   2HB   ASN  22          HB3       ASN  22 -21.178  36.185 -15.047
  178   1HD2  ASN  22          1HD2      ASN  22 -18.602  37.360 -12.201
  179   2HD2  ASN  22          2HD2      ASN  22 -18.083  36.293 -13.501
  180    H    ALA  23           H        ALA  23 -23.374  34.453 -15.022
  181    HA   ALA  23           HA       ALA  23 -22.761  33.108 -17.548
  182   1HB   ALA  23          HB1       ALA  23 -24.399  31.287 -17.226
  183   2HB   ALA  23          HB2       ALA  23 -23.072  31.132 -16.065
  184   3HB   ALA  23          HB3       ALA  23 -24.622  31.787 -15.526
  185    H    THR  24           H        THR  24 -24.381  33.302 -19.086
  186    HA   THR  24           HA       THR  24 -26.436  35.368 -18.591
  187    HB   THR  24           HB       THR  24 -25.500  34.297 -21.279
  188    HG1  THR  24           HG1      THR  24 -24.152  36.070 -21.366
  189   1HG2  THR  24          1HG2      THR  24 -26.375  36.456 -22.084
  190   2HG2  THR  24          2HG2      THR  24 -27.651  35.555 -21.276
  191   3HG2  THR  24          3HG2      THR  24 -26.849  36.915 -20.430
  192    H    ALA  25           H        ALA  25 -28.364  34.562 -18.114
  193    HA   ALA  25           HA       ALA  25 -29.136  31.827 -18.466
  194   1HB   ALA  25          HB1       ALA  25 -30.621  34.370 -17.690
  195   2HB   ALA  25          HB2       ALA  25 -31.397  32.784 -17.714
  196   3HB   ALA  25          HB3       ALA  25 -30.027  33.066 -16.616
  197    H    ASN  26           H        ASN  26 -30.716  30.840 -19.622
  198    HA   ASN  26           HA       ASN  26 -32.217  30.358 -21.163
  199   1HB   ASN  26          HB2       ASN  26 -33.300  32.412 -20.104
  200   2HB   ASN  26          HB3       ASN  26 -32.730  33.338 -21.492
  201   1HD2  ASN  26          1HD2      ASN  26 -35.997  32.695 -22.660
  202   2HD2  ASN  26          2HD2      ASN  26 -34.960  33.861 -21.847
  203    H    LEU  27           H        LEU  27 -29.363  30.983 -22.015
  204    HA   LEU  27           HA       LEU  27 -29.801  31.437 -24.923
  205   1HB   LEU  27          HB2       LEU  27 -27.191  31.218 -23.384
  206   2HB   LEU  27          HB3       LEU  27 -27.369  31.571 -25.089
  207    HG   LEU  27           HG       LEU  27 -28.176  33.343 -22.779
  208   1HD1  LEU  27          1HD1      LEU  27 -25.790  33.267 -23.319
  209   2HD1  LEU  27          2HD1      LEU  27 -26.136  33.686 -25.008
  210   3HD1  LEU  27          3HD1      LEU  27 -26.482  34.857 -23.742
  211   1HD2  LEU  27          1HD2      LEU  27 -28.785  35.047 -24.470
  212   2HD2  LEU  27          2HD2      LEU  27 -28.575  33.847 -25.744
  213   3HD2  LEU  27          3HD2      LEU  27 -29.858  33.667 -24.542
  214    H    SER  28           H        SER  28 -29.884  28.791 -22.921
  215    HA   SER  28           HA       SER  28 -29.850  26.564 -23.234
  216   1HB   SER  28          HB2       SER  28 -29.795  27.140 -26.199
  217   2HB   SER  28          HB3       SER  28 -30.338  25.639 -25.390
  218    HG   SER  28           HG       SER  28 -32.071  27.159 -25.987
  219    H    GLN  29           H        GLN  29 -27.215  27.977 -23.103
  220    HA   GLN  29           HA       GLN  29 -25.356  26.239 -24.577
  221   1HB   GLN  29          HB2       GLN  29 -23.735  27.790 -24.189
  222   2HB   GLN  29          HB3       GLN  29 -25.157  28.793 -24.430
  223   1HG   GLN  29          HG2       GLN  29 -23.915  28.152 -21.696
  224   2HG   GLN  29          HG3       GLN  29 -23.577  29.549 -22.684
  225   1HE2  GLN  29          1HE2      GLN  29 -24.276  31.115 -21.226
  226   2HE2  GLN  29          2HE2      GLN  29 -25.986  31.298 -20.838
  227    H    SER  30           H        SER  30 -23.225  25.772 -23.182
  228    HA   SER  30           HA       SER  30 -24.016  24.524 -20.591
  229   1HB   SER  30          HB2       SER  30 -21.885  23.588 -22.535
  230   2HB   SER  30          HB3       SER  30 -22.240  22.863 -20.957
  231    HG   SER  30           HG       SER  30 -23.975  23.007 -23.212
  232    H    VAL  31           H        VAL  31 -22.930  25.050 -18.859
  233    HA   VAL  31           HA       VAL  31 -20.448  26.762 -19.071
  234    HB   VAL  31           HB       VAL  31 -22.656  26.980 -16.994
  235   1HG1  VAL  31          1HG1      VAL  31 -21.529  29.071 -16.314
  236   2HG1  VAL  31          2HG1      VAL  31 -20.475  27.663 -16.115
  237   3HG1  VAL  31          3HG1      VAL  31 -20.234  28.751 -17.489
  238   1HG2  VAL  31          1HG2      VAL  31 -23.466  27.813 -19.178
  239   2HG2  VAL  31          2HG2      VAL  31 -23.187  29.163 -18.051
  240   3HG2  VAL  31          3HG2      VAL  31 -21.995  28.824 -19.326
  241    H    THR  32           H        THR  32 -18.696  26.039 -18.015
  242    HA   THR  32           HA       THR  32 -18.979  23.705 -16.171
  243    HB   THR  32           HB       THR  32 -16.452  24.735 -17.537
  244    HG1  THR  32           HG1      THR  32 -16.808  23.144 -19.058
  245   1HG2  THR  32          1HG2      THR  32 -17.167  22.107 -16.162
  246   2HG2  THR  32          2HG2      THR  32 -15.715  22.335 -17.198
  247   3HG2  THR  32          3HG2      THR  32 -15.909  23.252 -15.709
  248    H    LEU  33           H        LEU  33 -18.108  23.682 -14.168
  249    HA   LEU  33           HA       LEU  33 -16.204  25.575 -13.161
  250   1HB   LEU  33          HB2       LEU  33 -17.671  26.336 -11.250
  251   2HB   LEU  33          HB3       LEU  33 -17.964  26.997 -12.863
  252    HG   LEU  33           HG       LEU  33 -19.923  25.516 -13.125
  253   1HD1  LEU  33          1HD1      LEU  33 -19.309  24.715 -10.265
  254   2HD1  LEU  33          2HD1      LEU  33 -20.911  24.511 -11.003
  255   3HD1  LEU  33          3HD1      LEU  33 -19.526  23.664 -11.700
  256   1HD2  LEU  33          1HD2      LEU  33 -20.010  27.257 -10.623
  257   2HD2  LEU  33          2HD2      LEU  33 -20.110  27.830 -12.295
  258   3HD2  LEU  33          3HD2      LEU  33 -21.374  26.779 -11.654
  259    H    ALA  34           H        ALA  34 -15.620  24.970 -10.769
  260    HA   ALA  34           HA       ALA  34 -16.217  22.132 -10.233
  261   1HB   ALA  34          HB1       ALA  34 -14.611  22.234 -12.152
  262   2HB   ALA  34          HB2       ALA  34 -13.481  23.100 -11.123
  263   3HB   ALA  34          HB3       ALA  34 -13.890  21.434 -10.722
  264    H    CYS  35           H        CYS  35 -15.419  21.170  -8.466
  265    HA   CYS  35           HA       CYS  35 -13.754  22.715  -6.520
  266   1HB   CYS  35          HB2       CYS  35 -16.111  20.866  -6.054
  267   2HB   CYS  35          HB3       CYS  35 -14.771  20.953  -4.909
  268    H    ASP  36           H        ASP  36 -11.728  21.967  -6.995
  269    HA   ASP  36           HA       ASP  36 -11.250  19.382  -8.195
  270   1HB   ASP  36          HB2       ASP  36  -8.964  20.066  -8.356
  271   2HB   ASP  36          HB3       ASP  36 -10.070  21.262  -8.996
  272    H    ALA  37           H        ALA  37 -12.103  18.004  -6.596
  273    HA   ALA  37           HA       ALA  37 -10.552  17.495  -4.176
  274   1HB   ALA  37          HB1       ALA  37 -12.772  15.842  -5.480
  275   2HB   ALA  37          HB2       ALA  37 -12.136  15.627  -3.829
  276   3HB   ALA  37          HB3       ALA  37 -13.044  17.082  -4.269
  277    H    ASP  38           H        ASP  38  -9.182  15.844  -3.768
  278    HA   ASP  38           HA       ASP  38  -8.603  13.616  -5.590
  279   1HB   ASP  38          HB2       ASP  38  -7.381  15.512  -6.639
  280   2HB   ASP  38          HB3       ASP  38  -6.602  15.858  -5.103
  281    H    GLY  39           H        GLY  39  -6.830  12.245  -4.529
  282   1HA   GLY  39          HA2       GLY  39  -5.766  12.450  -1.975
  283   2HA   GLY  39          HA3       GLY  39  -7.380  11.821  -1.717
  284    H    PHE  40           H        PHE  40  -5.383  10.209  -0.908
  285    HA   PHE  40           HA       PHE  40  -5.440   7.990  -2.897
  286   1HB   PHE  40          HB2       PHE  40  -2.928   8.733  -1.418
  287   2HB   PHE  40          HB3       PHE  40  -3.189   7.372  -2.446
  288    HD1  PHE  40           HD1      PHE  40  -2.613  11.015  -2.430
  289    HD2  PHE  40           HD2      PHE  40  -3.437   7.571  -4.883
  290    HE1  PHE  40           HE1      PHE  40  -1.949  12.290  -4.460
  291    HE2  PHE  40           HE2      PHE  40  -2.832   8.860  -6.900
  292    HZ   PHE  40           HZ       PHE  40  -2.110  11.243  -6.714
  293    HA   PRO  41           HA       PRO  41  -6.420   6.069  -2.943
  294   1HB   PRO  41          HB2       PRO  41  -8.800   4.921  -2.328
  295   2HB   PRO  41          HB3       PRO  41  -7.203   4.137  -2.023
  296   1HG   PRO  41          HG2       PRO  41  -8.901   5.743  -0.084
  297   2HG   PRO  41          HG3       PRO  41  -8.191   4.111   0.158
  298   1HD   PRO  41          HD2       PRO  41  -6.900   6.307   1.109
  299   2HD   PRO  41          HD3       PRO  41  -5.979   4.977   0.349
  300    H    GLU  42           H        GLU  42  -8.091   6.710  -4.379
  301    HA   GLU  42           HA       GLU  42  -8.848   9.331  -4.546
  302   1HB   GLU  42          HB2       GLU  42 -10.472   8.648  -6.242
  303   2HB   GLU  42          HB3       GLU  42  -8.936   7.794  -6.419
  304   1HG   GLU  42          HG2       GLU  42 -10.059   5.814  -5.204
  305   2HG   GLU  42          HG3       GLU  42 -11.567   6.720  -5.357
  306    HA   PRO  43           HA       PRO  43 -11.901   9.748  -1.422
  307   1HB   PRO  43          HB2       PRO  43 -12.537  12.378  -1.682
  308   2HB   PRO  43          HB3       PRO  43 -10.862  11.888  -1.275
  309   1HG   PRO  43          HG2       PRO  43 -12.058  12.542  -3.998
  310   2HG   PRO  43          HG3       PRO  43 -10.574  13.248  -3.271
  311   1HD   PRO  43          HD2       PRO  43 -10.478  11.096  -4.992
  312   2HD   PRO  43          HD3       PRO  43  -9.364  11.231  -3.610
  313    H    THR  44           H        THR  44 -14.018  10.336  -0.890
  314    HA   THR  44           HA       THR  44 -16.058  10.047  -3.080
  315    HB   THR  44           HB       THR  44 -16.328   9.638  -0.062
  316    HG1  THR  44           HG1      THR  44 -15.182   8.008  -1.146
  317   1HG2  THR  44          1HG2      THR  44 -18.550   8.664  -0.628
  318   2HG2  THR  44          2HG2      THR  44 -18.464  10.376  -1.065
  319   3HG2  THR  44          3HG2      THR  44 -18.333   9.106  -2.313
  320    H    MET  45           H        MET  45 -17.239  11.943  -3.497
  321    HA   MET  45           HA       MET  45 -17.189  14.100  -1.460
  322   1HB   MET  45          HB2       MET  45 -16.173  15.689  -2.919
  323   2HB   MET  45          HB3       MET  45 -15.148  14.266  -2.879
  324   1HG   MET  45          HG2       MET  45 -15.088  14.714  -5.100
  325   2HG   MET  45          HG3       MET  45 -16.425  13.556  -5.065
  326   1HE   MET  45          HE1       MET  45 -16.650  18.103  -5.893
  327   2HE   MET  45          HE2       MET  45 -16.082  17.467  -4.326
  328   3HE   MET  45          HE3       MET  45 -15.185  17.111  -5.832
  329    H    THR  46           H        THR  46 -18.609  15.791  -1.726
  330    HA   THR  46           HA       THR  46 -20.705  15.734  -3.789
  331    HB   THR  46           HB       THR  46 -22.525  15.820  -2.017
  332    HG1  THR  46           HG1      THR  46 -20.545  14.673  -0.362
  333   1HG2  THR  46          1HG2      THR  46 -21.120  13.142  -1.979
  334   2HG2  THR  46          2HG2      THR  46 -22.835  13.453  -1.728
  335   3HG2  THR  46          3HG2      THR  46 -22.114  13.750  -3.344
  336    H    TRP  47           H        TRP  47 -22.268  17.579  -3.407
  337    HA   TRP  47           HA       TRP  47 -21.305  19.789  -1.798
  338   1HB   TRP  47          HB2       TRP  47 -20.960  21.303  -3.799
  339   2HB   TRP  47          HB3       TRP  47 -19.723  20.162  -3.322
  340    HD1  TRP  47           HD1      TRP  47 -19.420  17.905  -4.793
  341    HE1  TRP  47           HE1      TRP  47 -18.745  18.035  -7.237
  342    HE3  TRP  47           HE3      TRP  47 -21.589  22.409  -5.989
  343    HZ2  TRP  47           HZ2      TRP  47 -18.716  20.058  -9.304
  344    HZ3  TRP  47           HZ3      TRP  47 -21.205  23.395  -8.216
  345    HH2  TRP  47           HH2      TRP  47 -19.765  22.248  -9.872
  346    H    THR  48           H        THR  48 -22.488  21.811  -2.106
  347    HA   THR  48           HA       THR  48 -25.385  21.140  -2.446
  348    HB   THR  48           HB       THR  48 -25.917  22.451  -0.468
  349    HG1  THR  48           HG1      THR  48 -23.113  22.655  -0.113
  350   1HG2  THR  48          1HG2      THR  48 -25.450  20.064  -0.154
  351   2HG2  THR  48          2HG2      THR  48 -23.754  20.455   0.232
  352   3HG2  THR  48          3HG2      THR  48 -25.072  21.036   1.265
  353    H    LYS  49           H        LYS  49 -26.860  22.831  -2.762
  354    HA   LYS  49           HA       LYS  49 -25.842  25.142  -4.340
  355   1HB   LYS  49          HB2       LYS  49 -27.444  23.402  -5.317
  356   2HB   LYS  49          HB3       LYS  49 -28.665  24.013  -4.195
  357   1HG   LYS  49          HG2       LYS  49 -28.365  26.275  -5.227
  358   2HG   LYS  49          HG3       LYS  49 -27.198  25.549  -6.356
  359   1HD   LYS  49          HD2       LYS  49 -28.919  24.089  -7.290
  360   2HD   LYS  49          HD3       LYS  49 -30.092  24.676  -6.098
  361   1HE   LYS  49          HE2       LYS  49 -29.859  26.990  -7.019
  362   2HE   LYS  49          HE3       LYS  49 -28.682  26.382  -8.202
  363   1HZ   LYS  49          HZ1       LYS  49 -30.414  24.999  -9.168
  364   2HZ   LYS  49          HZ2       LYS  49 -31.502  25.459  -8.027
  365   3HZ   LYS  49          HZ3       LYS  49 -30.954  26.547  -9.107
  366    H    ASP  50           H        ASP  50 -25.222  26.047  -2.175
  367    HA   ASP  50           HA       ASP  50 -25.388  27.403  -0.426
  368   1HB   ASP  50          HB2       ASP  50 -26.614  28.858  -2.053
  369   2HB   ASP  50          HB3       ASP  50 -28.143  28.212  -1.435
  370    H    GLY  51           H        GLY  51 -27.266  24.677  -0.573
  371   1HA   GLY  51          HA2       GLY  51 -27.171  24.146   2.166
  372   2HA   GLY  51          HA3       GLY  51 -28.779  24.783   1.890
  373    H    GLU  52           H        GLU  52 -29.237  23.609  -0.734
  374    HA   GLU  52           HA       GLU  52 -29.915  20.889   0.106
  375   1HB   GLU  52          HB2       GLU  52 -31.363  20.837  -1.794
  376   2HB   GLU  52          HB3       GLU  52 -31.636  22.273  -0.855
  377   1HG   GLU  52          HG2       GLU  52 -30.282  23.594  -2.474
  378   2HG   GLU  52          HG3       GLU  52 -30.083  22.146  -3.465
  379    HA   PRO  53           HA       PRO  53 -26.608  19.007  -1.970
  380   1HB   PRO  53          HB2       PRO  53 -27.379  16.445  -2.435
  381   2HB   PRO  53          HB3       PRO  53 -27.148  17.159  -0.801
  382   1HG   PRO  53          HG2       PRO  53 -29.749  16.823  -2.327
  383   2HG   PRO  53          HG3       PRO  53 -29.397  16.367  -0.637
  384   1HD   PRO  53          HD2       PRO  53 -30.607  18.727  -1.245
  385   2HD   PRO  53          HD3       PRO  53 -29.451  18.634   0.090
  386    H    ILE  54           H        ILE  54 -25.622  18.729  -3.841
  387    HA   ILE  54           HA       ILE  54 -27.090  18.389  -6.432
  388    HB   ILE  54           HB       ILE  54 -24.317  19.595  -6.045
  389   1HG1  ILE  54          2HG1      ILE  54 -26.733  21.342  -6.542
  390   2HG1  ILE  54          3HG1      ILE  54 -26.239  21.030  -4.893
  391   1HG2  ILE  54          1HG2      ILE  54 -26.347  19.918  -8.330
  392   2HG2  ILE  54          2HG2      ILE  54 -24.700  20.569  -8.314
  393   3HG2  ILE  54          3HG2      ILE  54 -24.922  18.833  -8.390
  394   1HD1  ILE  54          1HD1      ILE  54 -24.041  21.892  -5.228
  395   2HD1  ILE  54          2HD1      ILE  54 -24.317  22.173  -6.944
  396   3HD1  ILE  54          3HD1      ILE  54 -25.227  23.111  -5.747
  397    H    GLU  55           H        GLU  55 -26.660  16.172  -4.847
  398    HA   GLU  55           HA       GLU  55 -24.147  14.923  -5.380
  399   1HB   GLU  55          HB2       GLU  55 -25.096  12.911  -4.407
  400   2HB   GLU  55          HB3       GLU  55 -25.272  14.345  -3.405
  401   1HG   GLU  55          HG2       GLU  55 -27.678  14.520  -4.038
  402   2HG   GLU  55          HG3       GLU  55 -27.505  13.068  -5.035
  403    H    GLN  56           H        GLN  56 -23.430  13.839  -6.948
  404    HA   GLN  56           HA       GLN  56 -24.512  13.969  -9.519
  405   1HB   GLN  56          HB2       GLN  56 -22.074  12.650  -8.332
  406   2HB   GLN  56          HB3       GLN  56 -22.352  12.707 -10.060
  407   1HG   GLN  56          HG2       GLN  56 -22.384  15.124 -10.094
  408   2HG   GLN  56          HG3       GLN  56 -22.279  15.213  -8.343
  409   1HE2  GLN  56          1HE2      GLN  56 -18.855  15.922  -9.138
  410   2HE2  GLN  56          2HE2      GLN  56 -20.427  16.702  -9.064
  411    H    GLU  57           H        GLU  57 -25.576  11.737  -7.407
  412    HA   GLU  57           HA       GLU  57 -25.855   9.508  -9.371
  413   1HB   GLU  57          HB2       GLU  57 -26.173   9.548  -6.347
  414   2HB   GLU  57          HB3       GLU  57 -26.440   8.147  -7.391
  415   1HG   GLU  57          HG2       GLU  57 -24.054   8.289  -8.176
  416   2HG   GLU  57          HG3       GLU  57 -23.795   9.618  -7.031
  417    H    ASP  58           H        ASP  58 -27.623  12.178  -8.301
  418    HA   ASP  58           HA       ASP  58 -30.181  10.940  -9.176
  419   1HB   ASP  58          HB2       ASP  58 -29.920  10.465  -6.730
  420   2HB   ASP  58          HB3       ASP  58 -29.885  12.192  -6.404
  421    H    ASN  59           H        ASN  59 -28.230  13.801  -8.914
  422    HA   ASN  59           HA       ASN  59 -30.515  15.583  -9.494
  423   1HB   ASN  59          HB2       ASN  59 -27.798  16.207  -8.315
  424   2HB   ASN  59          HB3       ASN  59 -29.018  17.403  -8.722
  425   1HD2  ASN  59          1HD2      ASN  59 -29.453  15.162  -5.391
  426   2HD2  ASN  59          2HD2      ASN  59 -28.148  14.804  -6.540
  427    H    GLU  60           H        GLU  60 -28.881  13.848 -11.397
  428    HA   GLU  60           HA       GLU  60 -27.254  15.456 -13.089
  429   1HB   GLU  60          HB2       GLU  60 -27.315  12.911 -12.539
  430   2HB   GLU  60          HB3       GLU  60 -28.555  12.810 -13.785
  431   1HG   GLU  60          HG2       GLU  60 -26.865  13.783 -15.417
  432   2HG   GLU  60          HG3       GLU  60 -25.660  13.754 -14.140
  433    H    GLU  61           H        GLU  61 -30.315  16.035 -12.832
  434    HA   GLU  61           HA       GLU  61 -31.690  15.713 -15.215
  435   1HB   GLU  61          HB2       GLU  61 -31.833  18.058 -13.283
  436   2HB   GLU  61          HB3       GLU  61 -33.036  17.726 -14.527
  437   1HG   GLU  61          HG2       GLU  61 -33.378  15.437 -13.476
  438   2HG   GLU  61          HG3       GLU  61 -32.329  15.942 -12.176
  439    H    LYS  62           H        LYS  62 -29.135  18.051 -14.763
  440    HA   LYS  62           HA       LYS  62 -29.046  18.396 -17.634
  441   1HB   LYS  62          HB2       LYS  62 -29.301  20.717 -17.897
  442   2HB   LYS  62          HB3       LYS  62 -30.717  20.102 -17.086
  443   1HG   LYS  62          HG2       LYS  62 -29.670  20.980 -14.867
  444   2HG   LYS  62          HG3       LYS  62 -28.509  21.846 -15.915
  445   1HD   LYS  62          HD2       LYS  62 -30.591  22.746 -17.172
  446   2HD   LYS  62          HD3       LYS  62 -31.507  22.202 -15.752
  447   1HE   LYS  62          HE2       LYS  62 -30.116  23.612 -14.311
  448   2HE   LYS  62          HE3       LYS  62 -29.073  24.022 -15.680
  449   1HZ   LYS  62          HZ1       LYS  62 -30.644  25.776 -15.227
  450   2HZ   LYS  62          HZ2       LYS  62 -30.924  25.132 -16.723
  451   3HZ   LYS  62          HZ3       LYS  62 -31.926  24.777 -15.468
  452    H    TYR  63           H        TYR  63 -27.176  17.112 -16.185
  453    HA   TYR  63           HA       TYR  63 -24.909  18.703 -16.973
  454   1HB   TYR  63          HB2       TYR  63 -23.689  18.686 -14.814
  455   2HB   TYR  63          HB3       TYR  63 -25.185  19.595 -14.777
  456    HD1  TYR  63           HD1      TYR  63 -24.188  15.993 -14.097
  457    HD2  TYR  63           HD2      TYR  63 -26.102  19.607 -12.689
  458    HE1  TYR  63           HE1      TYR  63 -24.572  14.941 -11.875
  459    HE2  TYR  63           HE2      TYR  63 -26.442  18.533 -10.474
  460    HH   TYR  63           HH       TYR  63 -26.023  16.709  -9.151
  461    H    SER  64           H        SER  64 -22.770  17.747 -16.564
  462    HA   SER  64           HA       SER  64 -22.549  14.850 -16.175
  463   1HB   SER  64          HB2       SER  64 -21.277  14.466 -18.277
  464   2HB   SER  64          HB3       SER  64 -22.961  14.887 -18.577
  465    HG   SER  64           HG       SER  64 -21.596  16.046 -19.954
  466    H    PHE  65           H        PHE  65 -20.323  14.225 -15.752
  467    HA   PHE  65           HA       PHE  65 -18.393  16.381 -15.140
  468   1HB   PHE  65          HB2       PHE  65 -18.426  15.395 -12.878
  469   2HB   PHE  65          HB3       PHE  65 -19.971  16.028 -13.443
  470    HD1  PHE  65           HD1      PHE  65 -18.121  12.865 -12.816
  471    HD2  PHE  65           HD2      PHE  65 -21.960  14.705 -13.427
  472    HE1  PHE  65           HE1      PHE  65 -19.248  10.701 -12.349
  473    HE2  PHE  65           HE2      PHE  65 -23.091  12.567 -12.933
  474    HZ   PHE  65           HZ       PHE  65 -21.735  10.544 -12.396
  475    H    ASN  66           H        ASN  66 -16.414  15.521 -14.074
  476    HA   ASN  66           HA       ASN  66 -15.136  13.679 -15.969
  477   1HB   ASN  66          HB2       ASN  66 -13.094  14.780 -15.378
  478   2HB   ASN  66          HB3       ASN  66 -14.335  16.004 -15.546
  479   1HD2  ASN  66          1HD2      ASN  66 -12.575  17.034 -12.539
  480   2HD2  ASN  66          2HD2      ASN  66 -12.496  17.213 -14.308
  481    H    TYR  67           H        TYR  67 -12.932  12.693 -14.736
  482    HA   TYR  67           HA       TYR  67 -14.040  10.424 -13.277
  483   1HB   TYR  67          HB2       TYR  67 -11.756   9.524 -13.483
  484   2HB   TYR  67          HB3       TYR  67 -12.509   9.966 -15.015
  485    HD1  TYR  67           HD1      TYR  67 -11.442  11.507 -16.503
  486    HD2  TYR  67           HD2      TYR  67  -9.960  11.052 -12.453
  487    HE1  TYR  67           HE1      TYR  67  -9.422  12.838 -17.079
  488    HE2  TYR  67           HE2      TYR  67  -7.934  12.359 -13.052
  489    HH   TYR  67           HH       TYR  67  -7.432  13.680 -16.363
  490    H    ASP  68           H        ASP  68 -12.513  13.339 -12.210
  491    HA   ASP  68           HA       ASP  68 -11.821  12.331  -9.464
  492   1HB   ASP  68          HB2       ASP  68 -11.777  15.074 -10.779
  493   2HB   ASP  68          HB3       ASP  68 -11.354  14.763  -9.094
  494    H    GLY  69           H        GLY  69 -14.571  13.519 -11.160
  495   1HA   GLY  69          HA2       GLY  69 -16.758  13.964 -10.471
  496   2HA   GLY  69          HA3       GLY  69 -16.268  13.734  -8.790
  497    H    SER  70           H        SER  70 -14.124  15.879 -10.350
  498    HA   SER  70           HA       SER  70 -14.985  18.007  -8.570
  499   1HB   SER  70          HB2       SER  70 -12.925  19.106  -9.349
  500   2HB   SER  70          HB3       SER  70 -12.668  17.475  -8.699
  501    HG   SER  70           HG       SER  70 -11.493  17.455 -10.524
  502    H    GLU  71           H        GLU  71 -14.609  17.762 -12.148
  503    HA   GLU  71           HA       GLU  71 -15.718  20.468 -12.505
  504   1HB   GLU  71          HB2       GLU  71 -14.855  18.330 -14.456
  505   2HB   GLU  71          HB3       GLU  71 -15.437  19.919 -14.928
  506   1HG   GLU  71          HG2       GLU  71 -13.580  21.030 -13.838
  507   2HG   GLU  71          HG3       GLU  71 -12.973  19.489 -13.197
  508    H    LEU  72           H        LEU  72 -17.787  20.900 -12.664
  509    HA   LEU  72           HA       LEU  72 -19.666  18.759 -13.578
  510   1HB   LEU  72          HB2       LEU  72 -19.745  19.395 -11.124
  511   2HB   LEU  72          HB3       LEU  72 -20.290  21.004 -11.640
  512    HG   LEU  72           HG       LEU  72 -22.256  19.912 -12.750
  513   1HD1  LEU  72          1HD1      LEU  72 -21.558  17.679 -13.144
  514   2HD1  LEU  72          2HD1      LEU  72 -21.050  17.412 -11.445
  515   3HD1  LEU  72          3HD1      LEU  72 -22.745  17.542 -11.847
  516   1HD2  LEU  72          1HD2      LEU  72 -22.430  20.878 -10.501
  517   2HD2  LEU  72          2HD2      LEU  72 -23.454  19.463 -10.682
  518   3HD2  LEU  72          3HD2      LEU  72 -21.930  19.327  -9.775
  519    H    ILE  73           H        ILE  73 -20.447  19.212 -15.489
  520    HA   ILE  73           HA       ILE  73 -20.402  22.000 -16.564
  521    HB   ILE  73           HB       ILE  73 -20.872  19.402 -18.079
  522   1HG1  ILE  73          2HG1      ILE  73 -18.175  20.794 -18.126
  523   2HG1  ILE  73          3HG1      ILE  73 -18.478  19.606 -16.872
  524   1HG2  ILE  73          1HG2      ILE  73 -21.643  21.500 -19.123
  525   2HG2  ILE  73          2HG2      ILE  73 -20.061  22.230 -18.914
  526   3HG2  ILE  73          3HG2      ILE  73 -20.273  20.849 -20.020
  527   1HD1  ILE  73          1HD1      ILE  73 -17.406  18.600 -18.790
  528   2HD1  ILE  73          2HD1      ILE  73 -19.000  17.892 -18.455
  529   3HD1  ILE  73          3HD1      ILE  73 -18.765  19.017 -19.834
  530    H    ILE  74           H        ILE  74 -22.240  23.099 -16.547
  531    HA   ILE  74           HA       ILE  74 -24.819  21.652 -16.129
  532    HB   ILE  74           HB       ILE  74 -24.400  24.623 -15.701
  533   1HG1  ILE  74          2HG1      ILE  74 -22.850  23.650 -14.110
  534   2HG1  ILE  74          3HG1      ILE  74 -24.287  24.239 -13.300
  535   1HG2  ILE  74          1HG2      ILE  74 -26.703  23.885 -16.000
  536   2HG2  ILE  74          2HG2      ILE  74 -26.507  22.645 -14.750
  537   3HG2  ILE  74          3HG2      ILE  74 -26.435  24.358 -14.303
  538   1HD1  ILE  74          1HD1      ILE  74 -23.534  22.113 -12.362
  539   2HD1  ILE  74          2HD1      ILE  74 -25.141  21.927 -13.052
  540   3HD1  ILE  74          3HD1      ILE  74 -23.721  21.329 -13.930
  541    H    LYS  75           H        LYS  75 -26.105  21.502 -17.890
  542    HA   LYS  75           HA       LYS  75 -25.722  23.450 -20.120
  543   1HB   LYS  75          HB2       LYS  75 -26.736  21.887 -21.605
  544   2HB   LYS  75          HB3       LYS  75 -25.430  21.102 -20.727
  545   1HG   LYS  75          HG2       LYS  75 -27.208  20.117 -19.187
  546   2HG   LYS  75          HG3       LYS  75 -28.435  20.751 -20.302
  547   1HD   LYS  75          HD2       LYS  75 -26.247  18.741 -20.994
  548   2HD   LYS  75          HD3       LYS  75 -27.948  18.350 -20.699
  549   1HE   LYS  75          HE2       LYS  75 -28.632  19.784 -22.589
  550   2HE   LYS  75          HE3       LYS  75 -26.912  20.132 -22.956
  551   1HZ   LYS  75          HZ1       LYS  75 -26.601  17.745 -23.374
  552   2HZ   LYS  75          HZ2       LYS  75 -28.154  17.429 -22.999
  553   3HZ   LYS  75          HZ3       LYS  75 -27.812  18.320 -24.314
  554    H    LYS  76           H        LYS  76 -27.430  24.333 -21.168
  555    HA   LYS  76           HA       LYS  76 -29.208  25.717 -21.267
  556   1HB   LYS  76          HB2       LYS  76 -31.415  24.799 -21.147
  557   2HB   LYS  76          HB3       LYS  76 -30.303  23.762 -22.016
  558   1HG   LYS  76          HG2       LYS  76 -30.161  22.252 -20.021
  559   2HG   LYS  76          HG3       LYS  76 -31.340  23.272 -19.213
  560   1HD   LYS  76          HD2       LYS  76 -32.997  22.784 -20.977
  561   2HD   LYS  76          HD3       LYS  76 -31.778  21.811 -21.833
  562   1HE   LYS  76          HE2       LYS  76 -31.609  20.315 -19.830
  563   2HE   LYS  76          HE3       LYS  76 -32.859  21.255 -19.016
  564   1HZ   LYS  76          HZ1       LYS  76 -33.763  19.270 -20.113
  565   2HZ   LYS  76          HZ2       LYS  76 -34.400  20.619 -20.788
  566   3HZ   LYS  76          HZ3       LYS  76 -33.236  19.792 -21.570
  567    H    VAL  77           H        VAL  77 -27.954  26.819 -19.664
  568    HA   VAL  77           HA       VAL  77 -28.863  26.855 -16.885
  569    HB   VAL  77           HB       VAL  77 -26.886  28.550 -18.407
  570   1HG1  VAL  77          1HG1      VAL  77 -26.061  29.329 -16.195
  571   2HG1  VAL  77          2HG1      VAL  77 -27.651  29.937 -16.579
  572   3HG1  VAL  77          3HG1      VAL  77 -27.478  28.579 -15.423
  573   1HG2  VAL  77          1HG2      VAL  77 -25.252  27.219 -17.031
  574   2HG2  VAL  77          2HG2      VAL  77 -26.601  26.278 -16.368
  575   3HG2  VAL  77          3HG2      VAL  77 -26.229  26.180 -18.098
  576    H    ASP  78           H        ASP  78 -29.989  28.366 -15.753
  577    HA   ASP  78           HA       ASP  78 -31.153  30.687 -17.154
  578   1HB   ASP  78          HB2       ASP  78 -32.621  28.445 -17.146
  579   2HB   ASP  78          HB3       ASP  78 -33.075  29.096 -15.542
  580    H    LYS  79           H        LYS  79 -32.594  31.883 -15.439
  581    HA   LYS  79           HA       LYS  79 -30.899  33.051 -13.512
  582   1HB   LYS  79          HB2       LYS  79 -33.925  33.046 -13.678
  583   2HB   LYS  79          HB3       LYS  79 -33.021  34.110 -12.626
  584   1HG   LYS  79          HG2       LYS  79 -31.932  35.200 -14.493
  585   2HG   LYS  79          HG3       LYS  79 -32.671  34.088 -15.659
  586   1HD   LYS  79          HD2       LYS  79 -34.240  35.998 -13.857
  587   2HD   LYS  79          HD3       LYS  79 -33.809  36.322 -15.529
  588   1HE   LYS  79          HE2       LYS  79 -35.036  34.308 -16.268
  589   2HE   LYS  79          HE3       LYS  79 -35.514  33.972 -14.613
  590   1HZ   LYS  79          HZ1       LYS  79 -36.709  36.136 -14.599
  591   2HZ   LYS  79          HZ2       LYS  79 -36.254  36.422 -16.156
  592   3HZ   LYS  79          HZ3       LYS  79 -37.245  35.173 -15.801
  593    H    SER  80           H        SER  80 -32.890  30.236 -13.100
  594    HA   SER  80           HA       SER  80 -32.941  30.259 -10.216
  595   1HB   SER  80          HB2       SER  80 -34.000  28.042 -10.543
  596   2HB   SER  80          HB3       SER  80 -34.770  29.310 -11.462
  597    HG   SER  80           HG       SER  80 -34.439  27.416 -12.722
  598    H    ASP  81           H        ASP  81 -30.434  29.448 -12.437
  599    HA   ASP  81           HA       ASP  81 -29.265  27.330 -10.745
  600   1HB   ASP  81          HB2       ASP  81 -28.291  28.770 -13.237
  601   2HB   ASP  81          HB3       ASP  81 -27.415  27.466 -12.456
  602    H    GLU  82           H        GLU  82 -29.322  30.683 -10.378
  603    HA   GLU  82           HA       GLU  82 -26.687  31.317  -9.520
  604   1HB   GLU  82          HB2       GLU  82 -28.477  32.974  -9.885
  605   2HB   GLU  82          HB3       GLU  82 -29.376  32.363  -8.504
  606   1HG   GLU  82          HG2       GLU  82 -27.556  33.047  -6.993
  607   2HG   GLU  82          HG3       GLU  82 -26.524  33.449  -8.345
  608    H    ALA  83           H        ALA  83 -25.499  30.727  -7.798
  609    HA   ALA  83           HA       ALA  83 -26.650  29.390  -5.417
  610   1HB   ALA  83          HB1       ALA  83 -25.449  27.226  -6.001
  611   2HB   ALA  83          HB2       ALA  83 -26.689  27.632  -7.212
  612   3HB   ALA  83          HB3       ALA  83 -25.003  27.916  -7.555
  613    H    GLU  84           H        GLU  84 -25.149  28.737  -3.822
  614    HA   GLU  84           HA       GLU  84 -22.320  29.633  -4.135
  615   1HB   GLU  84          HB2       GLU  84 -23.511  31.037  -2.522
  616   2HB   GLU  84          HB3       GLU  84 -23.934  29.603  -1.555
  617   1HG   GLU  84          HG2       GLU  84 -21.655  29.229  -0.956
  618   2HG   GLU  84          HG3       GLU  84 -21.033  30.167  -2.314
  619    H    TYR  85           H        TYR  85 -21.184  27.896  -4.552
  620    HA   TYR  85           HA       TYR  85 -22.271  25.232  -4.013
  621   1HB   TYR  85          HB2       TYR  85 -20.004  26.212  -5.739
  622   2HB   TYR  85          HB3       TYR  85 -20.445  24.547  -5.560
  623    HD1  TYR  85           HD1      TYR  85 -23.222  24.229  -5.814
  624    HD2  TYR  85           HD2      TYR  85 -20.735  27.168  -7.755
  625    HE1  TYR  85           HE1      TYR  85 -24.784  24.269  -7.752
  626    HE2  TYR  85           HE2      TYR  85 -22.280  27.188  -9.681
  627    HH   TYR  85           HH       TYR  85 -24.197  26.313 -10.608
  628    H    ILE  86           H        ILE  86 -21.894  25.258  -1.731
  629    HA   ILE  86           HA       ILE  86 -19.122  25.090  -0.727
  630    HB   ILE  86           HB       ILE  86 -21.679  24.310   0.691
  631   1HG1  ILE  86          2HG1      ILE  86 -20.180  26.974   0.584
  632   2HG1  ILE  86          3HG1      ILE  86 -21.833  26.643   0.059
  633   1HG2  ILE  86          1HG2      ILE  86 -19.587  23.287   1.659
  634   2HG2  ILE  86          2HG2      ILE  86 -18.874  24.900   1.762
  635   3HG2  ILE  86          3HG2      ILE  86 -20.301  24.472   2.720
  636   1HD1  ILE  86          1HD1      ILE  86 -22.478  26.170   2.412
  637   2HD1  ILE  86          2HD1      ILE  86 -20.843  26.695   2.931
  638   3HD1  ILE  86          3HD1      ILE  86 -21.935  27.833   2.099
  639    H    CYS  87           H        CYS  87 -17.888  23.280  -0.664
  640    HA   CYS  87           HA       CYS  87 -19.122  20.705  -1.475
  641   1HB   CYS  87          HB2       CYS  87 -17.346  20.433  -3.160
  642   2HB   CYS  87          HB3       CYS  87 -18.322  21.896  -3.444
  643    H    ILE  88           H        ILE  88 -18.239  18.834  -0.860
  644    HA   ILE  88           HA       ILE  88 -16.175  18.942   1.312
  645    HB   ILE  88           HB       ILE  88 -18.835  17.440   1.385
  646   1HG1  ILE  88          2HG1      ILE  88 -19.081  19.141   3.485
  647   2HG1  ILE  88          3HG1      ILE  88 -18.110  20.172   2.497
  648   1HG2  ILE  88          1HG2      ILE  88 -17.028  16.359   2.680
  649   2HG2  ILE  88          2HG2      ILE  88 -16.690  17.875   3.519
  650   3HG2  ILE  88          3HG2      ILE  88 -18.226  17.037   3.788
  651   1HD1  ILE  88          1HD1      ILE  88 -19.909  19.932   0.671
  652   2HD1  ILE  88          2HD1      ILE  88 -20.825  18.942   1.814
  653   3HD1  ILE  88          3HD1      ILE  88 -20.511  20.630   2.183
  654    H    ALA  89           H        ALA  89 -14.807  17.218   1.392
  655    HA   ALA  89           HA       ALA  89 -15.299  14.800  -0.299
  656   1HB   ALA  89          HB1       ALA  89 -12.710  16.398   0.005
  657   2HB   ALA  89          HB2       ALA  89 -12.909  14.871  -0.906
  658   3HB   ALA  89          HB3       ALA  89 -13.762  16.337  -1.467
  659    H    GLU  90           H        GLU  90 -14.518  12.895   0.500
  660    HA   GLU  90           HA       GLU  90 -13.305  12.775   3.247
  661   1HB   GLU  90          HB2       GLU  90 -15.842  12.872   3.333
  662   2HB   GLU  90          HB3       GLU  90 -15.869  11.373   2.368
  663   1HG   GLU  90          HG2       GLU  90 -14.554  10.231   4.188
  664   2HG   GLU  90          HG3       GLU  90 -14.643  11.701   5.147
  665    H    ASN  91           H        ASN  91 -12.075  10.913   3.564
  666    HA   ASN  91           HA       ASN  91 -12.592   8.561   1.926
  667   1HB   ASN  91          HB2       ASN  91 -10.567   8.194   0.868
  668   2HB   ASN  91          HB3       ASN  91 -10.945   9.847   0.523
  669   1HD2  ASN  91          1HD2      ASN  91  -7.360   9.928   1.176
  670   2HD2  ASN  91          2HD2      ASN  91  -8.450   9.263  -0.042
  671    H    LYS  92           H        LYS  92 -10.421   6.959   2.667
  672    HA   LYS  92           HA       LYS  92 -11.210   6.300   5.379
  673   1HB   LYS  92          HB2       LYS  92  -8.948   4.769   4.744
  674   2HB   LYS  92          HB3       LYS  92 -10.592   4.270   4.794
  675   1HG   LYS  92          HG2       LYS  92  -9.101   5.327   2.362
  676   2HG   LYS  92          HG3       LYS  92  -9.407   3.632   2.747
  677   1HD   LYS  92          HD2       LYS  92 -11.423   5.681   1.768
  678   2HD   LYS  92          HD3       LYS  92 -10.912   4.180   0.992
  679   1HE   LYS  92          HE2       LYS  92 -11.934   2.889   2.935
  680   2HE   LYS  92          HE3       LYS  92 -12.522   4.437   3.570
  681   1HZ   LYS  92          HZ1       LYS  92 -13.772   4.725   1.496
  682   2HZ   LYS  92          HZ2       LYS  92 -13.251   3.295   0.914
  683   3HZ   LYS  92          HZ3       LYS  92 -14.233   3.357   2.247
  684    H    ALA  93           H        ALA  93  -8.796   8.385   4.254
  685    HA   ALA  93           HA       ALA  93  -7.134   8.175   6.712
  686   1HB   ALA  93          HB1       ALA  93  -6.684   9.650   4.083
  687   2HB   ALA  93          HB2       ALA  93  -5.503   9.458   5.400
  688   3HB   ALA  93          HB3       ALA  93  -6.034   8.037   4.485
  689    H    GLY  94           H        GLY  94  -9.445  10.398   5.150
  690   1HA   GLY  94          HA2       GLY  94  -9.807  11.916   7.514
  691   2HA   GLY  94          HA3       GLY  94  -8.633  12.758   6.508
  692    H    GLU  95           H        GLU  95 -10.129  14.498   6.427
  693    HA   GLU  95           HA       GLU  95 -12.333  14.339   4.447
  694   1HB   GLU  95          HB2       GLU  95 -13.205  13.640   6.750
  695   2HB   GLU  95          HB3       GLU  95 -12.789  15.250   7.318
  696   1HG   GLU  95          HG2       GLU  95 -14.340  16.174   5.535
  697   2HG   GLU  95          HG3       GLU  95 -14.859  14.520   5.220
  698    H    GLN  96           H        GLN  96 -12.945  16.424   3.663
  699    HA   GLN  96           HA       GLN  96 -11.487  18.846   4.519
  700   1HB   GLN  96          HB2       GLN  96 -10.104  17.137   2.967
  701   2HB   GLN  96          HB3       GLN  96 -11.079  17.828   1.691
  702   1HG   GLN  96          HG2       GLN  96  -9.029  19.075   1.724
  703   2HG   GLN  96          HG3       GLN  96 -10.224  20.135   2.479
  704   1HE2  GLN  96          1HE2      GLN  96  -7.360  18.374   4.893
  705   2HE2  GLN  96          2HE2      GLN  96  -7.772  17.635   3.336
  706    H    ASP  97           H        ASP  97 -12.077  20.762   3.183
  707    HA   ASP  97           HA       ASP  97 -14.409  20.567   1.439
  708   1HB   ASP  97          HB2       ASP  97 -15.905  21.933   2.801
  709   2HB   ASP  97          HB3       ASP  97 -15.427  20.506   3.702
  710    H    ALA  98           H        ALA  98 -15.074  22.427   0.368
  711    HA   ALA  98           HA       ALA  98 -13.551  24.935   0.601
  712   1HB   ALA  98          HB1       ALA  98 -13.568  23.326  -2.000
  713   2HB   ALA  98          HB2       ALA  98 -12.823  24.906  -1.765
  714   3HB   ALA  98          HB3       ALA  98 -12.178  23.507  -0.919
  715    H    THR  99           H        THR  99 -14.477  26.440  -1.441
  716    HA   THR  99           HA       THR  99 -17.395  26.057  -1.824
  717    HB   THR  99           HB       THR  99 -16.129  28.317  -0.295
  718    HG1  THR  99           HG1      THR  99 -16.919  26.207   0.647
  719   1HG2  THR  99          1HG2      THR  99 -19.031  28.086  -1.306
  720   2HG2  THR  99          2HG2      THR  99 -18.478  29.212  -0.060
  721   3HG2  THR  99          3HG2      THR  99 -17.859  29.373  -1.696
  722    H    ILE 100           H        ILE 100 -18.003  26.718  -3.761
  723    HA   ILE 100           HA       ILE 100 -16.532  28.899  -5.213
  724    HB   ILE 100           HB       ILE 100 -18.473  27.419  -6.854
  725   1HG1  ILE 100          2HG1      ILE 100 -16.021  25.773  -6.127
  726   2HG1  ILE 100          3HG1      ILE 100 -17.648  25.455  -5.548
  727   1HG2  ILE 100          1HG2      ILE 100 -16.772  29.130  -7.596
  728   2HG2  ILE 100          2HG2      ILE 100 -15.517  27.880  -7.306
  729   3HG2  ILE 100          3HG2      ILE 100 -16.772  27.632  -8.548
  730   1HD1  ILE 100          1HD1      ILE 100 -16.823  25.383  -8.451
  731   2HD1  ILE 100          2HD1      ILE 100 -17.223  24.011  -7.420
  732   3HD1  ILE 100          3HD1      ILE 100 -18.491  25.175  -7.831
  733    H    HIS 101           H        HIS 101 -18.169  30.153  -6.711
  734    HA   HIS 101           HA       HIS 101 -20.946  30.207  -5.711
  735   1HB   HIS 101          HB2       HIS 101 -19.561  31.881  -4.412
  736   2HB   HIS 101          HB3       HIS 101 -19.269  32.727  -5.939
  737    HD1  HIS 101           HD1      HIS 101 -21.691  32.768  -3.107
  738    HD2  HIS 101           HD2      HIS 101 -21.575  33.738  -7.215
  739    HE1  HIS 101           HE1      HIS 101 -23.686  34.254  -3.562
  740    H    LEU 102           H        LEU 102 -22.409  31.054  -7.271
  741    HA   LEU 102           HA       LEU 102 -21.367  31.711  -9.980
  742   1HB   LEU 102          HB2       LEU 102 -21.850  29.347 -10.052
  743   2HB   LEU 102          HB3       LEU 102 -23.396  29.576  -9.217
  744    HG   LEU 102           HG       LEU 102 -24.307  30.781 -11.187
  745   1HD1  LEU 102          1HD1      LEU 102 -22.184  31.701 -12.125
  746   2HD1  LEU 102          2HD1      LEU 102 -21.684  30.056 -12.589
  747   3HD1  LEU 102          3HD1      LEU 102 -23.116  30.798 -13.333
  748   1HD2  LEU 102          1HD2      LEU 102 -23.090  28.095 -11.921
  749   2HD2  LEU 102          2HD2      LEU 102 -24.554  28.350 -10.943
  750   3HD2  LEU 102          3HD2      LEU 102 -24.535  28.842 -12.638
  751    H    LYS 103           H        LYS 103 -22.104  33.702 -10.365
  752    HA   LYS 103           HA       LYS 103 -24.861  34.559  -9.559
  753   1HB   LYS 103          HB2       LYS 103 -22.553  36.005 -10.958
  754   2HB   LYS 103          HB3       LYS 103 -24.135  36.724 -10.571
  755   1HG   LYS 103          HG2       LYS 103 -23.714  36.381  -8.176
  756   2HG   LYS 103          HG3       LYS 103 -22.184  35.561  -8.511
  757   1HD   LYS 103          HD2       LYS 103 -21.739  37.805  -7.771
  758   2HD   LYS 103          HD3       LYS 103 -21.250  37.628  -9.468
  759   1HE   LYS 103          HE2       LYS 103 -23.387  38.740 -10.162
  760   2HE   LYS 103          HE3       LYS 103 -23.845  38.900  -8.472
  761   1HZ   LYS 103          HZ1       LYS 103 -21.434  40.142  -9.682
  762   2HZ   LYS 103          HZ2       LYS 103 -22.814  40.934  -9.308
  763   3HZ   LYS 103          HZ3       LYS 103 -21.914  40.286  -8.110
  764    H    VAL 104           H        VAL 104 -26.435  35.091 -11.133
  765    HA   VAL 104           HA       VAL 104 -25.861  34.448 -13.988
  766    HB   VAL 104           HB       VAL 104 -28.314  33.498 -12.426
  767   1HG1  VAL 104          1HG1      VAL 104 -28.802  34.048 -14.795
  768   2HG1  VAL 104          2HG1      VAL 104 -27.455  33.037 -15.345
  769   3HG1  VAL 104          3HG1      VAL 104 -28.839  32.312 -14.560
  770   1HG2  VAL 104          1HG2      VAL 104 -26.448  32.083 -11.794
  771   2HG2  VAL 104          2HG2      VAL 104 -27.479  31.189 -12.918
  772   3HG2  VAL 104          3HG2      VAL 104 -25.958  31.890 -13.494
  773    H    PHE 105           H        PHE 105 -26.582  35.944 -15.381
  774    HA   PHE 105           HA       PHE 105 -28.772  37.794 -14.596
  775   1HB   PHE 105          HB2       PHE 105 -27.461  39.387 -16.112
  776   2HB   PHE 105          HB3       PHE 105 -26.963  39.199 -14.442
  777    HD1  PHE 105           HD1      PHE 105 -26.155  38.095 -17.962
  778    HD2  PHE 105           HD2      PHE 105 -24.720  38.727 -13.948
  779    HE1  PHE 105           HE1      PHE 105 -23.837  37.664 -18.723
  780    HE2  PHE 105           HE2      PHE 105 -22.400  38.277 -14.713
  781    HZ   PHE 105           HZ       PHE 105 -21.961  37.705 -17.093
  782    H    ALA 106           H        ALA 106 -29.957  38.677 -16.435
  783    HA   ALA 106           HA       ALA 106 -30.162  36.715 -18.679
  784   1HB   ALA 106          HB1       ALA 106 -32.568  36.985 -18.553
  785   2HB   ALA 106          HB2       ALA 106 -31.937  36.507 -16.980
  786   3HB   ALA 106          HB3       ALA 106 -32.433  38.184 -17.236
  787    H    LYS 107           H        LYS 107 -28.459  38.804 -19.020
  788    HA   LYS 107           HA       LYS 107 -27.843  40.524 -20.336
  789   1HB   LYS 107          HB2       LYS 107 -30.299  39.954 -22.007
  790   2HB   LYS 107          HB3       LYS 107 -28.842  40.839 -22.498
  791   1HG   LYS 107          HG2       LYS 107 -27.458  38.807 -22.177
  792   2HG   LYS 107          HG3       LYS 107 -28.916  37.893 -21.764
  793   1HD   LYS 107          HD2       LYS 107 -28.352  37.437 -24.070
  794   2HD   LYS 107          HD3       LYS 107 -29.865  38.313 -23.999
  795   1HE   LYS 107          HE2       LYS 107 -28.659  40.438 -24.484
  796   2HE   LYS 107          HE3       LYS 107 -27.136  39.554 -24.610
  797   1HZ   LYS 107          HZ1       LYS 107 -28.116  38.298 -26.489
  798   2HZ   LYS 107          HZ2       LYS 107 -29.489  39.131 -26.355
  799   3HZ   LYS 107          HZ3       LYS 107 -28.118  39.890 -26.821
  Start of MODEL   16
    1   1H    GLY   1          H1        GLY   1  -3.922  -0.771   3.114
    2   2H    GLY   1          H2        GLY   1  -2.756   0.026   3.939
    3   3H    GLY   1          H3        GLY   1  -4.300  -0.028   4.507
    4   1HA   GLY   1          HA2       GLY   1  -5.120   1.288   2.709
    5   2HA   GLY   1          HA3       GLY   1  -3.783   2.137   3.532
    6    H    LYS   2           H        LYS   2  -4.783   2.301   0.721
    7    HA   LYS   2           HA       LYS   2  -2.401   1.505  -0.852
    8   1HB   LYS   2          HB2       LYS   2  -4.748   0.996  -1.663
    9   2HB   LYS   2          HB3       LYS   2  -4.984   2.729  -1.854
   10   1HG   LYS   2          HG2       LYS   2  -2.624   1.339  -3.178
   11   2HG   LYS   2          HG3       LYS   2  -4.218   1.212  -3.867
   12   1HD   LYS   2          HD2       LYS   2  -4.451   3.622  -4.124
   13   2HD   LYS   2          HD3       LYS   2  -2.847   3.888  -3.446
   14   1HE   LYS   2          HE2       LYS   2  -3.415   2.254  -5.957
   15   2HE   LYS   2          HE3       LYS   2  -2.968   3.953  -5.957
   16   1HZ   LYS   2          HZ1       LYS   2  -1.012   2.529  -6.292
   17   2HZ   LYS   2          HZ2       LYS   2  -0.873   3.304  -4.840
   18   3HZ   LYS   2          HZ3       LYS   2  -1.313   1.725  -4.913
   19    H    ASP   3           H        ASP   3  -1.038   2.957  -1.749
   20    HA   ASP   3           HA       ASP   3  -1.481   5.841  -1.564
   21   1HB   ASP   3          HB2       ASP   3  -0.433   4.752   0.651
   22   2HB   ASP   3          HB3       ASP   3   1.044   4.865  -0.282
   23    H    ILE   4           H        ILE   4   0.669   6.957  -2.298
   24    HA   ILE   4           HA       ILE   4   1.940   5.487  -4.588
   25    HB   ILE   4           HB       ILE   4   0.919   8.345  -4.448
   26   1HG1  ILE   4          2HG1      ILE   4  -0.774   6.709  -5.117
   27   2HG1  ILE   4          3HG1      ILE   4  -0.399   7.826  -6.396
   28   1HG2  ILE   4          1HG2      ILE   4   1.874   8.600  -6.784
   29   2HG2  ILE   4          2HG2      ILE   4   3.072   8.549  -5.487
   30   3HG2  ILE   4          3HG2      ILE   4   2.789   7.118  -6.493
   31   1HD1  ILE   4          1HD1      ILE   4  -0.736   5.593  -7.269
   32   2HD1  ILE   4          2HD1      ILE   4   0.958   6.060  -7.498
   33   3HD1  ILE   4          3HD1      ILE   4   0.507   4.920  -6.209
   34    H    GLN   5           H        GLN   5   2.340   7.634  -1.826
   35    HA   GLN   5           HA       GLN   5   5.307   7.875  -2.254
   36   1HB   GLN   5          HB2       GLN   5   3.417   9.172  -0.242
   37   2HB   GLN   5          HB3       GLN   5   5.149   9.497  -0.381
   38   1HG   GLN   5          HG2       GLN   5   3.026  10.158  -2.465
   39   2HG   GLN   5          HG3       GLN   5   3.850  11.279  -1.416
   40   1HE2  GLN   5          1HE2      GLN   5   5.443  11.235  -4.852
   41   2HE2  GLN   5          2HE2      GLN   5   3.764  11.324  -4.362
   42    H    VAL   6           H        VAL   6   6.394   7.885   0.158
   43    HA   VAL   6           HA       VAL   6   6.018   5.128   1.141
   44    HB   VAL   6           HB       VAL   6   8.116   7.095   2.115
   45   1HG1  VAL   6          1HG1      VAL   6   9.217   4.874   2.737
   46   2HG1  VAL   6          2HG1      VAL   6   7.719   5.154   3.626
   47   3HG1  VAL   6          3HG1      VAL   6   7.718   4.054   2.229
   48   1HG2  VAL   6          1HG2      VAL   6   9.660   5.849   0.612
   49   2HG2  VAL   6          2HG2      VAL   6   8.284   4.967  -0.056
   50   3HG2  VAL   6          3HG2      VAL   6   8.441   6.711  -0.311
   51    H    ILE   7           H        ILE   7   3.878   5.767   1.700
   52    HA   ILE   7           HA       ILE   7   3.416   6.647   4.503
   53    HB   ILE   7           HB       ILE   7   2.060   7.865   2.062
   54   1HG1  ILE   7          2HG1      ILE   7   4.121   9.159   3.888
   55   2HG1  ILE   7          3HG1      ILE   7   4.296   8.783   2.155
   56   1HG2  ILE   7          1HG2      ILE   7   1.066   9.458   3.851
   57   2HG2  ILE   7          2HG2      ILE   7   0.537   7.807   3.968
   58   3HG2  ILE   7          3HG2      ILE   7   1.814   8.400   5.059
   59   1HD1  ILE   7          1HD1      ILE   7   3.930  11.092   2.241
   60   2HD1  ILE   7          2HD1      ILE   7   2.431  10.382   1.647
   61   3HD1  ILE   7          3HD1      ILE   7   2.565  10.957   3.336
   62    H    VAL   8           H        VAL   8   1.110   6.027   5.110
   63    HA   VAL   8           HA       VAL   8   0.305   3.492   3.707
   64    HB   VAL   8           HB       VAL   8  -0.089   4.422   6.590
   65   1HG1  VAL   8          1HG1      VAL   8  -0.969   2.156   7.077
   66   2HG1  VAL   8          2HG1      VAL   8  -2.018   3.064   5.986
   67   3HG1  VAL   8          3HG1      VAL   8  -0.960   1.792   5.326
   68   1HG2  VAL   8          1HG2      VAL   8   2.225   3.674   6.070
   69   2HG2  VAL   8          2HG2      VAL   8   1.410   2.597   7.184
   70   3HG2  VAL   8          3HG2      VAL   8   1.603   2.144   5.462
   71    H    ASN   9           H        ASN   9  -0.888   6.533   4.935
   72    HA   ASN   9           HA       ASN   9  -3.095   6.561   3.098
   73   1HB   ASN   9          HB2       ASN   9  -4.924   6.673   4.705
   74   2HB   ASN   9          HB3       ASN   9  -4.108   5.162   4.922
   75   1HD2  ASN   9          1HD2      ASN   9  -3.078   4.725   6.945
   76   2HD2  ASN   9          2HD2      ASN   9  -3.223   5.840   8.299
   77    H    VAL  10           H        VAL  10  -4.090   8.491   2.983
   78    HA   VAL  10           HA       VAL  10  -3.037  10.907   4.366
   79    HB   VAL  10           HB       VAL  10  -3.090  10.465   1.346
   80   1HG1  VAL  10          1HG1      VAL  10  -2.135  12.755   1.170
   81   2HG1  VAL  10          2HG1      VAL  10  -3.801  12.731   1.667
   82   3HG1  VAL  10          3HG1      VAL  10  -2.532  13.010   2.883
   83   1HG2  VAL  10          1HG2      VAL  10  -1.069   9.547   2.345
   84   2HG2  VAL  10          2HG2      VAL  10  -0.661  11.025   1.502
   85   3HG2  VAL  10          3HG2      VAL  10  -0.779  11.033   3.261
   86    HA   PRO  11           HA       PRO  11  -7.496  11.794   4.336
   87   1HB   PRO  11          HB2       PRO  11  -6.365  14.550   4.950
   88   2HB   PRO  11          HB3       PRO  11  -7.755  13.720   5.718
   89   1HG   PRO  11          HG2       PRO  11  -5.396  13.742   6.976
   90   2HG   PRO  11          HG3       PRO  11  -6.307  12.227   6.898
   91   1HD   PRO  11          HD2       PRO  11  -4.003  13.146   5.154
   92   2HD   PRO  11          HD3       PRO  11  -4.255  11.569   5.985
   93    HA   PRO  12           HA       PRO  12  -8.174  13.661   0.426
   94   1HB   PRO  12          HB2       PRO  12 -10.506  15.256   1.388
   95   2HB   PRO  12          HB3       PRO  12 -10.414  14.002   0.110
   96   1HG   PRO  12          HG2       PRO  12 -11.540  13.525   2.560
   97   2HG   PRO  12          HG3       PRO  12 -10.632  12.263   1.667
   98   1HD   PRO  12          HD2       PRO  12  -9.691  14.115   3.883
   99   2HD   PRO  12          HD3       PRO  12  -9.440  12.338   3.704
  100    H    SER  13           H        SER  13  -7.963  15.558  -0.838
  101    HA   SER  13           HA       SER  13  -7.098  18.118   0.517
  102   1HB   SER  13          HB2       SER  13  -5.708  16.564  -1.710
  103   2HB   SER  13          HB3       SER  13  -5.246  18.170  -1.105
  104    HG   SER  13           HG       SER  13  -5.331  15.744   0.419
  105    H    VAL  14           H        VAL  14  -9.651  18.003  -0.384
  106    HA   VAL  14           HA       VAL  14  -9.849  18.745  -3.167
  107    HB   VAL  14           HB       VAL  14 -11.657  17.633  -1.854
  108   1HG1  VAL  14          1HG1      VAL  14 -11.679  19.269   0.095
  109   2HG1  VAL  14          2HG1      VAL  14 -12.446  20.448  -0.968
  110   3HG1  VAL  14          3HG1      VAL  14 -13.283  18.926  -0.616
  111   1HG2  VAL  14          1HG2      VAL  14 -12.495  20.127  -3.400
  112   2HG2  VAL  14          2HG2      VAL  14 -12.048  18.555  -4.095
  113   3HG2  VAL  14          3HG2      VAL  14 -13.490  18.692  -3.055
  114    H    ARG  15           H        ARG  15 -10.050  20.583  -4.140
  115    HA   ARG  15           HA       ARG  15  -9.917  23.219  -2.737
  116   1HB   ARG  15          HB2       ARG  15  -8.033  22.123  -4.872
  117   2HB   ARG  15          HB3       ARG  15  -8.210  23.843  -4.563
  118   1HG   ARG  15          HG2       ARG  15  -7.541  23.572  -2.240
  119   2HG   ARG  15          HG3       ARG  15  -7.453  21.815  -2.419
  120   1HD   ARG  15          HD2       ARG  15  -5.695  22.106  -4.181
  121   2HD   ARG  15          HD3       ARG  15  -5.683  23.846  -3.838
  122    HE   ARG  15           HE       ARG  15  -4.674  21.614  -2.155
  123   1HH1  ARG  15          1HH1      ARG  15  -3.309  22.090  -0.491
  124   2HH1  ARG  15          2HH1      ARG  15  -3.247  23.694   0.160
  125   1HH2  ARG  15          1HH2      ARG  15  -5.466  25.034  -2.079
  126   2HH2  ARG  15          2HH2      ARG  15  -4.434  25.315  -0.701
  127    H    ALA  16           H        ALA  16 -10.269  25.020  -4.284
  128    HA   ALA  16           HA       ALA  16 -12.566  24.399  -6.099
  129   1HB   ALA  16          HB1       ALA  16 -13.055  26.763  -5.926
  130   2HB   ALA  16          HB2       ALA  16 -13.004  26.034  -4.324
  131   3HB   ALA  16          HB3       ALA  16 -11.653  27.053  -4.883
  132    H    ARG  17           H        ARG  17 -12.351  24.586  -8.218
  133    HA   ARG  17           HA       ARG  17  -9.698  25.163  -9.406
  134   1HB   ARG  17          HB2       ARG  17 -11.385  23.221  -9.993
  135   2HB   ARG  17          HB3       ARG  17 -12.138  24.457 -11.004
  136   1HG   ARG  17          HG2       ARG  17  -9.916  24.800 -12.153
  137   2HG   ARG  17          HG3       ARG  17  -9.277  23.462 -11.187
  138   1HD   ARG  17          HD2       ARG  17 -11.550  23.321 -13.216
  139   2HD   ARG  17          HD3       ARG  17  -9.917  22.712 -13.426
  140    HE   ARG  17           HE       ARG  17 -11.867  21.607 -11.404
  141   1HH1  ARG  17          1HH1      ARG  17  -9.482  20.830 -13.882
  142   2HH1  ARG  17          2HH1      ARG  17  -9.545  19.140 -13.464
  143   1HH2  ARG  17          1HH2      ARG  17 -11.659  19.586 -10.791
  144   2HH2  ARG  17          2HH2      ARG  17 -10.731  18.458 -11.769
  145    H    GLN  18           H        GLN  18 -12.855  26.573  -9.236
  146    HA   GLN  18           HA       GLN  18 -11.935  29.106 -10.496
  147   1HB   GLN  18          HB2       GLN  18 -14.752  27.893 -10.423
  148   2HB   GLN  18          HB3       GLN  18 -14.412  29.547 -10.954
  149   1HG   GLN  18          HG2       GLN  18 -13.437  26.976 -12.249
  150   2HG   GLN  18          HG3       GLN  18 -14.733  28.023 -12.836
  151   1HE2  GLN  18          1HE2      GLN  18 -11.709  28.811 -14.848
  152   2HE2  GLN  18          2HE2      GLN  18 -12.599  27.340 -14.545
  153    H    SER  19           H        SER  19 -13.503  30.942  -9.496
  154    HA   SER  19           HA       SER  19 -13.810  30.492  -6.536
  155   1HB   SER  19          HB2       SER  19 -12.709  33.006  -7.853
  156   2HB   SER  19          HB3       SER  19 -13.054  32.774  -6.143
  157    HG   SER  19           HG       SER  19 -10.801  32.450  -6.740
  158    H    THR  20           H        THR  20 -14.829  32.605  -9.227
  159    HA   THR  20           HA       THR  20 -17.632  32.617  -8.319
  160    HB   THR  20           HB       THR  20 -16.036  35.217  -8.401
  161    HG1  THR  20           HG1      THR  20 -16.465  33.533  -6.443
  162   1HG2  THR  20          1HG2      THR  20 -18.194  36.220  -7.679
  163   2HG2  THR  20          2HG2      THR  20 -18.265  35.583  -9.310
  164   3HG2  THR  20          3HG2      THR  20 -19.007  34.661  -7.973
  165    H    MET  21           H        MET  21 -18.653  32.217 -10.024
  166    HA   MET  21           HA       MET  21 -17.714  33.057 -12.742
  167   1HB   MET  21          HB2       MET  21 -19.456  30.778 -11.729
  168   2HB   MET  21          HB3       MET  21 -19.250  31.119 -13.437
  169   1HG   MET  21          HG2       MET  21 -16.972  30.515 -11.511
  170   2HG   MET  21          HG3       MET  21 -17.754  29.324 -12.514
  171   1HE   MET  21          HE1       MET  21 -16.625  30.023 -16.127
  172   2HE   MET  21          HE2       MET  21 -17.394  28.891 -14.973
  173   3HE   MET  21          HE3       MET  21 -18.183  30.427 -15.393
  174    H    ASN  22           H        ASN  22 -19.428  33.459 -14.363
  175    HA   ASN  22           HA       ASN  22 -21.935  34.698 -13.324
  176   1HB   ASN  22          HB2       ASN  22 -19.856  35.984 -15.157
  177   2HB   ASN  22          HB3       ASN  22 -21.478  36.615 -14.942
  178   1HD2  ASN  22          1HD2      ASN  22 -18.715  37.464 -12.122
  179   2HD2  ASN  22          2HD2      ASN  22 -18.279  36.506 -13.512
  180    H    ALA  23           H        ALA  23 -23.679  34.654 -14.890
  181    HA   ALA  23           HA       ALA  23 -23.238  33.714 -17.623
  182   1HB   ALA  23          HB1       ALA  23 -24.697  31.944 -15.645
  183   2HB   ALA  23          HB2       ALA  23 -24.495  31.629 -17.371
  184   3HB   ALA  23          HB3       ALA  23 -23.085  31.585 -16.314
  185    H    THR  24           H        THR  24 -25.221  33.608 -18.879
  186    HA   THR  24           HA       THR  24 -27.433  35.288 -17.743
  187    HB   THR  24           HB       THR  24 -26.896  34.898 -20.692
  188    HG1  THR  24           HG1      THR  24 -25.099  35.907 -19.757
  189   1HG2  THR  24          1HG2      THR  24 -29.134  35.781 -20.090
  190   2HG2  THR  24          2HG2      THR  24 -28.376  37.050 -19.106
  191   3HG2  THR  24          3HG2      THR  24 -28.163  37.028 -20.864
  192    H    ALA  25           H        ALA  25 -29.202  34.257 -17.295
  193    HA   ALA  25           HA       ALA  25 -29.858  31.567 -17.996
  194   1HB   ALA  25          HB1       ALA  25 -32.062  32.213 -16.890
  195   2HB   ALA  25          HB2       ALA  25 -30.624  32.633 -15.893
  196   3HB   ALA  25          HB3       ALA  25 -31.479  33.874 -16.831
  197    H    ASN  26           H        ASN  26 -31.542  30.753 -19.222
  198    HA   ASN  26           HA       ASN  26 -33.067  30.453 -20.809
  199   1HB   ASN  26          HB2       ASN  26 -33.548  33.465 -20.832
  200   2HB   ASN  26          HB3       ASN  26 -34.610  32.239 -21.458
  201   1HD2  ASN  26          1HD2      ASN  26 -34.870  33.107 -17.569
  202   2HD2  ASN  26          2HD2      ASN  26 -33.859  34.047 -18.662
  203    H    LEU  27           H        LEU  27 -30.181  31.799 -21.593
  204    HA   LEU  27           HA       LEU  27 -30.722  32.335 -24.429
  205   1HB   LEU  27          HB2       LEU  27 -28.065  32.214 -22.939
  206   2HB   LEU  27          HB3       LEU  27 -28.306  32.760 -24.587
  207    HG   LEU  27           HG       LEU  27 -29.176  34.168 -22.065
  208   1HD1  LEU  27          1HD1      LEU  27 -26.869  34.447 -22.844
  209   2HD1  LEU  27          2HD1      LEU  27 -27.445  34.983 -24.439
  210   3HD1  LEU  27          3HD1      LEU  27 -27.775  35.959 -22.993
  211   1HD2  LEU  27          1HD2      LEU  27 -30.109  35.955 -23.535
  212   2HD2  LEU  27          2HD2      LEU  27 -29.942  34.866 -24.961
  213   3HD2  LEU  27          3HD2      LEU  27 -31.068  34.492 -23.633
  214    H    SER  28           H        SER  28 -30.450  29.481 -22.791
  215    HA   SER  28           HA       SER  28 -30.155  27.332 -23.393
  216   1HB   SER  28          HB2       SER  28 -30.372  28.328 -26.257
  217   2HB   SER  28          HB3       SER  28 -30.498  26.657 -25.743
  218    HG   SER  28           HG       SER  28 -32.190  28.784 -24.883
  219    H    GLN  29           H        GLN  29 -27.831  29.051 -23.030
  220    HA   GLN  29           HA       GLN  29 -25.679  27.822 -24.654
  221   1HB   GLN  29          HB2       GLN  29 -24.233  29.394 -23.593
  222   2HB   GLN  29          HB3       GLN  29 -25.650  30.239 -24.190
  223   1HG   GLN  29          HG2       GLN  29 -26.573  30.254 -21.861
  224   2HG   GLN  29          HG3       GLN  29 -25.114  29.457 -21.266
  225   1HE2  GLN  29          1HE2      GLN  29 -25.012  33.327 -21.147
  226   2HE2  GLN  29          2HE2      GLN  29 -26.381  32.275 -20.814
  227    H    SER  30           H        SER  30 -23.671  27.050 -23.426
  228    HA   SER  30           HA       SER  30 -24.450  25.435 -21.029
  229   1HB   SER  30          HB2       SER  30 -22.747  23.800 -21.695
  230   2HB   SER  30          HB3       SER  30 -24.079  23.906 -22.855
  231    HG   SER  30           HG       SER  30 -22.092  23.853 -23.935
  232    H    VAL  31           H        VAL  31 -22.916  25.199 -19.445
  233    HA   VAL  31           HA       VAL  31 -20.567  27.067 -19.417
  234    HB   VAL  31           HB       VAL  31 -22.865  27.070 -17.411
  235   1HG1  VAL  31          1HG1      VAL  31 -20.769  27.337 -16.147
  236   2HG1  VAL  31          2HG1      VAL  31 -20.226  28.602 -17.273
  237   3HG1  VAL  31          3HG1      VAL  31 -21.623  28.853 -16.224
  238   1HG2  VAL  31          1HG2      VAL  31 -23.323  28.447 -19.393
  239   2HG2  VAL  31          2HG2      VAL  31 -23.070  29.458 -17.976
  240   3HG2  VAL  31          3HG2      VAL  31 -21.756  29.275 -19.185
  241    H    THR  32           H        THR  32 -18.821  26.298 -18.262
  242    HA   THR  32           HA       THR  32 -19.239  23.889 -16.516
  243    HB   THR  32           HB       THR  32 -16.751  24.521 -18.146
  244    HG1  THR  32           HG1      THR  32 -18.486  23.913 -19.452
  245   1HG2  THR  32          1HG2      THR  32 -16.237  23.104 -16.133
  246   2HG2  THR  32          2HG2      THR  32 -17.563  22.009 -16.576
  247   3HG2  THR  32          3HG2      THR  32 -16.128  22.157 -17.621
  248    H    LEU  33           H        LEU  33 -18.328  23.907 -14.529
  249    HA   LEU  33           HA       LEU  33 -16.170  25.728 -13.798
  250   1HB   LEU  33          HB2       LEU  33 -17.183  26.893 -12.038
  251   2HB   LEU  33          HB3       LEU  33 -18.176  27.210 -13.419
  252    HG   LEU  33           HG       LEU  33 -18.848  25.143 -11.265
  253   1HD1  LEU  33          1HD1      LEU  33 -19.830  28.010 -11.604
  254   2HD1  LEU  33          2HD1      LEU  33 -20.344  26.840 -10.376
  255   3HD1  LEU  33          3HD1      LEU  33 -18.670  27.445 -10.356
  256   1HD2  LEU  33          1HD2      LEU  33 -20.122  24.678 -13.266
  257   2HD2  LEU  33          2HD2      LEU  33 -21.186  25.394 -12.084
  258   3HD2  LEU  33          3HD2      LEU  33 -20.560  26.364 -13.449
  259    H    ALA  34           H        ALA  34 -15.423  25.149 -11.420
  260    HA   ALA  34           HA       ALA  34 -16.256  22.406 -10.686
  261   1HB   ALA  34          HB1       ALA  34 -13.546  22.987 -11.973
  262   2HB   ALA  34          HB2       ALA  34 -14.161  21.379 -11.526
  263   3HB   ALA  34          HB3       ALA  34 -14.867  22.324 -12.865
  264    H    CYS  35           H        CYS  35 -15.071  21.303  -9.250
  265    HA   CYS  35           HA       CYS  35 -13.088  22.691  -7.491
  266   1HB   CYS  35          HB2       CYS  35 -15.193  20.624  -6.783
  267   2HB   CYS  35          HB3       CYS  35 -13.744  20.893  -5.820
  268    H    ASP  36           H        ASP  36 -11.577  20.848  -6.515
  269    HA   ASP  36           HA       ASP  36 -11.202  18.574  -8.332
  270   1HB   ASP  36          HB2       ASP  36  -8.931  19.037  -8.930
  271   2HB   ASP  36          HB3       ASP  36  -9.883  20.428  -9.399
  272    H    ALA  37           H        ALA  37 -10.606  16.787  -7.266
  273    HA   ALA  37           HA       ALA  37  -9.756  17.057  -4.428
  274   1HB   ALA  37          HB1       ALA  37 -11.570  14.977  -5.687
  275   2HB   ALA  37          HB2       ALA  37 -11.160  15.115  -3.977
  276   3HB   ALA  37          HB3       ALA  37 -12.144  16.374  -4.748
  277    H    ASP  38           H        ASP  38  -8.567  15.420  -3.514
  278    HA   ASP  38           HA       ASP  38  -7.343  13.237  -5.019
  279   1HB   ASP  38          HB2       ASP  38  -5.962  15.212  -5.664
  280   2HB   ASP  38          HB3       ASP  38  -5.698  15.587  -3.966
  281    H    GLY  39           H        GLY  39  -5.897  11.977  -3.462
  282   1HA   GLY  39          HA2       GLY  39  -5.480  12.203  -0.786
  283   2HA   GLY  39          HA3       GLY  39  -7.159  11.654  -0.804
  284    H    PHE  40           H        PHE  40  -5.314   9.995   0.412
  285    HA   PHE  40           HA       PHE  40  -5.216   7.673  -1.463
  286   1HB   PHE  40          HB2       PHE  40  -2.913   8.419   0.358
  287   2HB   PHE  40          HB3       PHE  40  -3.073   6.993  -0.621
  288    HD1  PHE  40           HD1      PHE  40  -3.629   7.486  -3.256
  289    HD2  PHE  40           HD2      PHE  40  -1.510  10.097  -0.548
  290    HE1  PHE  40           HE1      PHE  40  -2.574   8.632  -5.191
  291    HE2  PHE  40           HE2      PHE  40  -0.357  11.158  -2.470
  292    HZ   PHE  40           HZ       PHE  40  -0.912  10.434  -4.812
  293    HA   PRO  41           HA       PRO  41  -6.124   5.708  -1.604
  294   1HB   PRO  41          HB2       PRO  41  -8.543   4.556  -1.259
  295   2HB   PRO  41          HB3       PRO  41  -7.010   3.779  -0.757
  296   1HG   PRO  41          HG2       PRO  41  -8.952   5.374   0.930
  297   2HG   PRO  41          HG3       PRO  41  -8.237   3.780   1.307
  298   1HD   PRO  41          HD2       PRO  41  -7.214   6.082   2.300
  299   2HD   PRO  41          HD3       PRO  41  -6.110   4.773   1.790
  300    H    GLU  42           H        GLU  42  -7.599   6.218  -3.274
  301    HA   GLU  42           HA       GLU  42  -8.273   8.801  -3.658
  302   1HB   GLU  42          HB2       GLU  42  -9.650   8.122  -5.543
  303   2HB   GLU  42          HB3       GLU  42  -8.179   7.166  -5.456
  304   1HG   GLU  42          HG2       GLU  42  -9.521   5.310  -4.358
  305   2HG   GLU  42          HG3       GLU  42 -10.975   6.266  -4.647
  306    HA   PRO  43           HA       PRO  43 -11.647   9.592  -1.014
  307   1HB   PRO  43          HB2       PRO  43 -12.221  12.182  -1.545
  308   2HB   PRO  43          HB3       PRO  43 -10.624  11.660  -0.934
  309   1HG   PRO  43          HG2       PRO  43 -11.437  12.108  -3.822
  310   2HG   PRO  43          HG3       PRO  43 -10.055  12.862  -2.971
  311   1HD   PRO  43          HD2       PRO  43  -9.696  10.634  -4.463
  312   2HD   PRO  43          HD3       PRO  43  -8.864  10.821  -2.906
  313    H    THR  44           H        THR  44 -13.763  10.196  -0.748
  314    HA   THR  44           HA       THR  44 -15.665   9.890  -3.061
  315    HB   THR  44           HB       THR  44 -16.111   9.552  -0.053
  316    HG1  THR  44           HG1      THR  44 -16.264   7.339  -0.620
  317   1HG2  THR  44          1HG2      THR  44 -17.982   9.026  -2.397
  318   2HG2  THR  44          2HG2      THR  44 -18.249   8.475  -0.735
  319   3HG2  THR  44          3HG2      THR  44 -18.198  10.220  -1.082
  320    H    MET  45           H        MET  45 -17.384  11.589  -3.202
  321    HA   MET  45           HA       MET  45 -17.089  13.957  -1.519
  322   1HB   MET  45          HB2       MET  45 -16.320  15.396  -3.404
  323   2HB   MET  45          HB3       MET  45 -15.122  14.181  -2.932
  324   1HG   MET  45          HG2       MET  45 -16.020  12.699  -4.817
  325   2HG   MET  45          HG3       MET  45 -16.932  14.087  -5.384
  326   1HE   MET  45          HE1       MET  45 -15.856  16.273  -6.397
  327   2HE   MET  45          HE2       MET  45 -14.996  16.524  -4.870
  328   3HE   MET  45          HE3       MET  45 -14.120  16.599  -6.390
  329    H    THR  46           H        THR  46 -18.454  15.700  -1.980
  330    HA   THR  46           HA       THR  46 -20.642  15.516  -3.941
  331    HB   THR  46           HB       THR  46 -22.377  15.881  -2.152
  332    HG1  THR  46           HG1      THR  46 -21.885  15.191  -0.048
  333   1HG2  THR  46          1HG2      THR  46 -21.076  13.143  -1.894
  334   2HG2  THR  46          2HG2      THR  46 -22.785  13.583  -1.589
  335   3HG2  THR  46          3HG2      THR  46 -22.102  13.670  -3.239
  336    H    TRP  47           H        TRP  47 -22.144  17.529  -3.538
  337    HA   TRP  47           HA       TRP  47 -20.935  19.772  -2.154
  338   1HB   TRP  47          HB2       TRP  47 -20.775  21.236  -4.185
  339   2HB   TRP  47          HB3       TRP  47 -19.538  20.080  -3.852
  340    HD1  TRP  47           HD1      TRP  47 -20.062  17.597  -5.476
  341    HE1  TRP  47           HE1      TRP  47 -19.249  17.789  -7.866
  342    HE3  TRP  47           HE3      TRP  47 -20.858  22.591  -6.192
  343    HZ2  TRP  47           HZ2      TRP  47 -18.390  19.921  -9.580
  344    HZ3  TRP  47           HZ3      TRP  47 -19.963  23.710  -8.251
  345    HH2  TRP  47           HH2      TRP  47 -18.693  22.395  -9.906
  346    H    THR  48           H        THR  48 -22.274  21.900  -2.645
  347    HA   THR  48           HA       THR  48 -25.136  21.087  -2.697
  348    HB   THR  48           HB       THR  48 -25.603  22.528  -0.815
  349    HG1  THR  48           HG1      THR  48 -23.858  23.441   0.318
  350   1HG2  THR  48          1HG2      THR  48 -24.853  20.149  -0.380
  351   2HG2  THR  48          2HG2      THR  48 -23.229  20.784  -0.069
  352   3HG2  THR  48          3HG2      THR  48 -24.578  21.278   0.966
  353    H    LYS  49           H        LYS  49 -26.664  22.416  -3.385
  354    HA   LYS  49           HA       LYS  49 -25.910  24.651  -5.218
  355   1HB   LYS  49          HB2       LYS  49 -27.345  22.507  -5.775
  356   2HB   LYS  49          HB3       LYS  49 -28.582  23.268  -4.834
  357   1HG   LYS  49          HG2       LYS  49 -29.185  23.794  -6.978
  358   2HG   LYS  49          HG3       LYS  49 -28.364  25.271  -6.497
  359   1HD   LYS  49          HD2       LYS  49 -26.410  24.673  -7.758
  360   2HD   LYS  49          HD3       LYS  49 -27.027  23.015  -8.031
  361   1HE   LYS  49          HE2       LYS  49 -28.941  24.002  -9.309
  362   2HE   LYS  49          HE3       LYS  49 -28.258  25.599  -9.097
  363   1HZ   LYS  49          HZ1       LYS  49 -27.661  24.659 -11.255
  364   2HZ   LYS  49          HZ2       LYS  49 -26.292  24.768 -10.357
  365   3HZ   LYS  49          HZ3       LYS  49 -27.027  23.314 -10.559
  366    H    ASP  50           H        ASP  50 -25.547  25.530  -2.715
  367    HA   ASP  50           HA       ASP  50 -26.074  26.902  -1.025
  368   1HB   ASP  50          HB2       ASP  50 -26.277  28.379  -3.078
  369   2HB   ASP  50          HB3       ASP  50 -28.004  28.230  -2.944
  370    H    GLY  51           H        GLY  51 -27.723  24.459  -1.148
  371   1HA   GLY  51          HA2       GLY  51 -29.362  24.759   1.083
  372   2HA   GLY  51          HA3       GLY  51 -30.426  25.142  -0.270
  373    H    GLU  52           H        GLU  52 -28.758  22.924  -1.841
  374    HA   GLU  52           HA       GLU  52 -29.809  20.462  -0.594
  375   1HB   GLU  52          HB2       GLU  52 -31.194  19.877  -2.501
  376   2HB   GLU  52          HB3       GLU  52 -31.729  21.382  -1.766
  377   1HG   GLU  52          HG2       GLU  52 -30.540  22.673  -3.605
  378   2HG   GLU  52          HG3       GLU  52 -30.135  21.107  -4.367
  379    HA   PRO  53           HA       PRO  53 -26.205  18.867  -2.329
  380   1HB   PRO  53          HB2       PRO  53 -26.571  16.181  -2.489
  381   2HB   PRO  53          HB3       PRO  53 -26.604  17.064  -0.943
  382   1HG   PRO  53          HG2       PRO  53 -28.979  16.229  -2.631
  383   2HG   PRO  53          HG3       PRO  53 -28.701  15.992  -0.865
  384   1HD   PRO  53          HD2       PRO  53 -30.178  18.074  -1.793
  385   2HD   PRO  53          HD3       PRO  53 -29.109  18.263  -0.379
  386    H    ILE  54           H        ILE  54 -25.094  18.656  -4.086
  387    HA   ILE  54           HA       ILE  54 -26.252  18.139  -6.752
  388    HB   ILE  54           HB       ILE  54 -23.545  19.247  -5.932
  389   1HG1  ILE  54          2HG1      ILE  54 -25.976  20.811  -6.957
  390   2HG1  ILE  54          3HG1      ILE  54 -25.572  20.690  -5.248
  391   1HG2  ILE  54          1HG2      ILE  54 -24.956  19.521  -8.647
  392   2HG2  ILE  54          2HG2      ILE  54 -23.301  20.037  -8.248
  393   3HG2  ILE  54          3HG2      ILE  54 -23.664  18.334  -8.307
  394   1HD1  ILE  54          1HD1      ILE  54 -23.705  21.904  -7.296
  395   2HD1  ILE  54          2HD1      ILE  54 -24.753  22.758  -6.159
  396   3HD1  ILE  54          3HD1      ILE  54 -23.435  21.728  -5.543
  397    H    GLU  55           H        GLU  55 -26.308  15.911  -5.290
  398    HA   GLU  55           HA       GLU  55 -23.946  14.243  -5.623
  399   1HB   GLU  55          HB2       GLU  55 -25.379  12.483  -4.697
  400   2HB   GLU  55          HB3       GLU  55 -25.320  13.915  -3.680
  401   1HG   GLU  55          HG2       GLU  55 -27.594  14.572  -4.491
  402   2HG   GLU  55          HG3       GLU  55 -27.620  13.141  -5.525
  403    H    GLN  56           H        GLN  56 -23.485  12.859  -7.178
  404    HA   GLN  56           HA       GLN  56 -24.596  13.184  -9.718
  405   1HB   GLN  56          HB2       GLN  56 -22.667  11.130  -8.566
  406   2HB   GLN  56          HB3       GLN  56 -23.023  11.221 -10.295
  407   1HG   GLN  56          HG2       GLN  56 -22.280  13.826  -9.067
  408   2HG   GLN  56          HG3       GLN  56 -21.013  12.600  -9.029
  409   1HE2  GLN  56          1HE2      GLN  56 -20.341  12.606 -12.501
  410   2HE2  GLN  56          2HE2      GLN  56 -20.289  11.619 -11.048
  411    H    GLU  57           H        GLU  57 -26.050  11.351  -7.374
  412    HA   GLU  57           HA       GLU  57 -27.122   9.252  -9.203
  413   1HB   GLU  57          HB2       GLU  57 -27.281   9.605  -6.169
  414   2HB   GLU  57          HB3       GLU  57 -28.032   8.286  -7.049
  415   1HG   GLU  57          HG2       GLU  57 -25.745   7.613  -7.906
  416   2HG   GLU  57          HG3       GLU  57 -25.032   8.878  -6.888
  417    H    ASP  58           H        ASP  58 -27.935  12.358  -8.243
  418    HA   ASP  58           HA       ASP  58 -30.818  11.976  -8.953
  419   1HB   ASP  58          HB2       ASP  58 -30.459  11.929  -6.447
  420   2HB   ASP  58          HB3       ASP  58 -29.847  13.553  -6.552
  421    H    ASN  59           H        ASN  59 -27.958  13.757  -9.482
  422    HA   ASN  59           HA       ASN  59 -29.443  16.188 -10.400
  423   1HB   ASN  59          HB2       ASN  59 -26.571  15.865  -9.415
  424   2HB   ASN  59          HB3       ASN  59 -27.161  17.291 -10.259
  425   1HD2  ASN  59          1HD2      ASN  59 -28.284  16.696  -6.412
  426   2HD2  ASN  59          2HD2      ASN  59 -27.593  15.359  -7.346
  427    H    GLU  60           H        GLU  60 -30.056  15.185 -12.293
  428    HA   GLU  60           HA       GLU  60 -28.013  14.889 -14.426
  429   1HB   GLU  60          HB2       GLU  60 -28.798  12.823 -13.114
  430   2HB   GLU  60          HB3       GLU  60 -30.391  13.090 -13.826
  431   1HG   GLU  60          HG2       GLU  60 -29.473  12.779 -16.088
  432   2HG   GLU  60          HG3       GLU  60 -27.842  12.751 -15.424
  433    H    GLU  61           H        GLU  61 -30.660  16.719 -13.603
  434    HA   GLU  61           HA       GLU  61 -32.302  16.447 -15.963
  435   1HB   GLU  61          HB2       GLU  61 -32.280  18.504 -13.729
  436   2HB   GLU  61          HB3       GLU  61 -33.492  18.417 -15.012
  437   1HG   GLU  61          HG2       GLU  61 -33.955  16.029 -14.333
  438   2HG   GLU  61          HG3       GLU  61 -32.877  16.287 -12.945
  439    H    LYS  62           H        LYS  62 -29.682  18.661 -15.152
  440    HA   LYS  62           HA       LYS  62 -29.323  19.249 -17.961
  441   1HB   LYS  62          HB2       LYS  62 -29.473  21.740 -17.752
  442   2HB   LYS  62          HB3       LYS  62 -31.033  20.993 -17.504
  443   1HG   LYS  62          HG2       LYS  62 -30.872  21.262 -15.072
  444   2HG   LYS  62          HG3       LYS  62 -29.214  21.838 -15.193
  445   1HD   LYS  62          HD2       LYS  62 -29.885  23.860 -16.348
  446   2HD   LYS  62          HD3       LYS  62 -31.569  23.294 -16.454
  447   1HE   LYS  62          HE2       LYS  62 -31.836  23.318 -14.050
  448   2HE   LYS  62          HE3       LYS  62 -30.106  23.562 -13.779
  449   1HZ   LYS  62          HZ1       LYS  62 -30.235  25.735 -14.589
  450   2HZ   LYS  62          HZ2       LYS  62 -31.729  25.547 -15.226
  451   3HZ   LYS  62          HZ3       LYS  62 -31.506  25.616 -13.574
  452    H    TYR  63           H        TYR  63 -27.738  17.894 -16.263
  453    HA   TYR  63           HA       TYR  63 -25.249  19.257 -16.259
  454   1HB   TYR  63          HB2       TYR  63 -25.150  19.260 -13.591
  455   2HB   TYR  63          HB3       TYR  63 -25.619  20.631 -14.564
  456    HD1  TYR  63           HD1      TYR  63 -27.138  21.904 -13.411
  457    HD2  TYR  63           HD2      TYR  63 -27.543  17.604 -13.308
  458    HE1  TYR  63           HE1      TYR  63 -29.269  22.131 -12.147
  459    HE2  TYR  63           HE2      TYR  63 -29.712  17.842 -12.063
  460    HH   TYR  63           HH       TYR  63 -31.037  21.033 -11.167
  461    H    SER  64           H        SER  64 -23.486  18.189 -15.272
  462    HA   SER  64           HA       SER  64 -23.487  15.900 -13.642
  463   1HB   SER  64          HB2       SER  64 -23.111  15.346 -16.603
  464   2HB   SER  64          HB3       SER  64 -22.393  14.311 -15.382
  465    HG   SER  64           HG       SER  64 -25.152  14.918 -15.394
  466    H    PHE  65           H        PHE  65 -21.251  15.304 -13.020
  467    HA   PHE  65           HA       PHE  65 -19.083  16.588 -14.519
  468   1HB   PHE  65          HB2       PHE  65 -18.047  17.082 -12.437
  469   2HB   PHE  65          HB3       PHE  65 -19.676  17.681 -12.475
  470    HD1  PHE  65           HD1      PHE  65 -21.249  17.145 -10.755
  471    HD2  PHE  65           HD2      PHE  65 -17.465  15.083 -11.003
  472    HE1  PHE  65           HE1      PHE  65 -21.542  16.329  -8.451
  473    HE2  PHE  65           HE2      PHE  65 -17.775  14.229  -8.699
  474    HZ   PHE  65           HZ       PHE  65 -19.820  14.859  -7.407
  475    H    ASN  66           H        ASN  66 -16.886  15.668 -13.776
  476    HA   ASN  66           HA       ASN  66 -16.972  12.674 -13.896
  477   1HB   ASN  66          HB2       ASN  66 -14.813  12.836 -15.160
  478   2HB   ASN  66          HB3       ASN  66 -16.230  13.419 -16.000
  479   1HD2  ASN  66          1HD2      ASN  66 -13.267  16.093 -14.949
  480   2HD2  ASN  66          2HD2      ASN  66 -13.533  14.714 -13.880
  481    H    TYR  67           H        TYR  67 -15.232  11.527 -12.945
  482    HA   TYR  67           HA       TYR  67 -14.572  12.589 -10.306
  483   1HB   TYR  67          HB2       TYR  67 -14.101   9.842 -11.515
  484   2HB   TYR  67          HB3       TYR  67 -13.995  10.275  -9.793
  485    HD1  TYR  67           HD1      TYR  67 -16.181  11.459  -8.817
  486    HD2  TYR  67           HD2      TYR  67 -16.118   8.899 -12.302
  487    HE1  TYR  67           HE1      TYR  67 -18.651  11.112  -8.634
  488    HE2  TYR  67           HE2      TYR  67 -18.555   8.531 -12.107
  489    HH   TYR  67           HH       TYR  67 -20.462   9.005 -10.866
  490    H    ASP  68           H        ASP  68 -12.308  11.547  -9.414
  491    HA   ASP  68           HA       ASP  68 -10.247  12.343  -9.021
  492   1HB   ASP  68          HB2       ASP  68  -8.493  11.862 -10.551
  493   2HB   ASP  68          HB3       ASP  68  -9.626  10.540 -10.442
  494    H    GLY  69           H        GLY  69 -12.176  14.167  -9.532
  495   1HA   GLY  69          HA2       GLY  69 -11.113  16.757  -9.646
  496   2HA   GLY  69          HA3       GLY  69 -11.651  16.320 -11.306
  497    H    SER  70           H        SER  70 -13.265  18.026 -10.994
  498    HA   SER  70           HA       SER  70 -15.844  16.933 -10.209
  499   1HB   SER  70          HB2       SER  70 -14.689  17.846  -8.042
  500   2HB   SER  70          HB3       SER  70 -15.184  19.422  -8.663
  501    HG   SER  70           HG       SER  70 -16.766  18.454  -7.314
  502    H    GLU  71           H        GLU  71 -14.939  17.744 -12.651
  503    HA   GLU  71           HA       GLU  71 -15.607  20.470 -13.268
  504   1HB   GLU  71          HB2       GLU  71 -15.109  18.091 -15.074
  505   2HB   GLU  71          HB3       GLU  71 -15.277  19.764 -15.619
  506   1HG   GLU  71          HG2       GLU  71 -13.265  20.434 -14.447
  507   2HG   GLU  71          HG3       GLU  71 -13.178  18.920 -13.570
  508    H    LEU  72           H        LEU  72 -17.666  20.985 -12.627
  509    HA   LEU  72           HA       LEU  72 -19.986  19.413 -13.518
  510   1HB   LEU  72          HB2       LEU  72 -19.975  20.313 -11.270
  511   2HB   LEU  72          HB3       LEU  72 -19.679  21.949 -11.902
  512    HG   LEU  72           HG       LEU  72 -21.929  21.916 -12.975
  513   1HD1  LEU  72          1HD1      LEU  72 -22.317  19.494 -13.284
  514   2HD1  LEU  72          2HD1      LEU  72 -22.215  19.243 -11.529
  515   3HD1  LEU  72          3HD1      LEU  72 -23.564  20.181 -12.210
  516   1HD2  LEU  72          1HD2      LEU  72 -23.226  22.079 -10.859
  517   2HD2  LEU  72          2HD2      LEU  72 -21.919  21.259  -9.994
  518   3HD2  LEU  72          3HD2      LEU  72 -21.620  22.849 -10.712
  519    H    ILE  73           H        ILE  73 -20.701  19.549 -15.409
  520    HA   ILE  73           HA       ILE  73 -20.614  22.101 -16.984
  521    HB   ILE  73           HB       ILE  73 -21.386  19.286 -17.833
  522   1HG1  ILE  73          2HG1      ILE  73 -18.786  20.516 -18.779
  523   2HG1  ILE  73          3HG1      ILE  73 -18.786  19.861 -17.151
  524   1HG2  ILE  73          1HG2      ILE  73 -22.374  21.002 -19.240
  525   2HG2  ILE  73          2HG2      ILE  73 -20.839  21.859 -19.413
  526   3HG2  ILE  73          3HG2      ILE  73 -21.048  20.260 -20.152
  527   1HD1  ILE  73          1HD1      ILE  73 -19.527  17.680 -17.897
  528   2HD1  ILE  73          2HD1      ILE  73 -19.587  18.271 -19.585
  529   3HD1  ILE  73          3HD1      ILE  73 -18.044  18.182 -18.704
  530    H    ILE  74           H        ILE  74 -22.447  23.196 -17.232
  531    HA   ILE  74           HA       ILE  74 -25.102  21.999 -16.504
  532    HB   ILE  74           HB       ILE  74 -24.031  24.845 -16.139
  533   1HG1  ILE  74          2HG1      ILE  74 -25.288  22.967 -14.107
  534   2HG1  ILE  74          3HG1      ILE  74 -23.559  23.014 -14.395
  535   1HG2  ILE  74          1HG2      ILE  74 -26.897  23.826 -15.805
  536   2HG2  ILE  74          2HG2      ILE  74 -26.308  25.419 -15.315
  537   3HG2  ILE  74          3HG2      ILE  74 -26.334  25.004 -17.017
  538   1HD1  ILE  74          1HD1      ILE  74 -23.966  24.342 -12.481
  539   2HD1  ILE  74          2HD1      ILE  74 -23.472  25.417 -13.788
  540   3HD1  ILE  74          3HD1      ILE  74 -25.199  25.315 -13.338
  541    H    LYS  75           H        LYS  75 -26.637  22.104 -18.077
  542    HA   LYS  75           HA       LYS  75 -25.958  23.654 -20.551
  543   1HB   LYS  75          HB2       LYS  75 -27.145  22.119 -21.901
  544   2HB   LYS  75          HB3       LYS  75 -26.005  21.236 -20.907
  545   1HG   LYS  75          HG2       LYS  75 -27.805  19.869 -20.916
  546   2HG   LYS  75          HG3       LYS  75 -27.989  20.680 -19.363
  547   1HD   LYS  75          HD2       LYS  75 -29.753  22.138 -20.345
  548   2HD   LYS  75          HD3       LYS  75 -29.465  21.459 -21.944
  549   1HE   LYS  75          HE2       LYS  75 -30.520  19.907 -19.542
  550   2HE   LYS  75          HE3       LYS  75 -31.523  20.625 -20.790
  551   1HZ   LYS  75          HZ1       LYS  75 -29.507  18.484 -21.242
  552   2HZ   LYS  75          HZ2       LYS  75 -31.138  18.295 -21.254
  553   3HZ   LYS  75          HZ3       LYS  75 -30.428  19.158 -22.430
  554    H    LYS  76           H        LYS  76 -27.478  24.661 -21.615
  555    HA   LYS  76           HA       LYS  76 -28.978  26.124 -22.134
  556   1HB   LYS  76          HB2       LYS  76 -31.247  25.795 -21.946
  557   2HB   LYS  76          HB3       LYS  76 -30.517  24.189 -21.922
  558   1HG   LYS  76          HG2       LYS  76 -30.925  24.092 -19.446
  559   2HG   LYS  76          HG3       LYS  76 -31.606  25.738 -19.506
  560   1HD   LYS  76          HD2       LYS  76 -33.335  24.950 -21.083
  561   2HD   LYS  76          HD3       LYS  76 -32.654  23.331 -21.068
  562   1HE   LYS  76          HE2       LYS  76 -34.560  23.280 -19.663
  563   2HE   LYS  76          HE3       LYS  76 -33.153  23.179 -18.594
  564   1HZ   LYS  76          HZ1       LYS  76 -33.432  25.477 -17.988
  565   2HZ   LYS  76          HZ2       LYS  76 -34.589  25.730 -19.106
  566   3HZ   LYS  76          HZ3       LYS  76 -34.888  24.757 -17.842
  567    H    VAL  77           H        VAL  77 -28.845  25.858 -18.720
  568    HA   VAL  77           HA       VAL  77 -28.475  27.227 -17.003
  569    HB   VAL  77           HB       VAL  77 -27.799  29.261 -19.124
  570   1HG1  VAL  77          1HG1      VAL  77 -28.236  30.449 -16.991
  571   2HG1  VAL  77          2HG1      VAL  77 -27.150  29.332 -16.134
  572   3HG1  VAL  77          3HG1      VAL  77 -26.531  30.449 -17.380
  573   1HG2  VAL  77          1HG2      VAL  77 -25.459  28.663 -18.578
  574   2HG2  VAL  77          2HG2      VAL  77 -26.017  27.481 -17.381
  575   3HG2  VAL  77          3HG2      VAL  77 -26.346  27.232 -19.118
  576    H    ASP  78           H        ASP  78 -29.722  28.130 -15.535
  577    HA   ASP  78           HA       ASP  78 -31.845  30.076 -16.317
  578   1HB   ASP  78          HB2       ASP  78 -32.289  27.706 -14.528
  579   2HB   ASP  78          HB3       ASP  78 -33.478  28.880 -14.978
  580    H    LYS  79           H        LYS  79 -32.760  31.178 -14.311
  581    HA   LYS  79           HA       LYS  79 -30.800  32.080 -12.447
  582   1HB   LYS  79          HB2       LYS  79 -33.853  32.137 -12.383
  583   2HB   LYS  79          HB3       LYS  79 -32.817  33.002 -11.233
  584   1HG   LYS  79          HG2       LYS  79 -31.810  34.307 -13.056
  585   2HG   LYS  79          HG3       LYS  79 -32.833  33.438 -14.257
  586   1HD   LYS  79          HD2       LYS  79 -34.860  34.323 -13.044
  587   2HD   LYS  79          HD3       LYS  79 -33.796  35.227 -11.959
  588   1HE   LYS  79          HE2       LYS  79 -32.899  36.492 -13.907
  589   2HE   LYS  79          HE3       LYS  79 -33.977  35.570 -14.984
  590   1HZ   LYS  79          HZ1       LYS  79 -34.912  37.361 -12.800
  591   2HZ   LYS  79          HZ2       LYS  79 -34.949  37.718 -14.388
  592   3HZ   LYS  79          HZ3       LYS  79 -35.882  36.502 -13.812
  593    H    SER  80           H        SER  80 -32.525  29.097 -12.384
  594    HA   SER  80           HA       SER  80 -32.265  28.587  -9.544
  595   1HB   SER  80          HB2       SER  80 -32.882  26.305 -10.203
  596   2HB   SER  80          HB3       SER  80 -33.983  27.509 -10.921
  597    HG   SER  80           HG       SER  80 -33.390  25.971 -12.458
  598    H    ASP  81           H        ASP  81 -29.956  28.686 -12.107
  599    HA   ASP  81           HA       ASP  81 -28.059  26.899 -10.724
  600   1HB   ASP  81          HB2       ASP  81 -27.745  28.615 -13.226
  601   2HB   ASP  81          HB3       ASP  81 -26.524  27.529 -12.549
  602    H    GLU  82           H        GLU  82 -29.061  30.044 -10.109
  603    HA   GLU  82           HA       GLU  82 -26.509  31.204  -9.365
  604   1HB   GLU  82          HB2       GLU  82 -28.486  32.631  -9.665
  605   2HB   GLU  82          HB3       GLU  82 -29.314  31.833  -8.316
  606   1HG   GLU  82          HG2       GLU  82 -27.648  32.607  -6.747
  607   2HG   GLU  82          HG3       GLU  82 -26.667  33.280  -8.074
  608    H    ALA  83           H        ALA  83 -25.184  30.472  -7.784
  609    HA   ALA  83           HA       ALA  83 -26.222  29.034  -5.400
  610   1HB   ALA  83          HB1       ALA  83 -26.288  27.283  -7.171
  611   2HB   ALA  83          HB2       ALA  83 -24.637  27.762  -7.699
  612   3HB   ALA  83          HB3       ALA  83 -24.921  26.980  -6.106
  613    H    GLU  84           H        GLU  84 -24.728  28.611  -3.861
  614    HA   GLU  84           HA       GLU  84 -21.938  29.620  -4.182
  615   1HB   GLU  84          HB2       GLU  84 -23.162  30.947  -2.514
  616   2HB   GLU  84          HB3       GLU  84 -23.493  29.471  -1.579
  617   1HG   GLU  84          HG2       GLU  84 -21.219  29.188  -1.012
  618   2HG   GLU  84          HG3       GLU  84 -20.638  30.048  -2.423
  619    H    TYR  85           H        TYR  85 -21.063  27.888  -4.968
  620    HA   TYR  85           HA       TYR  85 -21.917  25.187  -4.377
  621   1HB   TYR  85          HB2       TYR  85 -19.872  26.458  -6.195
  622   2HB   TYR  85          HB3       TYR  85 -20.039  24.715  -6.065
  623    HD1  TYR  85           HD1      TYR  85 -22.675  23.933  -6.279
  624    HD2  TYR  85           HD2      TYR  85 -20.955  27.463  -8.017
  625    HE1  TYR  85           HE1      TYR  85 -24.302  23.786  -8.177
  626    HE2  TYR  85           HE2      TYR  85 -22.639  27.356  -9.848
  627    HH   TYR  85           HH       TYR  85 -24.485  26.309 -10.698
  628    H    ILE  86           H        ILE  86 -21.408  25.073  -2.112
  629    HA   ILE  86           HA       ILE  86 -18.580  24.910  -1.294
  630    HB   ILE  86           HB       ILE  86 -21.135  24.091   0.161
  631   1HG1  ILE  86          2HG1      ILE  86 -19.377  26.577   0.457
  632   2HG1  ILE  86          3HG1      ILE  86 -20.919  26.554  -0.381
  633   1HG2  ILE  86          1HG2      ILE  86 -18.223  24.416   1.138
  634   2HG2  ILE  86          2HG2      ILE  86 -19.617  24.092   2.174
  635   3HG2  ILE  86          3HG2      ILE  86 -19.122  22.879   1.009
  636   1HD1  ILE  86          1HD1      ILE  86 -22.047  25.811   1.764
  637   2HD1  ILE  86          2HD1      ILE  86 -20.507  26.109   2.598
  638   3HD1  ILE  86          3HD1      ILE  86 -21.316  27.446   1.786
  639    H    CYS  87           H        CYS  87 -17.348  23.134  -1.506
  640    HA   CYS  87           HA       CYS  87 -18.602  20.543  -2.196
  641   1HB   CYS  87          HB2       CYS  87 -16.915  20.176  -3.881
  642   2HB   CYS  87          HB3       CYS  87 -17.726  21.679  -4.168
  643    H    ILE  88           H        ILE  88 -17.942  18.755  -1.268
  644    HA   ILE  88           HA       ILE  88 -15.863  18.942   0.871
  645    HB   ILE  88           HB       ILE  88 -18.588  17.595   0.933
  646   1HG1  ILE  88          2HG1      ILE  88 -17.581  20.047   2.438
  647   2HG1  ILE  88          3HG1      ILE  88 -18.765  20.040   1.132
  648   1HG2  ILE  88          1HG2      ILE  88 -18.083  17.053   3.313
  649   2HG2  ILE  88          2HG2      ILE  88 -16.899  16.301   2.258
  650   3HG2  ILE  88          3HG2      ILE  88 -16.472  17.776   3.137
  651   1HD1  ILE  88          1HD1      ILE  88 -19.174  18.903   3.908
  652   2HD1  ILE  88          2HD1      ILE  88 -19.987  20.286   3.172
  653   3HD1  ILE  88          3HD1      ILE  88 -20.285  18.633   2.553
  654    H    ALA  89           H        ALA  89 -14.489  17.246   1.049
  655    HA   ALA  89           HA       ALA  89 -15.079  14.772  -0.497
  656   1HB   ALA  89          HB1       ALA  89 -12.616  14.535  -0.828
  657   2HB   ALA  89          HB2       ALA  89 -13.277  15.934  -1.669
  658   3HB   ALA  89          HB3       ALA  89 -12.392  16.160  -0.149
  659    H    GLU  90           H        GLU  90 -14.326  12.866   0.431
  660    HA   GLU  90           HA       GLU  90 -13.533  12.821   3.314
  661   1HB   GLU  90          HB2       GLU  90 -15.999  13.060   3.177
  662   2HB   GLU  90          HB3       GLU  90 -16.105  11.710   2.050
  663   1HG   GLU  90          HG2       GLU  90 -15.293  10.173   3.799
  664   2HG   GLU  90          HG3       GLU  90 -15.084  11.511   4.923
  665    H    ASN  91           H        ASN  91 -12.431  10.953   3.880
  666    HA   ASN  91           HA       ASN  91 -12.836   8.507   2.360
  667   1HB   ASN  91          HB2       ASN  91 -10.677   8.026   1.611
  668   2HB   ASN  91          HB3       ASN  91 -11.005   9.671   1.068
  669   1HD2  ASN  91          1HD2      ASN  91  -7.530   9.708   2.214
  670   2HD2  ASN  91          2HD2      ASN  91  -8.472   8.986   0.901
  671    H    LYS  92           H        LYS  92 -10.813   6.926   3.451
  672    HA   LYS  92           HA       LYS  92 -11.877   6.486   6.108
  673   1HB   LYS  92          HB2       LYS  92  -9.593   4.861   5.844
  674   2HB   LYS  92          HB3       LYS  92 -11.255   4.384   5.676
  675   1HG   LYS  92          HG2       LYS  92  -9.462   5.349   3.390
  676   2HG   LYS  92          HG3       LYS  92  -9.722   3.661   3.861
  677   1HD   LYS  92          HD2       LYS  92 -11.722   5.543   2.520
  678   2HD   LYS  92          HD3       LYS  92 -11.000   4.045   1.915
  679   1HE   LYS  92          HE2       LYS  92 -12.147   2.748   3.674
  680   2HE   LYS  92          HE3       LYS  92 -12.932   4.197   4.262
  681   1HZ   LYS  92          HZ1       LYS  92 -14.390   2.991   2.730
  682   2HZ   LYS  92          HZ2       LYS  92 -13.991   4.434   2.071
  683   3HZ   LYS  92          HZ3       LYS  92 -13.292   3.053   1.546
  684    H    ALA  93           H        ALA  93  -9.280   8.434   5.058
  685    HA   ALA  93           HA       ALA  93  -7.845   8.366   7.668
  686   1HB   ALA  93          HB1       ALA  93  -6.532   8.123   5.626
  687   2HB   ALA  93          HB2       ALA  93  -7.154   9.635   4.975
  688   3HB   ALA  93          HB3       ALA  93  -6.119   9.632   6.406
  689    H    GLY  94           H        GLY  94  -9.871  10.575   5.688
  690   1HA   GLY  94          HA2       GLY  94 -10.630  12.117   7.963
  691   2HA   GLY  94          HA3       GLY  94  -9.371  12.989   7.097
  692    H    GLU  95           H        GLU  95 -10.741  14.663   6.746
  693    HA   GLU  95           HA       GLU  95 -12.698  14.455   4.494
  694   1HB   GLU  95          HB2       GLU  95 -13.221  15.341   7.351
  695   2HB   GLU  95          HB3       GLU  95 -14.040  16.189   6.037
  696   1HG   GLU  95          HG2       GLU  95 -15.102  14.203   5.258
  697   2HG   GLU  95          HG3       GLU  95 -14.175  13.174   6.342
  698    H    GLN  96           H        GLN  96 -13.030  16.505   3.501
  699    HA   GLN  96           HA       GLN  96 -11.489  18.867   4.353
  700   1HB   GLN  96          HB2       GLN  96 -10.098  17.102   2.915
  701   2HB   GLN  96          HB3       GLN  96 -10.994  17.749   1.575
  702   1HG   GLN  96          HG2       GLN  96  -8.887  18.896   1.706
  703   2HG   GLN  96          HG3       GLN  96 -10.100  20.057   2.197
  704   1HE2  GLN  96          1HE2      GLN  96  -7.977  17.543   3.657
  705   2HE2  GLN  96          2HE2      GLN  96  -7.579  18.483   5.099
  706    H    ASP  97           H        ASP  97 -11.907  20.807   2.886
  707    HA   ASP  97           HA       ASP  97 -14.136  20.575   1.014
  708   1HB   ASP  97          HB2       ASP  97 -15.649  22.036   2.113
  709   2HB   ASP  97          HB3       ASP  97 -15.239  20.765   3.250
  710    H    ALA  98           H        ALA  98 -14.638  22.379  -0.225
  711    HA   ALA  98           HA       ALA  98 -13.115  24.891  -0.012
  712   1HB   ALA  98          HB1       ALA  98 -13.038  23.267  -2.569
  713   2HB   ALA  98          HB2       ALA  98 -12.298  24.869  -2.303
  714   3HB   ALA  98          HB3       ALA  98 -11.685  23.446  -1.447
  715    H    THR  99           H        THR  99 -13.969  26.465  -1.933
  716    HA   THR  99           HA       THR  99 -16.925  26.072  -2.332
  717    HB   THR  99           HB       THR  99 -15.639  28.454  -0.955
  718    HG1  THR  99           HG1      THR  99 -15.770  26.746   0.464
  719   1HG2  THR  99          1HG2      THR  99 -18.051  29.008  -0.433
  720   2HG2  THR  99          2HG2      THR  99 -17.612  29.187  -2.143
  721   3HG2  THR  99          3HG2      THR  99 -18.545  27.761  -1.590
  722    H    ILE 100           H        ILE 100 -17.622  26.771  -4.197
  723    HA   ILE 100           HA       ILE 100 -16.220  28.952  -5.711
  724    HB   ILE 100           HB       ILE 100 -18.223  27.424  -7.251
  725   1HG1  ILE 100          2HG1      ILE 100 -15.676  25.896  -6.635
  726   2HG1  ILE 100          3HG1      ILE 100 -17.287  25.468  -5.994
  727   1HG2  ILE 100          1HG2      ILE 100 -16.626  27.692  -9.023
  728   2HG2  ILE 100          2HG2      ILE 100 -16.608  29.200  -8.114
  729   3HG2  ILE 100          3HG2      ILE 100 -15.304  28.022  -7.865
  730   1HD1  ILE 100          1HD1      ILE 100 -16.464  25.422  -8.909
  731   2HD1  ILE 100          2HD1      ILE 100 -16.879  24.061  -7.865
  732   3HD1  ILE 100          3HD1      ILE 100 -18.143  25.241  -8.289
  733    H    HIS 101           H        HIS 101 -17.930  30.178  -7.108
  734    HA   HIS 101           HA       HIS 101 -20.653  30.222  -5.988
  735   1HB   HIS 101          HB2       HIS 101 -19.168  31.910  -4.805
  736   2HB   HIS 101          HB3       HIS 101 -19.038  32.775  -6.335
  737    HD1  HIS 101           HD1      HIS 101 -21.195  32.618  -3.285
  738    HD2  HIS 101           HD2      HIS 101 -21.496  33.738  -7.348
  739    HE1  HIS 101           HE1      HIS 101 -23.244  34.095  -3.489
  740    H    LEU 102           H        LEU 102 -22.206  30.942  -7.491
  741    HA   LEU 102           HA       LEU 102 -21.329  31.773 -10.207
  742   1HB   LEU 102          HB2       LEU 102 -21.673  29.410 -10.332
  743   2HB   LEU 102          HB3       LEU 102 -23.235  29.519  -9.480
  744    HG   LEU 102           HG       LEU 102 -24.235  30.609 -11.416
  745   1HD1  LEU 102          1HD1      LEU 102 -21.522  30.519 -12.772
  746   2HD1  LEU 102          2HD1      LEU 102 -23.053  31.027 -13.512
  747   3HD1  LEU 102          3HD1      LEU 102 -22.359  31.997 -12.214
  748   1HD2  LEU 102          1HD2      LEU 102 -23.957  28.862 -13.121
  749   2HD2  LEU 102          2HD2      LEU 102 -22.474  28.271 -12.309
  750   3HD2  LEU 102          3HD2      LEU 102 -24.057  28.169 -11.525
  751    H    LYS 103           H        LYS 103 -22.116  33.745 -10.365
  752    HA   LYS 103           HA       LYS 103 -24.872  34.481  -9.438
  753   1HB   LYS 103          HB2       LYS 103 -22.595  36.044 -10.722
  754   2HB   LYS 103          HB3       LYS 103 -24.193  36.717 -10.504
  755   1HG   LYS 103          HG2       LYS 103 -22.371  35.735  -8.254
  756   2HG   LYS 103          HG3       LYS 103 -22.593  37.418  -8.743
  757   1HD   LYS 103          HD2       LYS 103 -24.800  35.616  -7.634
  758   2HD   LYS 103          HD3       LYS 103 -23.858  36.784  -6.697
  759   1HE   LYS 103          HE2       LYS 103 -24.700  38.657  -7.976
  760   2HE   LYS 103          HE3       LYS 103 -25.488  37.598  -9.133
  761   1HZ   LYS 103          HZ1       LYS 103 -27.027  38.505  -7.465
  762   2HZ   LYS 103          HZ2       LYS 103 -27.021  36.872  -7.439
  763   3HZ   LYS 103          HZ3       LYS 103 -26.213  37.719  -6.272
  764    H    VAL 104           H        VAL 104 -26.576  34.837 -10.767
  765    HA   VAL 104           HA       VAL 104 -26.192  34.426 -13.698
  766    HB   VAL 104           HB       VAL 104 -28.396  33.217 -12.019
  767   1HG1  VAL 104          1HG1      VAL 104 -29.265  33.765 -14.248
  768   2HG1  VAL 104          2HG1      VAL 104 -27.799  33.087 -15.007
  769   3HG1  VAL 104          3HG1      VAL 104 -28.957  32.034 -14.168
  770   1HG2  VAL 104          1HG2      VAL 104 -27.432  31.018 -12.745
  771   2HG2  VAL 104          2HG2      VAL 104 -26.059  31.878 -13.472
  772   3HG2  VAL 104          3HG2      VAL 104 -26.323  31.929 -11.722
  773    H    PHE 105           H        PHE 105 -27.086  35.924 -14.953
  774    HA   PHE 105           HA       PHE 105 -29.334  37.618 -13.984
  775   1HB   PHE 105          HB2       PHE 105 -28.200  39.292 -15.577
  776   2HB   PHE 105          HB3       PHE 105 -27.618  39.086 -13.920
  777    HD1  PHE 105           HD1      PHE 105 -25.437  38.297 -13.473
  778    HD2  PHE 105           HD2      PHE 105 -26.833  38.497 -17.551
  779    HE1  PHE 105           HE1      PHE 105 -23.117  38.032 -14.284
  780    HE2  PHE 105           HE2      PHE 105 -24.488  38.296 -18.354
  781    HZ   PHE 105           HZ       PHE 105 -22.628  37.979 -16.733
  782    H    ALA 106           H        ALA 106 -30.226  38.776 -16.207
  783    HA   ALA 106           HA       ALA 106 -30.654  36.685 -18.256
  784   1HB   ALA 106          HB1       ALA 106 -32.227  36.190 -16.398
  785   2HB   ALA 106          HB2       ALA 106 -32.915  37.840 -16.539
  786   3HB   ALA 106          HB3       ALA 106 -33.108  36.666 -17.877
  787    H    LYS 107           H        LYS 107 -29.400  39.160 -18.376
  788    HA   LYS 107           HA       LYS 107 -30.397  40.244 -20.824
  789   1HB   LYS 107          HB2       LYS 107 -30.871  42.549 -20.061
  790   2HB   LYS 107          HB3       LYS 107 -32.052  41.403 -19.405
  791   1HG   LYS 107          HG2       LYS 107 -30.831  41.382 -17.240
  792   2HG   LYS 107          HG3       LYS 107 -29.689  42.596 -17.896
  793   1HD   LYS 107          HD2       LYS 107 -31.577  44.178 -18.203
  794   2HD   LYS 107          HD3       LYS 107 -32.713  42.978 -17.614
  795   1HE   LYS 107          HE2       LYS 107 -32.294  44.441 -15.801
  796   2HE   LYS 107          HE3       LYS 107 -31.488  42.899 -15.435
  797   1HZ   LYS 107          HZ1       LYS 107 -29.377  43.945 -16.128
  798   2HZ   LYS 107          HZ2       LYS 107 -30.134  45.357 -16.476
  799   3HZ   LYS 107          HZ3       LYS 107 -30.050  44.819 -14.938
  Start of MODEL   17
    1   1H    GLY   1          H1        GLY   1   2.961  -2.497   1.804
    2   2H    GLY   1          H2        GLY   1   2.763  -3.143   3.300
    3   3H    GLY   1          H3        GLY   1   1.465  -2.624   2.411
    4   1HA   GLY   1          HA2       GLY   1   3.636  -0.902   3.430
    5   2HA   GLY   1          HA3       GLY   1   2.200  -0.364   2.546
    6    H    LYS   2           H        LYS   2   1.714   1.016   4.338
    7    HA   LYS   2           HA       LYS   2  -0.085  -0.102   6.355
    8   1HB   LYS   2          HB2       LYS   2   2.717   0.605   6.975
    9   2HB   LYS   2          HB3       LYS   2   1.597   1.625   7.876
   10   1HG   LYS   2          HG2       LYS   2   1.400  -1.412   7.833
   11   2HG   LYS   2          HG3       LYS   2   2.360  -0.504   9.025
   12   1HD   LYS   2          HD2       LYS   2   0.393   0.634   9.874
   13   2HD   LYS   2          HD3       LYS   2  -0.617  -0.095   8.636
   14   1HE   LYS   2          HE2       LYS   2  -0.964  -1.333  10.664
   15   2HE   LYS   2          HE3       LYS   2  -0.087  -2.364   9.544
   16   1HZ   LYS   2          HZ1       LYS   2   0.836  -2.452  11.786
   17   2HZ   LYS   2          HZ2       LYS   2   1.943  -1.872  10.780
   18   3HZ   LYS   2          HZ3       LYS   2   1.153  -0.843  11.773
   19    H    ASP   3           H        ASP   3  -1.230   1.548   7.540
   20    HA   ASP   3           HA       ASP   3  -1.869   3.872   5.834
   21   1HB   ASP   3          HB2       ASP   3  -3.270   2.650   8.246
   22   2HB   ASP   3          HB3       ASP   3  -3.934   3.876   7.169
   23    H    ILE   4           H        ILE   4  -0.009   3.357   8.663
   24    HA   ILE   4           HA       ILE   4  -0.866   5.774  10.114
   25    HB   ILE   4           HB       ILE   4   1.166   3.624  10.751
   26   1HG1  ILE   4          2HG1      ILE   4  -1.695   4.074  11.768
   27   2HG1  ILE   4          3HG1      ILE   4  -1.210   2.839  10.597
   28   1HG2  ILE   4          1HG2      ILE   4   0.025   5.808  12.560
   29   2HG2  ILE   4          2HG2      ILE   4   1.097   4.498  13.067
   30   3HG2  ILE   4          3HG2      ILE   4   1.714   5.704  11.973
   31   1HD1  ILE   4          1HD1      ILE   4   0.260   1.788  12.326
   32   2HD1  ILE   4          2HD1      ILE   4  -0.417   2.912  13.526
   33   3HD1  ILE   4          3HD1      ILE   4  -1.483   1.777  12.723
   34    H    GLN   5           H        GLN   5   2.026   4.738   8.362
   35    HA   GLN   5           HA       GLN   5   3.097   7.451   8.322
   36   1HB   GLN   5          HB2       GLN   5   5.143   6.926   9.581
   37   2HB   GLN   5          HB3       GLN   5   3.699   6.809  10.581
   38   1HG   GLN   5          HG2       GLN   5   3.693   4.362  10.435
   39   2HG   GLN   5          HG3       GLN   5   5.053   4.391   9.324
   40   1HE2  GLN   5          1HE2      GLN   5   6.287   3.710  12.809
   41   2HE2  GLN   5          2HE2      GLN   5   5.052   2.974  11.803
   42    H    VAL   6           H        VAL   6   2.374   5.687   6.303
   43    HA   VAL   6           HA       VAL   6   4.929   5.477   4.756
   44    HB   VAL   6           HB       VAL   6   2.798   3.314   4.606
   45   1HG1  VAL   6          1HG1      VAL   6   4.088   3.495   2.539
   46   2HG1  VAL   6          2HG1      VAL   6   5.621   3.503   3.451
   47   3HG1  VAL   6          3HG1      VAL   6   4.628   2.057   3.405
   48   1HG2  VAL   6          1HG2      VAL   6   4.444   1.815   5.690
   49   2HG2  VAL   6          2HG2      VAL   6   5.473   3.211   6.061
   50   3HG2  VAL   6          3HG2      VAL   6   3.870   3.077   6.783
   51    H    ILE   7           H        ILE   7   4.641   5.778   2.483
   52    HA   ILE   7           HA       ILE   7   2.484   7.638   1.886
   53    HB   ILE   7           HB       ILE   7   4.653   6.645   0.004
   54   1HG1  ILE   7          2HG1      ILE   7   5.809   7.636   1.889
   55   2HG1  ILE   7          3HG1      ILE   7   5.871   8.735   0.533
   56   1HG2  ILE   7          1HG2      ILE   7   2.849   7.737  -1.204
   57   2HG2  ILE   7          2HG2      ILE   7   2.706   9.014  -0.003
   58   3HG2  ILE   7          3HG2      ILE   7   4.123   8.928  -1.093
   59   1HD1  ILE   7          1HD1      ILE   7   4.090  10.166   1.557
   60   2HD1  ILE   7          2HD1      ILE   7   4.038   9.034   2.965
   61   3HD1  ILE   7          3HD1      ILE   7   5.499   9.972   2.605
   62    H    VAL   8           H        VAL   8   0.781   6.380   2.154
   63    HA   VAL   8           HA       VAL   8  -0.289   4.879  -0.170
   64    HB   VAL   8           HB       VAL   8  -0.479   3.750   2.650
   65   1HG1  VAL   8          1HG1      VAL   8  -2.377   3.165   1.175
   66   2HG1  VAL   8          2HG1      VAL   8  -1.252   2.601  -0.068
   67   3HG1  VAL   8          3HG1      VAL   8  -1.323   1.738   1.467
   68   1HG2  VAL   8          1HG2      VAL   8   1.334   2.821   0.389
   69   2HG2  VAL   8          2HG2      VAL   8   1.832   3.401   1.984
   70   3HG2  VAL   8          3HG2      VAL   8   0.973   1.877   1.880
   71    H    ASN   9           H        ASN   9  -0.807   6.282   3.020
   72    HA   ASN   9           HA       ASN   9  -3.630   7.015   2.357
   73   1HB   ASN   9          HB2       ASN   9  -2.031   6.760   4.895
   74   2HB   ASN   9          HB3       ASN   9  -3.398   7.846   4.835
   75   1HD2  ASN   9          1HD2      ASN   9  -2.881   4.554   3.439
   76   2HD2  ASN   9          2HD2      ASN   9  -4.257   3.863   4.295
   77    H    VAL  10           H        VAL  10  -4.163   8.981   1.768
   78    HA   VAL  10           HA       VAL  10  -2.563  11.395   2.389
   79    HB   VAL  10           HB       VAL  10  -3.450  10.602  -0.405
   80   1HG1  VAL  10          1HG1      VAL  10  -3.765  13.022  -0.097
   81   2HG1  VAL  10          2HG1      VAL  10  -2.114  13.154   0.569
   82   3HG1  VAL  10          3HG1      VAL  10  -2.391  12.730  -1.138
   83   1HG2  VAL  10          1HG2      VAL  10  -1.323   9.527   0.171
   84   2HG2  VAL  10          2HG2      VAL  10  -1.027  10.798  -1.000
   85   3HG2  VAL  10          3HG2      VAL  10  -0.677  11.075   0.726
   86    HA   PRO  11           HA       PRO  11  -6.868  12.306   3.349
   87   1HB   PRO  11          HB2       PRO  11  -5.664  15.095   3.511
   88   2HB   PRO  11          HB3       PRO  11  -6.864  14.344   4.590
   89   1HG   PRO  11          HG2       PRO  11  -4.285  14.416   5.345
   90   2HG   PRO  11          HG3       PRO  11  -5.193  12.871   5.499
   91   1HD   PRO  11          HD2       PRO  11  -3.295  13.678   3.294
   92   2HD   PRO  11          HD3       PRO  11  -3.412  12.133   4.217
   93    HA   PRO  12           HA       PRO  12  -8.504  13.992  -0.444
   94   1HB   PRO  12          HB2       PRO  12 -10.797  15.271   0.912
   95   2HB   PRO  12          HB3       PRO  12 -10.783  13.907  -0.241
   96   1HG   PRO  12          HG2       PRO  12 -11.296  13.597   2.440
   97   2HG   PRO  12          HG3       PRO  12 -10.441  12.339   1.479
   98   1HD   PRO  12          HD2       PRO  12  -9.261  14.552   3.221
   99   2HD   PRO  12          HD3       PRO  12  -8.895  12.816   3.264
  100    H    SER  13           H        SER  13  -7.374  15.665  -1.284
  101    HA   SER  13           HA       SER  13  -6.983  18.210   0.190
  102   1HB   SER  13          HB2       SER  13  -5.694  17.133  -2.333
  103   2HB   SER  13          HB3       SER  13  -5.227  18.593  -1.482
  104    HG   SER  13           HG       SER  13  -5.210  16.003  -0.296
  105    H    VAL  14           H        VAL  14  -9.583  18.143  -0.438
  106    HA   VAL  14           HA       VAL  14 -10.192  19.082  -3.088
  107    HB   VAL  14           HB       VAL  14 -11.834  17.886  -1.778
  108   1HG1  VAL  14          1HG1      VAL  14 -12.169  20.343   0.000
  109   2HG1  VAL  14          2HG1      VAL  14 -13.087  18.838   0.057
  110   3HG1  VAL  14          3HG1      VAL  14 -11.356  18.832   0.492
  111   1HG2  VAL  14          1HG2      VAL  14 -12.539  19.487  -3.564
  112   2HG2  VAL  14          2HG2      VAL  14 -13.769  19.188  -2.335
  113   3HG2  VAL  14          3HG2      VAL  14 -12.840  20.693  -2.298
  114    H    ARG  15           H        ARG  15 -10.050  20.927  -3.986
  115    HA   ARG  15           HA       ARG  15 -10.213  23.464  -2.425
  116   1HB   ARG  15          HB2       ARG  15  -8.260  22.713  -4.609
  117   2HB   ARG  15          HB3       ARG  15  -8.694  24.391  -4.395
  118   1HG   ARG  15          HG2       ARG  15  -7.239  22.623  -2.447
  119   2HG   ARG  15          HG3       ARG  15  -6.694  24.061  -3.304
  120   1HD   ARG  15          HD2       ARG  15  -6.909  24.859  -1.158
  121   2HD   ARG  15          HD3       ARG  15  -8.392  25.409  -1.973
  122    HE   ARG  15           HE       ARG  15  -8.753  22.835  -0.681
  123   1HH1  ARG  15          1HH1      ARG  15  -8.734  26.251   0.212
  124   2HH1  ARG  15          2HH1      ARG  15  -9.917  25.926   1.467
  125   1HH2  ARG  15          1HH2      ARG  15 -10.220  22.615   0.637
  126   2HH2  ARG  15          2HH2      ARG  15 -10.863  23.893   1.641
  127    H    ALA  16           H        ALA  16 -10.513  25.276  -3.892
  128    HA   ALA  16           HA       ALA  16 -12.838  24.825  -5.707
  129   1HB   ALA  16          HB1       ALA  16 -11.822  27.284  -4.232
  130   2HB   ALA  16          HB2       ALA  16 -13.114  27.315  -5.439
  131   3HB   ALA  16          HB3       ALA  16 -13.332  26.366  -3.954
  132    H    ARG  17           H        ARG  17 -12.421  24.695  -7.807
  133    HA   ARG  17           HA       ARG  17  -9.816  25.521  -8.857
  134   1HB   ARG  17          HB2       ARG  17 -11.291  23.379  -9.437
  135   2HB   ARG  17          HB3       ARG  17 -11.940  24.442 -10.688
  136   1HG   ARG  17          HG2       ARG  17  -9.566  24.893 -11.473
  137   2HG   ARG  17          HG3       ARG  17  -8.997  23.838 -10.195
  138   1HD   ARG  17          HD2       ARG  17  -8.876  22.631 -12.245
  139   2HD   ARG  17          HD3       ARG  17 -10.088  21.915 -11.193
  140    HE   ARG  17           HE       ARG  17 -11.468  22.023 -13.003
  141   1HH1  ARG  17          1HH1      ARG  17 -11.984  22.417 -15.139
  142   2HH1  ARG  17          2HH1      ARG  17 -11.604  23.989 -15.791
  143   1HH2  ARG  17          1HH2      ARG  17  -9.549  24.958 -13.265
  144   2HH2  ARG  17          2HH2      ARG  17 -10.181  25.331 -14.835
  145    H    GLN  18           H        GLN  18 -12.651  27.147  -8.431
  146    HA   GLN  18           HA       GLN  18 -11.686  29.560  -9.695
  147   1HB   GLN  18          HB2       GLN  18 -13.691  27.957 -11.115
  148   2HB   GLN  18          HB3       GLN  18 -14.400  29.453 -10.549
  149   1HG   GLN  18          HG2       GLN  18 -11.780  29.365 -12.093
  150   2HG   GLN  18          HG3       GLN  18 -13.353  29.484 -12.884
  151   1HE2  GLN  18          1HE2      GLN  18 -13.822  32.917 -12.006
  152   2HE2  GLN  18          2HE2      GLN  18 -14.548  31.462 -12.698
  153    H    SER  19           H        SER  19 -12.814  31.452  -8.818
  154    HA   SER  19           HA       SER  19 -13.880  30.883  -6.102
  155   1HB   SER  19          HB2       SER  19 -13.531  33.299  -5.765
  156   2HB   SER  19          HB3       SER  19 -12.044  32.440  -6.209
  157    HG   SER  19           HG       SER  19 -12.270  34.390  -7.389
  158    H    THR  20           H        THR  20 -14.803  32.798  -8.908
  159    HA   THR  20           HA       THR  20 -17.712  32.713  -8.220
  160    HB   THR  20           HB       THR  20 -16.115  35.239  -8.742
  161    HG1  THR  20           HG1      THR  20 -16.747  35.750  -6.691
  162   1HG2  THR  20          1HG2      THR  20 -19.120  34.811  -8.309
  163   2HG2  THR  20          2HG2      THR  20 -18.307  36.407  -8.342
  164   3HG2  THR  20          3HG2      THR  20 -18.355  35.401  -9.786
  165    H    MET  21           H        MET  21 -18.574  31.765  -9.908
  166    HA   MET  21           HA       MET  21 -17.704  32.308 -12.703
  167   1HB   MET  21          HB2       MET  21 -19.561  30.242 -11.436
  168   2HB   MET  21          HB3       MET  21 -19.283  30.393 -13.177
  169   1HG   MET  21          HG2       MET  21 -17.149  29.776 -11.070
  170   2HG   MET  21          HG3       MET  21 -17.890  28.595 -12.130
  171   1HE   MET  21          HE1       MET  21 -17.553  28.395 -14.655
  172   2HE   MET  21          HE2       MET  21 -17.956  30.095 -15.003
  173   3HE   MET  21          HE3       MET  21 -16.457  29.391 -15.632
  174    H    ASN  22           H        ASN  22 -19.458  32.588 -14.320
  175    HA   ASN  22           HA       ASN  22 -22.037  33.645 -13.507
  176   1HB   ASN  22          HB2       ASN  22 -21.730  35.904 -14.369
  177   2HB   ASN  22          HB3       ASN  22 -20.672  35.613 -13.015
  178   1HD2  ASN  22          1HD2      ASN  22 -17.705  36.130 -14.948
  179   2HD2  ASN  22          2HD2      ASN  22 -18.374  35.643 -13.389
  180    H    ALA  23           H        ALA  23 -23.437  34.150 -15.345
  181    HA   ALA  23           HA       ALA  23 -22.651  33.567 -18.058
  182   1HB   ALA  23          HB1       ALA  23 -24.106  31.392 -16.476
  183   2HB   ALA  23          HB2       ALA  23 -24.019  31.434 -18.246
  184   3HB   ALA  23          HB3       ALA  23 -22.549  31.269 -17.312
  185    H    THR  24           H        THR  24 -24.533  33.442 -19.532
  186    HA   THR  24           HA       THR  24 -26.491  35.504 -18.709
  187    HB   THR  24           HB       THR  24 -26.151  34.395 -21.525
  188    HG1  THR  24           HG1      THR  24 -24.135  35.155 -20.803
  189   1HG2  THR  24          1HG2      THR  24 -26.914  36.706 -22.067
  190   2HG2  THR  24          2HG2      THR  24 -28.113  35.780 -21.160
  191   3HG2  THR  24          3HG2      THR  24 -27.153  37.011 -20.338
  192    H    ALA  25           H        ALA  25 -28.514  34.963 -18.149
  193    HA   ALA  25           HA       ALA  25 -29.498  32.280 -18.405
  194   1HB   ALA  25          HB1       ALA  25 -30.013  33.808 -16.495
  195   2HB   ALA  25          HB2       ALA  25 -30.869  34.895 -17.592
  196   3HB   ALA  25          HB3       ALA  25 -31.502  33.279 -17.286
  197    H    ASN  26           H        ASN  26 -31.203  31.437 -19.495
  198    HA   ASN  26           HA       ASN  26 -32.830  31.053 -20.940
  199   1HB   ASN  26          HB2       ASN  26 -33.759  33.066 -19.693
  200   2HB   ASN  26          HB3       ASN  26 -33.312  34.047 -21.089
  201   1HD2  ASN  26          1HD2      ASN  26 -36.447  31.339 -21.266
  202   2HD2  ASN  26          2HD2      ASN  26 -35.091  31.074 -20.147
  203    H    LEU  27           H        LEU  27 -30.048  32.200 -22.012
  204    HA   LEU  27           HA       LEU  27 -30.771  32.284 -24.913
  205   1HB   LEU  27          HB2       LEU  27 -28.105  32.755 -23.541
  206   2HB   LEU  27          HB3       LEU  27 -28.440  32.889 -25.271
  207    HG   LEU  27           HG       LEU  27 -29.484  34.705 -23.063
  208   1HD1  LEU  27          1HD1      LEU  27 -27.115  35.006 -23.823
  209   2HD1  LEU  27          2HD1      LEU  27 -27.717  35.263 -25.470
  210   3HD1  LEU  27          3HD1      LEU  27 -28.157  36.395 -24.171
  211   1HD2  LEU  27          1HD2      LEU  27 -30.119  34.738 -26.044
  212   2HD2  LEU  27          2HD2      LEU  27 -31.282  34.480 -24.748
  213   3HD2  LEU  27          3HD2      LEU  27 -30.490  36.057 -24.892
  214    H    SER  28           H        SER  28 -30.597  29.889 -22.844
  215    HA   SER  28           HA       SER  28 -30.057  27.703 -22.818
  216   1HB   SER  28          HB2       SER  28 -29.819  27.942 -25.848
  217   2HB   SER  28          HB3       SER  28 -29.930  26.440 -24.911
  218    HG   SER  28           HG       SER  28 -31.967  27.217 -25.774
  219    H    GLN  29           H        GLN  29 -27.904  29.593 -22.414
  220    HA   GLN  29           HA       GLN  29 -25.491  28.710 -23.652
  221   1HB   GLN  29          HB2       GLN  29 -26.147  30.940 -22.496
  222   2HB   GLN  29          HB3       GLN  29 -25.625  30.153 -21.000
  223   1HG   GLN  29          HG2       GLN  29 -23.357  29.951 -21.878
  224   2HG   GLN  29          HG3       GLN  29 -23.913  30.414 -23.503
  225   1HE2  GLN  29          1HE2      GLN  29 -23.409  33.841 -22.850
  226   2HE2  GLN  29          2HE2      GLN  29 -23.556  32.562 -24.027
  227    H    SER  30           H        SER  30 -23.599  27.935 -22.378
  228    HA   SER  30           HA       SER  30 -24.212  25.842 -20.330
  229   1HB   SER  30          HB2       SER  30 -22.648  24.323 -21.490
  230   2HB   SER  30          HB3       SER  30 -24.085  24.687 -22.470
  231    HG   SER  30           HG       SER  30 -22.131  24.810 -23.682
  232    H    VAL  31           H        VAL  31 -22.426  25.130 -19.106
  233    HA   VAL  31           HA       VAL  31 -20.100  27.003 -18.842
  234    HB   VAL  31           HB       VAL  31 -22.117  26.623 -16.602
  235   1HG1  VAL  31          1HG1      VAL  31 -19.865  26.915 -15.672
  236   2HG1  VAL  31          2HG1      VAL  31 -19.565  28.308 -16.742
  237   3HG1  VAL  31          3HG1      VAL  31 -20.787  28.393 -15.450
  238   1HG2  VAL  31          1HG2      VAL  31 -21.556  29.157 -18.201
  239   2HG2  VAL  31          2HG2      VAL  31 -23.059  28.208 -18.263
  240   3HG2  VAL  31          3HG2      VAL  31 -22.617  28.989 -16.757
  241    H    THR  32           H        THR  32 -18.297  25.939 -18.129
  242    HA   THR  32           HA       THR  32 -18.624  23.422 -16.557
  243    HB   THR  32           HB       THR  32 -16.101  24.394 -17.929
  244    HG1  THR  32           HG1      THR  32 -16.547  22.850 -19.475
  245   1HG2  THR  32          1HG2      THR  32 -15.406  21.998 -17.614
  246   2HG2  THR  32          2HG2      THR  32 -15.575  22.872 -16.097
  247   3HG2  THR  32          3HG2      THR  32 -16.852  21.756 -16.618
  248    H    LEU  33           H        LEU  33 -17.939  23.381 -14.498
  249    HA   LEU  33           HA       LEU  33 -16.002  25.298 -13.419
  250   1HB   LEU  33          HB2       LEU  33 -17.586  26.051 -11.637
  251   2HB   LEU  33          HB3       LEU  33 -17.906  26.645 -13.245
  252    HG   LEU  33           HG       LEU  33 -19.815  25.062 -13.527
  253   1HD1  LEU  33          1HD1      LEU  33 -19.187  24.410 -10.619
  254   2HD1  LEU  33          2HD1      LEU  33 -20.739  24.077 -11.392
  255   3HD1  LEU  33          3HD1      LEU  33 -19.283  23.277 -11.986
  256   1HD2  LEU  33          1HD2      LEU  33 -21.258  26.261 -11.920
  257   2HD2  LEU  33          2HD2      LEU  33 -19.841  26.893 -11.086
  258   3HD2  LEU  33          3HD2      LEU  33 -20.163  27.333 -12.774
  259    H    ALA  34           H        ALA  34 -15.434  24.698 -11.069
  260    HA   ALA  34           HA       ALA  34 -16.006  21.910 -10.463
  261   1HB   ALA  34          HB1       ALA  34 -13.766  21.061 -11.033
  262   2HB   ALA  34          HB2       ALA  34 -14.362  21.933 -12.468
  263   3HB   ALA  34          HB3       ALA  34 -13.187  22.692 -11.394
  264    H    CYS  35           H        CYS  35 -15.347  21.051  -8.661
  265    HA   CYS  35           HA       CYS  35 -13.650  22.627  -6.751
  266   1HB   CYS  35          HB2       CYS  35 -16.038  22.402  -6.062
  267   2HB   CYS  35          HB3       CYS  35 -15.855  20.632  -6.068
  268    H    ASP  36           H        ASP  36 -11.643  21.741  -7.037
  269    HA   ASP  36           HA       ASP  36 -11.330  19.059  -8.123
  270   1HB   ASP  36          HB2       ASP  36  -9.038  19.600  -8.434
  271   2HB   ASP  36          HB3       ASP  36 -10.120  20.782  -9.134
  272    H    ALA  37           H        ALA  37 -12.134  17.776  -6.462
  273    HA   ALA  37           HA       ALA  37 -10.453  17.365  -4.056
  274   1HB   ALA  37          HB1       ALA  37 -12.867  15.824  -5.140
  275   2HB   ALA  37          HB2       ALA  37 -12.118  15.606  -3.551
  276   3HB   ALA  37          HB3       ALA  37 -12.941  17.116  -3.940
  277    H    ASP  38           H        ASP  38  -9.027  15.773  -3.760
  278    HA   ASP  38           HA       ASP  38  -8.837  13.405  -5.440
  279   1HB   ASP  38          HB2       ASP  38  -7.606  15.095  -6.793
  280   2HB   ASP  38          HB3       ASP  38  -6.657  15.559  -5.391
  281    H    GLY  39           H        GLY  39  -7.218  11.871  -4.430
  282   1HA   GLY  39          HA2       GLY  39  -5.689  12.261  -2.102
  283   2HA   GLY  39          HA3       GLY  39  -7.303  11.879  -1.536
  284    H    PHE  40           H        PHE  40  -5.620  10.129  -0.729
  285    HA   PHE  40           HA       PHE  40  -5.952   7.721  -2.458
  286   1HB   PHE  40          HB2       PHE  40  -3.328   8.550  -1.239
  287   2HB   PHE  40          HB3       PHE  40  -3.675   7.002  -1.976
  288    HD1  PHE  40           HD1      PHE  40  -2.970  10.536  -2.637
  289    HD2  PHE  40           HD2      PHE  40  -4.077   6.786  -4.400
  290    HE1  PHE  40           HE1      PHE  40  -2.338  11.446  -4.851
  291    HE2  PHE  40           HE2      PHE  40  -3.468   7.695  -6.663
  292    HZ   PHE  40           HZ       PHE  40  -2.575   9.991  -6.880
  293    HA   PRO  41           HA       PRO  41  -6.616   5.505  -2.196
  294   1HB   PRO  41          HB2       PRO  41  -8.987   4.923  -0.428
  295   2HB   PRO  41          HB3       PRO  41  -8.141   3.854  -1.612
  296   1HG   PRO  41          HG2       PRO  41  -7.661   3.568   1.043
  297   2HG   PRO  41          HG3       PRO  41  -6.280   3.562  -0.119
  298   1HD   PRO  41          HD2       PRO  41  -7.320   5.901   1.526
  299   2HD   PRO  41          HD3       PRO  41  -5.645   5.317   1.356
  300    H    GLU  42           H        GLU  42  -8.483   5.818  -3.627
  301    HA   GLU  42           HA       GLU  42  -9.058   8.426  -4.280
  302   1HB   GLU  42          HB2       GLU  42 -10.767   5.961  -4.804
  303   2HB   GLU  42          HB3       GLU  42 -10.967   7.525  -5.608
  304   1HG   GLU  42          HG2       GLU  42  -8.665   7.366  -6.527
  305   2HG   GLU  42          HG3       GLU  42  -8.468   5.797  -5.767
  306    HA   PRO  43           HA       PRO  43 -11.821   9.583  -1.057
  307   1HB   PRO  43          HB2       PRO  43 -12.313  12.210  -1.644
  308   2HB   PRO  43          HB3       PRO  43 -10.677  11.618  -1.188
  309   1HG   PRO  43          HG2       PRO  43 -11.835  12.033  -3.971
  310   2HG   PRO  43          HG3       PRO  43 -10.288  12.660  -3.333
  311   1HD   PRO  43          HD2       PRO  43 -10.401  10.336  -4.789
  312   2HD   PRO  43          HD3       PRO  43  -9.273  10.518  -3.392
  313    H    THR  44           H        THR  44 -13.878  10.246  -0.490
  314    HA   THR  44           HA       THR  44 -16.065   9.912  -2.561
  315    HB   THR  44           HB       THR  44 -16.214   9.807   0.497
  316    HG1  THR  44           HG1      THR  44 -15.198   7.996  -0.383
  317   1HG2  THR  44          1HG2      THR  44 -18.351  10.518  -0.467
  318   2HG2  THR  44          2HG2      THR  44 -18.302   9.190  -1.656
  319   3HG2  THR  44          3HG2      THR  44 -18.460   8.846   0.091
  320    H    MET  45           H        MET  45 -17.178  11.804  -3.096
  321    HA   MET  45           HA       MET  45 -17.182  14.047  -1.190
  322   1HB   MET  45          HB2       MET  45 -16.115  15.600  -2.682
  323   2HB   MET  45          HB3       MET  45 -15.079  14.208  -2.521
  324   1HG   MET  45          HG2       MET  45 -14.920  14.561  -4.775
  325   2HG   MET  45          HG3       MET  45 -16.207  13.362  -4.698
  326   1HE   MET  45          HE1       MET  45 -16.691  17.852  -5.757
  327   2HE   MET  45          HE2       MET  45 -16.217  17.347  -4.135
  328   3HE   MET  45          HE3       MET  45 -15.156  17.000  -5.524
  329    H    THR  46           H        THR  46 -18.620  15.699  -1.593
  330    HA   THR  46           HA       THR  46 -20.534  15.599  -3.805
  331    HB   THR  46           HB       THR  46 -22.525  15.655  -2.288
  332    HG1  THR  46           HG1      THR  46 -22.329  14.840  -0.205
  333   1HG2  THR  46          1HG2      THR  46 -22.828  13.331  -1.941
  334   2HG2  THR  46          2HG2      THR  46 -21.931  13.574  -3.470
  335   3HG2  THR  46          3HG2      THR  46 -21.070  13.027  -1.994
  336    H    TRP  47           H        TRP  47 -22.187  17.402  -3.500
  337    HA   TRP  47           HA       TRP  47 -21.329  19.692  -1.964
  338   1HB   TRP  47          HB2       TRP  47 -20.910  21.141  -3.998
  339   2HB   TRP  47          HB3       TRP  47 -19.702  20.012  -3.467
  340    HD1  TRP  47           HD1      TRP  47 -19.407  17.672  -4.917
  341    HE1  TRP  47           HE1      TRP  47 -18.692  17.725  -7.360
  342    HE3  TRP  47           HE3      TRP  47 -21.316  22.240  -6.201
  343    HZ2  TRP  47           HZ2      TRP  47 -18.532  19.684  -9.445
  344    HZ3  TRP  47           HZ3      TRP  47 -20.741  23.219  -8.399
  345    HH2  TRP  47           HH2      TRP  47 -19.326  21.960 -10.014
  346    H    THR  48           H        THR  48 -22.605  21.631  -2.219
  347    HA   THR  48           HA       THR  48 -25.463  20.879  -2.766
  348    HB   THR  48           HB       THR  48 -26.093  22.188  -0.843
  349    HG1  THR  48           HG1      THR  48 -24.510  23.090   0.489
  350   1HG2  THR  48          1HG2      THR  48 -25.337  19.808  -0.453
  351   2HG2  THR  48          2HG2      THR  48 -23.741  20.426   0.015
  352   3HG2  THR  48          3HG2      THR  48 -25.191  20.868   0.945
  353    H    LYS  49           H        LYS  49 -26.933  22.400  -3.351
  354    HA   LYS  49           HA       LYS  49 -25.914  24.801  -4.822
  355   1HB   LYS  49          HB2       LYS  49 -27.354  22.990  -5.939
  356   2HB   LYS  49          HB3       LYS  49 -28.699  23.568  -4.966
  357   1HG   LYS  49          HG2       LYS  49 -28.260  25.896  -5.894
  358   2HG   LYS  49          HG3       LYS  49 -27.140  25.090  -7.030
  359   1HD   LYS  49          HD2       LYS  49 -28.967  23.690  -7.875
  360   2HD   LYS  49          HD3       LYS  49 -30.100  24.408  -6.725
  361   1HE   LYS  49          HE2       LYS  49 -28.629  25.900  -8.965
  362   2HE   LYS  49          HE3       LYS  49 -30.283  25.265  -9.070
  363   1HZ   LYS  49          HZ1       LYS  49 -30.480  27.527  -8.525
  364   2HZ   LYS  49          HZ2       LYS  49 -30.806  26.757  -7.110
  365   3HZ   LYS  49          HZ3       LYS  49 -29.356  27.512  -7.347
  366    H    ASP  50           H        ASP  50 -25.527  25.726  -2.620
  367    HA   ASP  50           HA       ASP  50 -25.936  27.126  -0.923
  368   1HB   ASP  50          HB2       ASP  50 -27.099  28.493  -2.582
  369   2HB   ASP  50          HB3       ASP  50 -28.638  27.718  -2.192
  370    H    GLY  51           H        GLY  51 -27.634  24.280  -1.196
  371   1HA   GLY  51          HA2       GLY  51 -27.642  23.767   1.550
  372   2HA   GLY  51          HA3       GLY  51 -29.275  24.338   1.197
  373    H    GLU  52           H        GLU  52 -29.465  23.127  -1.443
  374    HA   GLU  52           HA       GLU  52 -30.155  20.386  -0.599
  375   1HB   GLU  52          HB2       GLU  52 -31.434  20.278  -2.655
  376   2HB   GLU  52          HB3       GLU  52 -31.841  21.719  -1.718
  377   1HG   GLU  52          HG2       GLU  52 -30.395  23.057  -3.307
  378   2HG   GLU  52          HG3       GLU  52 -30.086  21.587  -4.230
  379    HA   PRO  53           HA       PRO  53 -26.579  18.657  -2.411
  380   1HB   PRO  53          HB2       PRO  53 -27.162  16.033  -2.736
  381   2HB   PRO  53          HB3       PRO  53 -27.170  16.831  -1.129
  382   1HG   PRO  53          HG2       PRO  53 -29.570  16.282  -2.918
  383   2HG   PRO  53          HG3       PRO  53 -29.398  15.938  -1.170
  384   1HD   PRO  53          HD2       PRO  53 -30.627  18.197  -2.067
  385   2HD   PRO  53          HD3       PRO  53 -29.658  18.176  -0.569
  386    H    ILE  54           H        ILE  54 -25.540  18.599  -4.213
  387    HA   ILE  54           HA       ILE  54 -26.777  18.062  -6.864
  388    HB   ILE  54           HB       ILE  54 -24.033  19.228  -6.314
  389   1HG1  ILE  54          2HG1      ILE  54 -26.421  20.983  -6.997
  390   2HG1  ILE  54          3HG1      ILE  54 -25.996  20.678  -5.305
  391   1HG2  ILE  54          1HG2      ILE  54 -24.274  20.181  -8.626
  392   2HG2  ILE  54          2HG2      ILE  54 -24.437  18.427  -8.636
  393   3HG2  ILE  54          3HG2      ILE  54 -25.872  19.414  -8.760
  394   1HD1  ILE  54          1HD1      ILE  54 -23.762  21.569  -5.599
  395   2HD1  ILE  54          2HD1      ILE  54 -24.060  21.888  -7.333
  396   3HD1  ILE  54          3HD1      ILE  54 -25.006  22.754  -6.126
  397    H    GLU  55           H        GLU  55 -26.636  15.870  -5.299
  398    HA   GLU  55           HA       GLU  55 -24.136  14.577  -5.181
  399   1HB   GLU  55          HB2       GLU  55 -25.366  12.654  -4.402
  400   2HB   GLU  55          HB3       GLU  55 -25.902  14.155  -3.584
  401   1HG   GLU  55          HG2       GLU  55 -27.913  14.185  -5.096
  402   2HG   GLU  55          HG3       GLU  55 -27.382  12.658  -5.788
  403    H    GLN  56           H        GLN  56 -23.224  12.865  -6.193
  404    HA   GLN  56           HA       GLN  56 -23.427  12.915  -8.982
  405   1HB   GLN  56          HB2       GLN  56 -21.889  11.032  -7.155
  406   2HB   GLN  56          HB3       GLN  56 -21.629  11.212  -8.895
  407   1HG   GLN  56          HG2       GLN  56 -21.031  13.625  -8.511
  408   2HG   GLN  56          HG3       GLN  56 -21.192  13.374  -6.780
  409   1HE2  GLN  56          1HE2      GLN  56 -17.898  12.129  -6.498
  410   2HE2  GLN  56          2HE2      GLN  56 -19.260  12.843  -5.676
  411    H    GLU  57           H        GLU  57 -25.277  11.046  -6.847
  412    HA   GLU  57           HA       GLU  57 -25.596   8.755  -8.723
  413   1HB   GLU  57          HB2       GLU  57 -26.266   9.015  -5.772
  414   2HB   GLU  57          HB3       GLU  57 -26.543   7.586  -6.762
  415   1HG   GLU  57          HG2       GLU  57 -24.128   7.411  -7.264
  416   2HG   GLU  57          HG3       GLU  57 -23.817   8.785  -6.196
  417    H    ASP  58           H        ASP  58 -27.222  11.596  -8.102
  418    HA   ASP  58           HA       ASP  58 -29.777  10.509  -9.145
  419   1HB   ASP  58          HB2       ASP  58 -29.768  10.078  -6.684
  420   2HB   ASP  58          HB3       ASP  58 -29.616  11.814  -6.411
  421    H    ASN  59           H        ASN  59 -27.751  13.370  -8.638
  422    HA   ASN  59           HA       ASN  59 -29.968  15.044  -9.700
  423   1HB   ASN  59          HB2       ASN  59 -29.120  15.541  -7.363
  424   2HB   ASN  59          HB3       ASN  59 -27.594  16.038  -8.121
  425   1HD2  ASN  59          1HD2      ASN  59 -29.795  19.044  -7.813
  426   2HD2  ASN  59          2HD2      ASN  59 -29.032  17.921  -6.666
  427    H    GLU  60           H        GLU  60 -29.719  14.864 -11.809
  428    HA   GLU  60           HA       GLU  60 -27.192  15.694 -13.158
  429   1HB   GLU  60          HB2       GLU  60 -27.685  13.165 -12.554
  430   2HB   GLU  60          HB3       GLU  60 -28.919  13.273 -13.819
  431   1HG   GLU  60          HG2       GLU  60 -27.126  13.898 -15.451
  432   2HG   GLU  60          HG3       GLU  60 -25.940  13.820 -14.130
  433    H    GLU  61           H        GLU  61 -30.154  16.682 -12.811
  434    HA   GLU  61           HA       GLU  61 -31.710  16.345 -15.062
  435   1HB   GLU  61          HB2       GLU  61 -31.591  18.826 -13.317
  436   2HB   GLU  61          HB3       GLU  61 -32.888  18.397 -14.446
  437   1HG   GLU  61          HG2       GLU  61 -33.223  16.227 -13.164
  438   2HG   GLU  61          HG3       GLU  61 -32.104  16.823 -11.948
  439    H    LYS  62           H        LYS  62 -29.082  18.634 -14.942
  440    HA   LYS  62           HA       LYS  62 -29.024  18.654 -17.839
  441   1HB   LYS  62          HB2       LYS  62 -29.205  21.057 -18.282
  442   2HB   LYS  62          HB3       LYS  62 -30.702  20.409 -17.630
  443   1HG   LYS  62          HG2       LYS  62 -30.003  21.311 -15.330
  444   2HG   LYS  62          HG3       LYS  62 -28.689  22.165 -16.176
  445   1HD   LYS  62          HD2       LYS  62 -30.477  23.081 -17.778
  446   2HD   LYS  62          HD3       LYS  62 -31.675  22.512 -16.598
  447   1HE   LYS  62          HE2       LYS  62 -30.611  23.864 -14.830
  448   2HE   LYS  62          HE3       LYS  62 -29.318  24.318 -15.948
  449   1HZ   LYS  62          HZ1       LYS  62 -30.982  25.489 -17.293
  450   2HZ   LYS  62          HZ2       LYS  62 -32.169  25.159 -16.187
  451   3HZ   LYS  62          HZ3       LYS  62 -30.856  26.072 -15.769
  452    H    TYR  63           H        TYR  63 -27.310  17.586 -16.142
  453    HA   TYR  63           HA       TYR  63 -24.910  18.972 -16.853
  454   1HB   TYR  63          HB2       TYR  63 -24.207  18.655 -14.225
  455   2HB   TYR  63          HB3       TYR  63 -24.621  20.160 -14.992
  456    HD1  TYR  63           HD1      TYR  63 -25.811  17.638 -12.560
  457    HD2  TYR  63           HD2      TYR  63 -26.639  21.355 -14.572
  458    HE1  TYR  63           HE1      TYR  63 -27.529  18.213 -10.847
  459    HE2  TYR  63           HE2      TYR  63 -28.347  21.921 -12.885
  460    HH   TYR  63           HH       TYR  63 -29.451  21.242 -11.010
  461    H    SER  64           H        SER  64 -22.949  17.875 -16.425
  462    HA   SER  64           HA       SER  64 -22.926  15.085 -15.535
  463   1HB   SER  64          HB2       SER  64 -21.991  14.241 -17.654
  464   2HB   SER  64          HB3       SER  64 -23.673  14.751 -17.805
  465    HG   SER  64           HG       SER  64 -22.377  15.486 -19.556
  466    H    PHE  65           H        PHE  65 -20.890  14.428 -14.908
  467    HA   PHE  65           HA       PHE  65 -18.630  16.309 -15.131
  468   1HB   PHE  65          HB2       PHE  65 -18.520  15.928 -12.633
  469   2HB   PHE  65          HB3       PHE  65 -20.024  16.666 -13.241
  470    HD1  PHE  65           HD1      PHE  65 -18.591  13.407 -12.050
  471    HD2  PHE  65           HD2      PHE  65 -22.131  15.743 -12.807
  472    HE1  PHE  65           HE1      PHE  65 -20.014  11.588 -11.112
  473    HE2  PHE  65           HE2      PHE  65 -23.550  13.905 -11.924
  474    HZ   PHE  65           HZ       PHE  65 -22.477  11.809 -11.101
  475    H    ASN  66           H        ASN  66 -16.700  15.388 -13.826
  476    HA   ASN  66           HA       ASN  66 -15.780  13.059 -15.361
  477   1HB   ASN  66          HB2       ASN  66 -13.630  13.927 -14.911
  478   2HB   ASN  66          HB3       ASN  66 -14.660  15.311 -15.240
  479   1HD2  ASN  66          1HD2      ASN  66 -12.650  16.360 -12.381
  480   2HD2  ASN  66          2HD2      ASN  66 -12.418  16.080 -14.110
  481    H    TYR  67           H        TYR  67 -13.849  11.782 -14.171
  482    HA   TYR  67           HA       TYR  67 -15.186  10.069 -12.293
  483   1HB   TYR  67          HB2       TYR  67 -12.313  10.080 -13.229
  484   2HB   TYR  67          HB3       TYR  67 -13.083   8.762 -12.391
  485    HD1  TYR  67           HD1      TYR  67 -12.444  10.196 -15.615
  486    HD2  TYR  67           HD2      TYR  67 -15.215   7.681 -13.465
  487    HE1  TYR  67           HE1      TYR  67 -13.251   9.263 -17.768
  488    HE2  TYR  67           HE2      TYR  67 -16.011   6.737 -15.604
  489    HH   TYR  67           HH       TYR  67 -15.812   6.751 -17.886
  490    H    ASP  68           H        ASP  68 -13.295  12.864 -11.724
  491    HA   ASP  68           HA       ASP  68 -12.455  12.170  -8.941
  492   1HB   ASP  68          HB2       ASP  68 -12.200  14.663 -10.637
  493   2HB   ASP  68          HB3       ASP  68 -11.593  14.472  -8.993
  494    H    GLY  69           H        GLY  69 -15.234  13.366 -10.541
  495   1HA   GLY  69          HA2       GLY  69 -17.280  14.147  -9.776
  496   2HA   GLY  69          HA3       GLY  69 -16.668  14.116  -8.114
  497    H    SER  70           H        SER  70 -14.613  15.846 -10.302
  498    HA   SER  70           HA       SER  70 -15.144  18.273  -8.695
  499   1HB   SER  70          HB2       SER  70 -12.944  18.987  -9.520
  500   2HB   SER  70          HB3       SER  70 -12.891  17.442  -8.631
  501    HG   SER  70           HG       SER  70 -11.624  17.510 -10.574
  502    H    GLU  71           H        GLU  71 -14.168  17.797 -12.133
  503    HA   GLU  71           HA       GLU  71 -15.424  20.253 -12.927
  504   1HB   GLU  71          HB2       GLU  71 -14.484  18.001 -14.720
  505   2HB   GLU  71          HB3       GLU  71 -14.842  19.676 -15.192
  506   1HG   GLU  71          HG2       GLU  71 -13.039  20.374 -13.528
  507   2HG   GLU  71          HG3       GLU  71 -12.550  18.696 -13.452
  508    H    LEU  72           H        LEU  72 -17.499  20.554 -12.826
  509    HA   LEU  72           HA       LEU  72 -19.380  18.558 -13.914
  510   1HB   LEU  72          HB2       LEU  72 -19.512  18.995 -11.511
  511   2HB   LEU  72          HB3       LEU  72 -19.851  20.688 -11.801
  512    HG   LEU  72           HG       LEU  72 -21.651  18.495 -12.893
  513   1HD1  LEU  72          1HD1      LEU  72 -21.868  19.914 -10.207
  514   2HD1  LEU  72          2HD1      LEU  72 -23.054  18.798 -10.912
  515   3HD1  LEU  72          3HD1      LEU  72 -21.456  18.198 -10.422
  516   1HD2  LEU  72          1HD2      LEU  72 -23.389  20.340 -12.626
  517   2HD2  LEU  72          2HD2      LEU  72 -22.044  21.467 -12.312
  518   3HD2  LEU  72          3HD2      LEU  72 -22.188  20.633 -13.869
  519    H    ILE  73           H        ILE  73 -20.241  19.021 -15.739
  520    HA   ILE  73           HA       ILE  73 -20.092  21.769 -16.893
  521    HB   ILE  73           HB       ILE  73 -20.683  19.145 -18.278
  522   1HG1  ILE  73          2HG1      ILE  73 -18.005  20.468 -18.614
  523   2HG1  ILE  73          3HG1      ILE  73 -18.238  19.488 -17.169
  524   1HG2  ILE  73          1HG2      ILE  73 -19.900  21.964 -19.246
  525   2HG2  ILE  73          2HG2      ILE  73 -20.077  20.548 -20.317
  526   3HG2  ILE  73          3HG2      ILE  73 -21.479  21.197 -19.441
  527   1HD1  ILE  73          1HD1      ILE  73 -18.739  18.457 -19.988
  528   2HD1  ILE  73          2HD1      ILE  73 -17.284  18.150 -18.982
  529   3HD1  ILE  73          3HD1      ILE  73 -18.861  17.545 -18.469
  530    H    ILE  74           H        ILE  74 -21.856  22.893 -16.924
  531    HA   ILE  74           HA       ILE  74 -24.559  21.695 -16.556
  532    HB   ILE  74           HB       ILE  74 -23.510  24.528 -16.105
  533   1HG1  ILE  74          2HG1      ILE  74 -24.507  22.564 -14.006
  534   2HG1  ILE  74          3HG1      ILE  74 -22.793  22.778 -14.422
  535   1HG2  ILE  74          1HG2      ILE  74 -25.855  24.599 -16.836
  536   2HG2  ILE  74          2HG2      ILE  74 -26.299  23.351 -15.686
  537   3HG2  ILE  74          3HG2      ILE  74 -25.788  24.952 -15.137
  538   1HD1  ILE  74          1HD1      ILE  74 -23.248  24.051 -12.455
  539   2HD1  ILE  74          2HD1      ILE  74 -22.904  25.158 -13.778
  540   3HD1  ILE  74          3HD1      ILE  74 -24.581  24.911 -13.239
  541    H    LYS  75           H        LYS  75 -26.107  22.078 -18.062
  542    HA   LYS  75           HA       LYS  75 -25.447  23.827 -20.363
  543   1HB   LYS  75          HB2       LYS  75 -26.576  22.241 -21.908
  544   2HB   LYS  75          HB3       LYS  75 -25.008  21.761 -21.351
  545   1HG   LYS  75          HG2       LYS  75 -27.447  20.677 -19.921
  546   2HG   LYS  75          HG3       LYS  75 -26.983  20.012 -21.471
  547   1HD   LYS  75          HD2       LYS  75 -25.256  20.013 -18.977
  548   2HD   LYS  75          HD3       LYS  75 -26.127  18.647 -19.583
  549   1HE   LYS  75          HE2       LYS  75 -23.858  20.049 -21.060
  550   2HE   LYS  75          HE3       LYS  75 -23.688  18.608 -20.031
  551   1HZ   LYS  75          HZ1       LYS  75 -23.866  18.003 -22.359
  552   2HZ   LYS  75          HZ2       LYS  75 -25.189  17.419 -21.574
  553   3HZ   LYS  75          HZ3       LYS  75 -25.321  18.732 -22.528
  554    H    LYS  76           H        LYS  76 -27.075  24.640 -21.498
  555    HA   LYS  76           HA       LYS  76 -28.819  26.066 -21.671
  556   1HB   LYS  76          HB2       LYS  76 -31.068  25.185 -21.675
  557   2HB   LYS  76          HB3       LYS  76 -29.916  24.275 -22.649
  558   1HG   LYS  76          HG2       LYS  76 -29.810  22.498 -20.909
  559   2HG   LYS  76          HG3       LYS  76 -31.012  23.389 -19.972
  560   1HD   LYS  76          HD2       LYS  76 -32.650  23.177 -21.778
  561   2HD   LYS  76          HD3       LYS  76 -31.452  22.372 -22.793
  562   1HE   LYS  76          HE2       LYS  76 -31.234  20.550 -21.095
  563   2HE   LYS  76          HE3       LYS  76 -32.407  21.354 -20.059
  564   1HZ   LYS  76          HZ1       LYS  76 -34.088  21.028 -21.797
  565   2HZ   LYS  76          HZ2       LYS  76 -32.997  20.388 -22.811
  566   3HZ   LYS  76          HZ3       LYS  76 -33.397  19.594 -21.432
  567    H    VAL  77           H        VAL  77 -27.756  27.148 -19.945
  568    HA   VAL  77           HA       VAL  77 -28.779  27.217 -17.261
  569    HB   VAL  77           HB       VAL  77 -26.894  28.912 -18.892
  570   1HG1  VAL  77          1HG1      VAL  77 -27.598  29.335 -15.932
  571   2HG1  VAL  77          2HG1      VAL  77 -26.158  30.005 -16.738
  572   3HG1  VAL  77          3HG1      VAL  77 -27.769  30.514 -17.243
  573   1HG2  VAL  77          1HG2      VAL  77 -26.039  26.709 -18.287
  574   2HG2  VAL  77          2HG2      VAL  77 -25.234  27.922 -17.283
  575   3HG2  VAL  77          3HG2      VAL  77 -26.535  26.954 -16.593
  576    H    ASP  78           H        ASP  78 -29.991  28.650 -16.171
  577    HA   ASP  78           HA       ASP  78 -31.149  31.043 -17.435
  578   1HB   ASP  78          HB2       ASP  78 -32.661  28.771 -17.578
  579   2HB   ASP  78          HB3       ASP  78 -33.139  29.369 -15.984
  580    H    LYS  79           H        LYS  79 -32.598  32.119 -15.666
  581    HA   LYS  79           HA       LYS  79 -30.974  33.187 -13.654
  582   1HB   LYS  79          HB2       LYS  79 -34.002  33.009 -13.772
  583   2HB   LYS  79          HB3       LYS  79 -33.088  34.085 -12.675
  584   1HG   LYS  79          HG2       LYS  79 -32.071  35.209 -14.655
  585   2HG   LYS  79          HG3       LYS  79 -33.005  34.144 -15.727
  586   1HD   LYS  79          HD2       LYS  79 -34.239  36.082 -13.741
  587   2HD   LYS  79          HD3       LYS  79 -34.000  36.422 -15.444
  588   1HE   LYS  79          HE2       LYS  79 -35.455  34.518 -16.065
  589   2HE   LYS  79          HE3       LYS  79 -35.684  34.101 -14.363
  590   1HZ   LYS  79          HZ1       LYS  79 -37.521  35.460 -15.295
  591   2HZ   LYS  79          HZ2       LYS  79 -36.792  36.264 -14.073
  592   3HZ   LYS  79          HZ3       LYS  79 -36.499  36.686 -15.612
  593    H    SER  80           H        SER  80 -32.882  30.261 -13.360
  594    HA   SER  80           HA       SER  80 -32.827  30.150 -10.455
  595   1HB   SER  80          HB2       SER  80 -33.823  27.893 -10.863
  596   2HB   SER  80          HB3       SER  80 -34.718  29.247 -11.555
  597    HG   SER  80           HG       SER  80 -34.485  27.478 -13.028
  598    H    ASP  81           H        ASP  81 -30.452  29.438 -12.780
  599    HA   ASP  81           HA       ASP  81 -29.197  27.221 -11.286
  600   1HB   ASP  81          HB2       ASP  81 -28.319  28.833 -13.705
  601   2HB   ASP  81          HB3       ASP  81 -27.385  27.504 -13.015
  602    H    GLU  82           H        GLU  82 -29.285  30.529 -10.675
  603    HA   GLU  82           HA       GLU  82 -26.664  31.109  -9.741
  604   1HB   GLU  82          HB2       GLU  82 -28.459  32.766  -9.922
  605   2HB   GLU  82          HB3       GLU  82 -29.378  31.933  -8.649
  606   1HG   GLU  82          HG2       GLU  82 -27.583  32.477  -7.011
  607   2HG   GLU  82          HG3       GLU  82 -26.654  33.244  -8.312
  608    H    ALA  83           H        ALA  83 -25.503  30.496  -7.951
  609    HA   ALA  83           HA       ALA  83 -26.683  28.926  -5.756
  610   1HB   ALA  83          HB1       ALA  83 -24.750  27.642  -7.743
  611   2HB   ALA  83          HB2       ALA  83 -25.369  26.884  -6.283
  612   3HB   ALA  83          HB3       ALA  83 -26.491  27.254  -7.598
  613    H    GLU  84           H        GLU  84 -25.358  28.510  -4.078
  614    HA   GLU  84           HA       GLU  84 -22.558  29.615  -4.036
  615   1HB   GLU  84          HB2       GLU  84 -24.124  30.863  -2.581
  616   2HB   GLU  84          HB3       GLU  84 -24.531  29.370  -1.705
  617   1HG   GLU  84          HG2       GLU  84 -22.204  29.133  -0.963
  618   2HG   GLU  84          HG3       GLU  84 -21.710  30.515  -1.936
  619    H    TYR  85           H        TYR  85 -21.438  27.820  -4.552
  620    HA   TYR  85           HA       TYR  85 -22.397  25.153  -3.882
  621   1HB   TYR  85          HB2       TYR  85 -20.012  26.104  -5.454
  622   2HB   TYR  85          HB3       TYR  85 -20.461  24.433  -5.272
  623    HD1  TYR  85           HD1      TYR  85 -20.523  27.089  -7.493
  624    HD2  TYR  85           HD2      TYR  85 -23.093  23.999  -5.918
  625    HE1  TYR  85           HE1      TYR  85 -21.773  26.992  -9.650
  626    HE2  TYR  85           HE2      TYR  85 -24.329  23.908  -8.091
  627    HH   TYR  85           HH       TYR  85 -24.471  24.720 -10.195
  628    H    ILE  86           H        ILE  86 -22.000  24.619  -1.745
  629    HA   ILE  86           HA       ILE  86 -19.184  24.840  -0.747
  630    HB   ILE  86           HB       ILE  86 -21.682  23.863   0.702
  631   1HG1  ILE  86          2HG1      ILE  86 -20.169  26.498   0.769
  632   2HG1  ILE  86          3HG1      ILE  86 -21.837  26.254   0.272
  633   1HG2  ILE  86          1HG2      ILE  86 -18.838  24.417   1.665
  634   2HG2  ILE  86          2HG2      ILE  86 -20.211  23.925   2.718
  635   3HG2  ILE  86          3HG2      ILE  86 -19.547  22.817   1.520
  636   1HD1  ILE  86          1HD1      ILE  86 -21.946  27.270   2.395
  637   2HD1  ILE  86          2HD1      ILE  86 -22.387  25.557   2.608
  638   3HD1  ILE  86          3HD1      ILE  86 -20.765  26.130   3.078
  639    H    CYS  87           H        CYS  87 -17.872  23.129  -0.887
  640    HA   CYS  87           HA       CYS  87 -18.966  20.490  -1.668
  641   1HB   CYS  87          HB2       CYS  87 -16.990  20.300  -3.219
  642   2HB   CYS  87          HB3       CYS  87 -18.186  21.500  -3.708
  643    H    ILE  88           H        ILE  88 -18.317  18.787  -0.689
  644    HA   ILE  88           HA       ILE  88 -16.168  19.021   1.359
  645    HB   ILE  88           HB       ILE  88 -18.768  17.435   1.533
  646   1HG1  ILE  88          2HG1      ILE  88 -19.053  19.255   3.532
  647   2HG1  ILE  88          3HG1      ILE  88 -18.142  20.267   2.454
  648   1HG2  ILE  88          1HG2      ILE  88 -16.917  16.490   2.878
  649   2HG2  ILE  88          2HG2      ILE  88 -16.628  18.071   3.638
  650   3HG2  ILE  88          3HG2      ILE  88 -18.144  17.176   3.924
  651   1HD1  ILE  88          1HD1      ILE  88 -20.608  20.554   2.166
  652   2HD1  ILE  88          2HD1      ILE  88 -19.906  19.911   0.681
  653   3HD1  ILE  88          3HD1      ILE  88 -20.768  18.823   1.780
  654    H    ALA  89           H        ALA  89 -14.685  17.386   1.422
  655    HA   ALA  89           HA       ALA  89 -15.265  14.846  -0.033
  656   1HB   ALA  89          HB1       ALA  89 -13.755  16.283  -1.420
  657   2HB   ALA  89          HB2       ALA  89 -12.604  16.348  -0.069
  658   3HB   ALA  89          HB3       ALA  89 -12.945  14.796  -0.847
  659    H    GLU  90           H        GLU  90 -14.434  13.031   0.819
  660    HA   GLU  90           HA       GLU  90 -13.096  13.056   3.479
  661   1HB   GLU  90          HB2       GLU  90 -15.594  13.266   3.700
  662   2HB   GLU  90          HB3       GLU  90 -15.758  11.750   2.830
  663   1HG   GLU  90          HG2       GLU  90 -14.429  10.612   4.649
  664   2HG   GLU  90          HG3       GLU  90 -14.335  12.163   5.478
  665    H    ASN  91           H        ASN  91 -11.897  11.220   3.883
  666    HA   ASN  91           HA       ASN  91 -12.506   8.732   2.528
  667   1HB   ASN  91          HB2       ASN  91 -10.552   8.313   1.341
  668   2HB   ASN  91          HB3       ASN  91 -11.003   9.929   0.878
  669   1HD2  ASN  91          1HD2      ASN  91  -7.375   9.984   1.281
  670   2HD2  ASN  91          2HD2      ASN  91  -8.545   9.212   0.200
  671    H    LYS  92           H        LYS  92 -10.261   7.230   3.285
  672    HA   LYS  92           HA       LYS  92 -10.719   7.009   6.156
  673   1HB   LYS  92          HB2       LYS  92  -8.883   5.188   5.845
  674   2HB   LYS  92          HB3       LYS  92 -10.542   4.888   5.413
  675   1HG   LYS  92          HG2       LYS  92  -8.474   5.765   3.386
  676   2HG   LYS  92          HG3       LYS  92  -8.643   4.093   3.868
  677   1HD   LYS  92          HD2       LYS  92 -10.768   5.730   2.411
  678   2HD   LYS  92          HD3       LYS  92  -9.786   4.455   1.770
  679   1HE   LYS  92          HE2       LYS  92 -11.867   4.090   3.946
  680   2HE   LYS  92          HE3       LYS  92 -12.106   3.764   2.212
  681   1HZ   LYS  92          HZ1       LYS  92 -11.553   1.719   3.362
  682   2HZ   LYS  92          HZ2       LYS  92 -10.361   2.092   2.345
  683   3HZ   LYS  92          HZ3       LYS  92 -10.172   2.327   3.958
  684    H    ALA  93           H        ALA  93  -8.358   8.669   4.344
  685    HA   ALA  93           HA       ALA  93  -6.451   8.821   6.568
  686   1HB   ALA  93          HB1       ALA  93  -5.693   8.513   4.242
  687   2HB   ALA  93          HB2       ALA  93  -6.421  10.072   3.798
  688   3HB   ALA  93          HB3       ALA  93  -5.052  10.003   4.959
  689    H    GLY  94           H        GLY  94  -9.002  10.873   5.153
  690   1HA   GLY  94          HA2       GLY  94  -9.087  12.617   7.401
  691   2HA   GLY  94          HA3       GLY  94  -8.146  13.383   6.129
  692    H    GLU  95           H        GLU  95  -9.785  15.069   6.269
  693    HA   GLU  95           HA       GLU  95 -12.107  14.738   4.535
  694   1HB   GLU  95          HB2       GLU  95 -12.856  13.729   6.731
  695   2HB   GLU  95          HB3       GLU  95 -12.487  15.273   7.504
  696   1HG   GLU  95          HG2       GLU  95 -14.185  16.318   5.888
  697   2HG   GLU  95          HG3       GLU  95 -14.583  14.680   5.405
  698    H    GLN  96           H        GLN  96 -12.521  16.705   3.609
  699    HA   GLN  96           HA       GLN  96 -11.939  19.257   4.965
  700   1HB   GLN  96          HB2       GLN  96 -10.313  18.292   2.590
  701   2HB   GLN  96          HB3       GLN  96 -10.521  20.009   2.909
  702   1HG   GLN  96          HG2       GLN  96  -9.641  19.573   5.243
  703   2HG   GLN  96          HG3       GLN  96  -9.190  17.946   4.718
  704   1HE2  GLN  96          1HE2      GLN  96  -7.855  17.919   2.572
  705   2HE2  GLN  96          2HE2      GLN  96  -6.502  19.066   2.595
  706    H    ASP  97           H        ASP  97 -12.273  21.166   3.309
  707    HA   ASP  97           HA       ASP  97 -14.381  20.684   1.343
  708   1HB   ASP  97          HB2       ASP  97 -16.136  21.915   2.464
  709   2HB   ASP  97          HB3       ASP  97 -15.605  20.634   3.504
  710    H    ALA  98           H        ALA  98 -14.788  22.379  -0.059
  711    HA   ALA  98           HA       ALA  98 -13.537  25.069   0.389
  712   1HB   ALA  98          HB1       ALA  98 -12.154  23.707  -1.193
  713   2HB   ALA  98          HB2       ALA  98 -13.554  23.577  -2.273
  714   3HB   ALA  98          HB3       ALA  98 -12.809  25.155  -1.955
  715    H    THR  99           H        THR  99 -14.470  26.654  -1.392
  716    HA   THR  99           HA       THR  99 -17.412  26.311  -1.693
  717    HB   THR  99           HB       THR  99 -16.048  28.652  -0.329
  718    HG1  THR  99           HG1      THR  99 -16.351  26.921   1.044
  719   1HG2  THR  99          1HG2      THR  99 -17.978  29.535  -1.580
  720   2HG2  THR  99          2HG2      THR  99 -18.993  28.212  -0.967
  721   3HG2  THR  99          3HG2      THR  99 -18.394  29.452   0.131
  722    H    ILE 100           H        ILE 100 -18.323  27.450  -3.429
  723    HA   ILE 100           HA       ILE 100 -16.672  29.306  -5.124
  724    HB   ILE 100           HB       ILE 100 -18.251  26.936  -6.218
  725   1HG1  ILE 100          2HG1      ILE 100 -15.254  27.103  -6.021
  726   2HG1  ILE 100          3HG1      ILE 100 -16.282  26.057  -5.030
  727   1HG2  ILE 100          1HG2      ILE 100 -16.448  28.988  -7.565
  728   2HG2  ILE 100          2HG2      ILE 100 -17.088  27.554  -8.371
  729   3HG2  ILE 100          3HG2      ILE 100 -18.187  28.779  -7.779
  730   1HD1  ILE 100          1HD1      ILE 100 -15.778  25.824  -7.993
  731   2HD1  ILE 100          2HD1      ILE 100 -15.416  24.674  -6.703
  732   3HD1  ILE 100          3HD1      ILE 100 -17.109  24.985  -7.142
  733    H    HIS 101           H        HIS 101 -17.996  30.835  -6.259
  734    HA   HIS 101           HA       HIS 101 -20.924  30.783  -5.678
  735   1HB   HIS 101          HB2       HIS 101 -19.381  33.145  -6.729
  736   2HB   HIS 101          HB3       HIS 101 -20.945  33.139  -5.950
  737    HD1  HIS 101           HD1      HIS 101 -17.442  33.865  -5.254
  738    HD2  HIS 101           HD2      HIS 101 -20.684  32.280  -3.116
  739    HE1  HIS 101           HE1      HIS 101 -16.859  34.120  -2.775
  740    H    LEU 102           H        LEU 102 -22.408  31.043  -7.400
  741    HA   LEU 102           HA       LEU 102 -21.374  31.523 -10.132
  742   1HB   LEU 102          HB2       LEU 102 -21.728  29.176 -10.098
  743   2HB   LEU 102          HB3       LEU 102 -23.268  29.338  -9.251
  744    HG   LEU 102           HG       LEU 102 -24.307  30.370 -11.237
  745   1HD1  LEU 102          1HD1      LEU 102 -23.124  30.282 -13.426
  746   2HD1  LEU 102          2HD1      LEU 102 -22.330  31.401 -12.305
  747   3HD1  LEU 102          3HD1      LEU 102 -21.629  29.783 -12.602
  748   1HD2  LEU 102          1HD2      LEU 102 -24.417  28.351 -12.580
  749   2HD2  LEU 102          2HD2      LEU 102 -22.908  27.767 -11.869
  750   3HD2  LEU 102          3HD2      LEU 102 -24.355  27.944 -10.873
  751    H    LYS 103           H        LYS 103 -22.082  33.462 -10.557
  752    HA   LYS 103           HA       LYS 103 -24.829  34.375  -9.758
  753   1HB   LYS 103          HB2       LYS 103 -22.417  35.987 -10.601
  754   2HB   LYS 103          HB3       LYS 103 -23.952  36.641 -10.027
  755   1HG   LYS 103          HG2       LYS 103 -21.943  35.009  -8.405
  756   2HG   LYS 103          HG3       LYS 103 -22.262  36.746  -8.261
  757   1HD   LYS 103          HD2       LYS 103 -24.194  34.485  -7.574
  758   2HD   LYS 103          HD3       LYS 103 -23.339  35.471  -6.415
  759   1HE   LYS 103          HE2       LYS 103 -25.432  36.515  -8.381
  760   2HE   LYS 103          HE3       LYS 103 -25.755  36.052  -6.730
  761   1HZ   LYS 103          HZ1       LYS 103 -24.207  37.797  -5.995
  762   2HZ   LYS 103          HZ2       LYS 103 -23.935  38.255  -7.543
  763   3HZ   LYS 103          HZ3       LYS 103 -25.415  38.423  -6.882
  764    H    VAL 104           H        VAL 104 -26.052  33.457 -11.342
  765    HA   VAL 104           HA       VAL 104 -25.532  33.983 -14.215
  766    HB   VAL 104           HB       VAL 104 -27.767  32.539 -12.730
  767   1HG1  VAL 104          1HG1      VAL 104 -28.793  33.402 -14.760
  768   2HG1  VAL 104          2HG1      VAL 104 -27.376  32.960 -15.737
  769   3HG1  VAL 104          3HG1      VAL 104 -28.437  31.722 -15.046
  770   1HG2  VAL 104          1HG2      VAL 104 -25.593  31.383 -12.763
  771   2HG2  VAL 104          2HG2      VAL 104 -26.791  30.553 -13.749
  772   3HG2  VAL 104          3HG2      VAL 104 -25.518  31.518 -14.535
  773    H    PHE 105           H        PHE 105 -26.407  35.652 -15.395
  774    HA   PHE 105           HA       PHE 105 -28.138  37.575 -13.917
  775   1HB   PHE 105          HB2       PHE 105 -27.043  39.177 -15.493
  776   2HB   PHE 105          HB3       PHE 105 -26.027  38.490 -14.220
  777    HD1  PHE 105           HD1      PHE 105 -26.693  38.673 -17.872
  778    HD2  PHE 105           HD2      PHE 105 -24.110  37.050 -14.808
  779    HE1  PHE 105           HE1      PHE 105 -24.965  38.159 -19.569
  780    HE2  PHE 105           HE2      PHE 105 -22.400  36.525 -16.542
  781    HZ   PHE 105           HZ       PHE 105 -22.805  37.126 -18.896
  782    H    ALA 106           H        ALA 106 -29.695  38.740 -15.005
  783    HA   ALA 106           HA       ALA 106 -31.157  37.188 -16.974
  784   1HB   ALA 106          HB1       ALA 106 -32.154  38.030 -14.853
  785   2HB   ALA 106          HB2       ALA 106 -31.881  39.694 -15.388
  786   3HB   ALA 106          HB3       ALA 106 -32.990  38.623 -16.290
  787    H    LYS 107           H        LYS 107 -28.993  38.073 -18.265
  788    HA   LYS 107           HA       LYS 107 -28.257  39.026 -20.209
  789   1HB   LYS 107          HB2       LYS 107 -31.084  39.979 -20.770
  790   2HB   LYS 107          HB3       LYS 107 -29.788  39.700 -21.920
  791   1HG   LYS 107          HG2       LYS 107 -29.875  37.273 -21.524
  792   2HG   LYS 107          HG3       LYS 107 -31.087  37.503 -20.244
  793   1HD   LYS 107          HD2       LYS 107 -32.599  38.540 -21.951
  794   2HD   LYS 107          HD3       LYS 107 -31.409  38.125 -23.206
  795   1HE   LYS 107          HE2       LYS 107 -31.652  35.721 -22.573
  796   2HE   LYS 107          HE3       LYS 107 -32.796  36.167 -21.319
  797   1HZ   LYS 107          HZ1       LYS 107 -33.254  36.570 -24.224
  798   2HZ   LYS 107          HZ2       LYS 107 -34.016  35.473 -23.275
  799   3HZ   LYS 107          HZ3       LYS 107 -34.286  37.053 -23.053
  Start of MODEL   18
    1   1H    GLY   1          H1        GLY   1   0.306   4.172  -7.337
    2   2H    GLY   1          H2        GLY   1  -1.243   4.633  -7.063
    3   3H    GLY   1          H3        GLY   1  -0.105   5.792  -7.215
    4   1HA   GLY   1          HA2       GLY   1   0.981   5.074  -5.189
    5   2HA   GLY   1          HA3       GLY   1  -0.705   5.514  -4.902
    6    H    LYS   2           H        LYS   2   0.343   4.021  -3.036
    7    HA   LYS   2           HA       LYS   2  -0.978   1.404  -3.180
    8   1HB   LYS   2          HB2       LYS   2   2.005   1.807  -3.093
    9   2HB   LYS   2          HB3       LYS   2   1.366   0.614  -1.992
   10   1HG   LYS   2          HG2       LYS   2   0.949   0.573  -5.015
   11   2HG   LYS   2          HG3       LYS   2   2.148  -0.337  -4.088
   12   1HD   LYS   2          HD2       LYS   2   0.297  -1.397  -2.772
   13   2HD   LYS   2          HD3       LYS   2  -0.865  -0.669  -3.870
   14   1HE   LYS   2          HE2       LYS   2   1.366  -2.596  -4.673
   15   2HE   LYS   2          HE3       LYS   2  -0.332  -3.045  -4.412
   16   1HZ   LYS   2          HZ1       LYS   2   0.156  -2.696  -6.774
   17   2HZ   LYS   2          HZ2       LYS   2  -0.938  -1.605  -6.239
   18   3HZ   LYS   2          HZ3       LYS   2   0.593  -1.144  -6.504
   19    H    ASP   3           H        ASP   3  -1.593   0.646  -1.242
   20    HA   ASP   3           HA       ASP   3  -1.587   2.573   1.006
   21   1HB   ASP   3          HB2       ASP   3  -3.680   1.570   0.112
   22   2HB   ASP   3          HB3       ASP   3  -3.135  -0.028   0.625
   23    H    ILE   4           H        ILE   4   0.865   1.175   0.429
   24    HA   ILE   4           HA       ILE   4   1.322  -1.015   2.342
   25    HB   ILE   4           HB       ILE   4   3.040   0.560   0.395
   26   1HG1  ILE   4          2HG1      ILE   4   2.215  -2.384   0.556
   27   2HG1  ILE   4          3HG1      ILE   4   1.414  -1.170  -0.425
   28   1HG2  ILE   4          1HG2      ILE   4   4.946  -0.984   0.963
   29   2HG2  ILE   4          2HG2      ILE   4   4.524   0.051   2.293
   30   3HG2  ILE   4          3HG2      ILE   4   3.993  -1.650   2.318
   31   1HD1  ILE   4          1HD1      ILE   4   3.552  -0.801  -1.700
   32   2HD1  ILE   4          2HD1      ILE   4   4.222  -2.205  -0.802
   33   3HD1  ILE   4          3HD1      ILE   4   2.826  -2.417  -1.871
   34    H    GLN   5           H        GLN   5   2.581  -0.871   4.233
   35    HA   GLN   5           HA       GLN   5   2.129   1.577   5.679
   36   1HB   GLN   5          HB2       GLN   5   3.443  -1.022   6.543
   37   2HB   GLN   5          HB3       GLN   5   2.990   0.290   7.650
   38   1HG   GLN   5          HG2       GLN   5   0.616   0.031   6.942
   39   2HG   GLN   5          HG3       GLN   5   1.069  -1.330   5.930
   40   1HE2  GLN   5          1HE2      GLN   5  -0.812  -1.323   8.271
   41   2HE2  GLN   5          2HE2      GLN   5  -0.124  -2.532   9.344
   42    H    VAL   6           H        VAL   6   4.075   1.835   3.657
   43    HA   VAL   6           HA       VAL   6   6.112   3.336   5.158
   44    HB   VAL   6           HB       VAL   6   7.028   1.715   2.750
   45   1HG1  VAL   6          1HG1      VAL   6   8.528   3.553   3.460
   46   2HG1  VAL   6          2HG1      VAL   6   8.542   2.925   5.115
   47   3HG1  VAL   6          3HG1      VAL   6   9.276   1.985   3.807
   48   1HG2  VAL   6          1HG2      VAL   6   7.281   0.814   5.661
   49   2HG2  VAL   6          2HG2      VAL   6   6.351   0.000   4.395
   50   3HG2  VAL   6          3HG2      VAL   6   8.089   0.057   4.254
   51    H    ILE   7           H        ILE   7   3.684   3.810   3.679
   52    HA   ILE   7           HA       ILE   7   4.519   6.023   1.866
   53    HB   ILE   7           HB       ILE   7   2.430   3.894   1.206
   54   1HG1  ILE   7          2HG1      ILE   7   5.158   4.444  -0.081
   55   2HG1  ILE   7          3HG1      ILE   7   4.690   3.031   0.809
   56   1HG2  ILE   7          1HG2      ILE   7   1.656   6.062   0.331
   57   2HG2  ILE   7          2HG2      ILE   7   3.251   6.353  -0.411
   58   3HG2  ILE   7          3HG2      ILE   7   2.179   5.059  -0.970
   59   1HD1  ILE   7          1HD1      ILE   7   2.939   2.540  -0.960
   60   2HD1  ILE   7          2HD1      ILE   7   3.812   3.774  -1.955
   61   3HD1  ILE   7          3HD1      ILE   7   4.664   2.363  -1.399
   62    H    VAL   8           H        VAL   8   2.943   7.713   1.751
   63    HA   VAL   8           HA       VAL   8   1.348   7.950   4.239
   64    HB   VAL   8           HB       VAL   8   1.923   9.980   2.019
   65   1HG1  VAL   8          1HG1      VAL   8   0.773  10.331   4.843
   66   2HG1  VAL   8          2HG1      VAL   8   1.239  11.657   3.723
   67   3HG1  VAL   8          3HG1      VAL   8  -0.094  10.604   3.302
   68   1HG2  VAL   8          1HG2      VAL   8   3.525  10.988   3.601
   69   2HG2  VAL   8          2HG2      VAL   8   3.237   9.665   4.761
   70   3HG2  VAL   8          3HG2      VAL   8   4.002   9.341   3.202
   71    H    ASN   9           H        ASN   9  -0.734   7.708   4.361
   72    HA   ASN   9           HA       ASN   9  -2.458   7.454   1.945
   73   1HB   ASN   9          HB2       ASN   9  -4.245   6.993   3.685
   74   2HB   ASN   9          HB3       ASN   9  -2.945   5.792   3.504
   75   1HD2  ASN   9          1HD2      ASN   9  -3.349   8.808   5.497
   76   2HD2  ASN   9          2HD2      ASN   9  -2.915   8.002   7.003
   77    H    VAL  10           H        VAL  10  -2.881   9.290   0.960
   78    HA   VAL  10           HA       VAL  10  -2.697  11.829   2.276
   79    HB   VAL  10           HB       VAL  10  -3.520  11.307  -0.573
   80   1HG1  VAL  10          1HG1      VAL  10  -2.634  13.583  -0.973
   81   2HG1  VAL  10          2HG1      VAL  10  -3.965  13.619   0.178
   82   3HG1  VAL  10          3HG1      VAL  10  -2.304  13.754   0.775
   83   1HG2  VAL  10          1HG2      VAL  10  -1.311  10.235  -0.130
   84   2HG2  VAL  10          2HG2      VAL  10  -1.122  11.698  -1.103
   85   3HG2  VAL  10          3HG2      VAL  10  -0.763  11.729   0.633
   86    HA   PRO  11           HA       PRO  11  -7.130  12.265   3.302
   87   1HB   PRO  11          HB2       PRO  11  -6.221  15.119   3.511
   88   2HB   PRO  11          HB3       PRO  11  -7.266  14.201   4.625
   89   1HG   PRO  11          HG2       PRO  11  -4.715  14.593   5.285
   90   2HG   PRO  11          HG3       PRO  11  -5.417  12.954   5.484
   91   1HD   PRO  11          HD2       PRO  11  -3.700  13.990   3.193
   92   2HD   PRO  11          HD3       PRO  11  -3.571  12.463   4.115
   93    HA   PRO  12           HA       PRO  12  -8.859  13.780  -0.438
   94   1HB   PRO  12          HB2       PRO  12 -11.443  14.140   0.179
   95   2HB   PRO  12          HB3       PRO  12 -10.630  12.555   0.503
   96   1HG   PRO  12          HG2       PRO  12 -11.232  14.814   2.450
   97   2HG   PRO  12          HG3       PRO  12 -11.422  13.047   2.682
   98   1HD   PRO  12          HD2       PRO  12  -9.221  14.551   3.467
   99   2HD   PRO  12          HD3       PRO  12  -9.234  12.772   3.284
  100    H    SER  13           H        SER  13  -7.534  15.712  -0.615
  101    HA   SER  13           HA       SER  13  -8.276  18.248   0.635
  102   1HB   SER  13          HB2       SER  13  -6.047  17.581  -1.327
  103   2HB   SER  13          HB3       SER  13  -6.270  19.117  -0.451
  104    HG   SER  13           HG       SER  13  -4.771  17.693   0.581
  105    H    VAL  14           H        VAL  14 -10.455  18.052  -0.437
  106    HA   VAL  14           HA       VAL  14 -10.662  18.878  -3.136
  107    HB   VAL  14           HB       VAL  14 -12.465  17.787  -1.862
  108   1HG1  VAL  14          1HG1      VAL  14 -14.040  19.036  -0.485
  109   2HG1  VAL  14          2HG1      VAL  14 -12.431  19.178   0.221
  110   3HG1  VAL  14          3HG1      VAL  14 -13.152  20.535  -0.709
  111   1HG2  VAL  14          1HG2      VAL  14 -14.297  18.871  -3.007
  112   2HG2  VAL  14          2HG2      VAL  14 -13.373  20.379  -3.161
  113   3HG2  VAL  14          3HG2      VAL  14 -12.845  18.901  -4.024
  114    H    ARG  15           H        ARG  15 -11.024  20.849  -4.107
  115    HA   ARG  15           HA       ARG  15 -10.920  23.344  -2.499
  116   1HB   ARG  15          HB2       ARG  15  -8.996  24.200  -3.620
  117   2HB   ARG  15          HB3       ARG  15  -8.580  22.647  -2.915
  118   1HG   ARG  15          HG2       ARG  15  -9.241  21.763  -5.378
  119   2HG   ARG  15          HG3       ARG  15  -8.881  23.414  -5.808
  120   1HD   ARG  15          HD2       ARG  15  -6.888  22.226  -6.130
  121   2HD   ARG  15          HD3       ARG  15  -6.651  23.147  -4.647
  122    HE   ARG  15           HE       ARG  15  -7.589  20.682  -3.759
  123   1HH1  ARG  15          1HH1      ARG  15  -6.594  18.829  -3.397
  124   2HH1  ARG  15          2HH1      ARG  15  -5.004  18.504  -4.054
  125   1HH2  ARG  15          1HH2      ARG  15  -4.074  19.936  -5.454
  126   2HH2  ARG  15          2HH2      ARG  15  -4.888  21.430  -5.860
  127    H    ALA  16           H        ALA  16 -11.374  25.286  -3.763
  128    HA   ALA  16           HA       ALA  16 -13.419  24.769  -5.844
  129   1HB   ALA  16          HB1       ALA  16 -13.970  27.141  -5.561
  130   2HB   ALA  16          HB2       ALA  16 -14.053  26.247  -4.022
  131   3HB   ALA  16          HB3       ALA  16 -12.663  27.313  -4.359
  132    H    ARG  17           H        ARG  17 -12.906  24.783  -7.884
  133    HA   ARG  17           HA       ARG  17 -10.228  25.283  -8.772
  134   1HB   ARG  17          HB2       ARG  17 -11.769  23.601  -9.765
  135   2HB   ARG  17          HB3       ARG  17 -12.704  24.888 -10.523
  136   1HG   ARG  17          HG2       ARG  17 -10.712  25.620 -11.788
  137   2HG   ARG  17          HG3       ARG  17  -9.727  24.377 -11.018
  138   1HD   ARG  17          HD2       ARG  17 -12.199  23.781 -12.705
  139   2HD   ARG  17          HD3       ARG  17 -10.588  23.992 -13.395
  140    HE   ARG  17           HE       ARG  17 -11.598  21.615 -12.161
  141   1HH1  ARG  17          1HH1      ARG  17 -10.455  19.864 -12.133
  142   2HH1  ARG  17          2HH1      ARG  17  -8.679  19.885 -12.114
  143   1HH2  ARG  17          1HH2      ARG  17  -8.506  23.302 -12.520
  144   2HH2  ARG  17          2HH2      ARG  17  -7.638  21.801 -12.310
  145    H    GLN  18           H        GLN  18 -13.086  27.293  -9.166
  146    HA   GLN  18           HA       GLN  18 -11.391  29.546 -10.188
  147   1HB   GLN  18          HB2       GLN  18 -14.110  28.632 -11.112
  148   2HB   GLN  18          HB3       GLN  18 -13.394  30.149 -11.621
  149   1HG   GLN  18          HG2       GLN  18 -11.437  28.920 -12.550
  150   2HG   GLN  18          HG3       GLN  18 -12.204  27.385 -12.145
  151   1HE2  GLN  18          1HE2      GLN  18 -13.843  29.544 -15.271
  152   2HE2  GLN  18          2HE2      GLN  18 -12.982  30.435 -14.028
  153    H    SER  19           H        SER  19 -13.430  28.750  -7.663
  154    HA   SER  19           HA       SER  19 -14.246  29.818  -5.904
  155   1HB   SER  19          HB2       SER  19 -12.776  32.264  -6.909
  156   2HB   SER  19          HB3       SER  19 -13.395  32.004  -5.278
  157    HG   SER  19           HG       SER  19 -11.157  31.469  -5.481
  158    H    THR  20           H        THR  20 -14.798  31.780  -8.809
  159    HA   THR  20           HA       THR  20 -17.629  32.244  -8.114
  160    HB   THR  20           HB       THR  20 -15.694  34.552  -8.581
  161    HG1  THR  20           HG1      THR  20 -16.326  35.170  -6.509
  162   1HG2  THR  20          1HG2      THR  20 -18.723  34.524  -8.080
  163   2HG2  THR  20          2HG2      THR  20 -17.696  35.972  -8.076
  164   3HG2  THR  20          3HG2      THR  20 -17.897  35.056  -9.583
  165    H    MET  21           H        MET  21 -18.713  31.827  -9.819
  166    HA   MET  21           HA       MET  21 -17.603  32.098 -12.571
  167   1HB   MET  21          HB2       MET  21 -19.941  30.484 -11.541
  168   2HB   MET  21          HB3       MET  21 -19.281  30.470 -13.168
  169   1HG   MET  21          HG2       MET  21 -17.811  29.542 -10.654
  170   2HG   MET  21          HG3       MET  21 -18.569  28.498 -11.834
  171   1HE   MET  21          HE1       MET  21 -16.329  28.687 -14.935
  172   2HE   MET  21          HE2       MET  21 -17.930  28.341 -14.270
  173   3HE   MET  21          HE3       MET  21 -17.511  30.003 -14.716
  174    H    ASN  22           H        ASN  22 -19.329  32.605 -14.258
  175    HA   ASN  22           HA       ASN  22 -21.717  34.004 -13.403
  176   1HB   ASN  22          HB2       ASN  22 -21.267  36.087 -14.485
  177   2HB   ASN  22          HB3       ASN  22 -20.052  35.828 -13.253
  178   1HD2  ASN  22          1HD2      ASN  22 -17.358  35.879 -15.554
  179   2HD2  ASN  22          2HD2      ASN  22 -17.851  35.599 -13.894
  180    H    ALA  23           H        ALA  23 -23.193  34.497 -15.238
  181    HA   ALA  23           HA       ALA  23 -22.655  33.297 -17.847
  182   1HB   ALA  23          HB1       ALA  23 -22.943  31.304 -16.378
  183   2HB   ALA  23          HB2       ALA  23 -24.533  31.863 -15.882
  184   3HB   ALA  23          HB3       ALA  23 -24.232  31.408 -17.579
  185    H    THR  24           H        THR  24 -24.360  33.506 -19.330
  186    HA   THR  24           HA       THR  24 -26.392  35.527 -18.649
  187    HB   THR  24           HB       THR  24 -25.863  34.453 -21.423
  188    HG1  THR  24           HG1      THR  24 -24.486  36.259 -21.647
  189   1HG2  THR  24          1HG2      THR  24 -26.773  36.620 -22.120
  190   2HG2  THR  24          2HG2      THR  24 -27.947  35.826 -21.046
  191   3HG2  THR  24          3HG2      THR  24 -26.934  37.120 -20.410
  192    H    ALA  25           H        ALA  25 -28.355  34.843 -18.072
  193    HA   ALA  25           HA       ALA  25 -29.261  32.141 -18.435
  194   1HB   ALA  25          HB1       ALA  25 -31.336  33.151 -17.242
  195   2HB   ALA  25          HB2       ALA  25 -29.783  33.310 -16.402
  196   3HB   ALA  25          HB3       ALA  25 -30.479  34.695 -17.263
  197    H    ASN  26           H        ASN  26 -31.180  31.422 -19.351
  198    HA   ASN  26           HA       ASN  26 -32.928  31.172 -20.688
  199   1HB   ASN  26          HB2       ASN  26 -33.479  33.461 -19.517
  200   2HB   ASN  26          HB3       ASN  26 -33.167  34.173 -21.096
  201   1HD2  ASN  26          1HD2      ASN  26 -36.439  31.716 -20.514
  202   2HD2  ASN  26          2HD2      ASN  26 -34.970  31.523 -19.509
  203    H    LEU  27           H        LEU  27 -30.105  32.067 -21.933
  204    HA   LEU  27           HA       LEU  27 -30.907  32.128 -24.787
  205   1HB   LEU  27          HB2       LEU  27 -28.169  32.256 -23.491
  206   2HB   LEU  27          HB3       LEU  27 -28.502  32.397 -25.207
  207    HG   LEU  27           HG       LEU  27 -29.359  34.372 -23.070
  208   1HD1  LEU  27          1HD1      LEU  27 -27.807  35.878 -24.239
  209   2HD1  LEU  27          2HD1      LEU  27 -26.983  34.440 -23.652
  210   3HD1  LEU  27          3HD1      LEU  27 -27.396  34.576 -25.385
  211   1HD2  LEU  27          1HD2      LEU  27 -31.106  34.354 -24.759
  212   2HD2  LEU  27          2HD2      LEU  27 -30.112  35.808 -24.939
  213   3HD2  LEU  27          3HD2      LEU  27 -29.886  34.445 -26.056
  214    H    SER  28           H        SER  28 -30.903  29.691 -22.715
  215    HA   SER  28           HA       SER  28 -30.562  27.459 -22.678
  216   1HB   SER  28          HB2       SER  28 -30.292  27.657 -25.719
  217   2HB   SER  28          HB3       SER  28 -30.552  26.172 -24.774
  218    HG   SER  28           HG       SER  28 -32.505  27.100 -25.621
  219    H    GLN  29           H        GLN  29 -28.291  29.275 -22.366
  220    HA   GLN  29           HA       GLN  29 -25.980  28.168 -23.662
  221   1HB   GLN  29          HB2       GLN  29 -26.356  30.535 -22.941
  222   2HB   GLN  29          HB3       GLN  29 -26.148  29.992 -21.264
  223   1HG   GLN  29          HG2       GLN  29 -24.200  31.159 -22.183
  224   2HG   GLN  29          HG3       GLN  29 -23.805  29.562 -21.625
  225   1HE2  GLN  29          1HE2      GLN  29 -23.146  30.510 -25.525
  226   2HE2  GLN  29          2HE2      GLN  29 -23.779  31.705 -24.395
  227    H    SER  30           H        SER  30 -24.016  27.607 -22.302
  228    HA   SER  30           HA       SER  30 -24.654  25.645 -20.128
  229   1HB   SER  30          HB2       SER  30 -22.799  25.126 -22.467
  230   2HB   SER  30          HB3       SER  30 -23.104  24.046 -21.091
  231    HG   SER  30           HG       SER  30 -24.377  23.574 -23.017
  232    H    VAL  31           H        VAL  31 -23.001  25.130 -18.732
  233    HA   VAL  31           HA       VAL  31 -20.637  26.993 -18.588
  234    HB   VAL  31           HB       VAL  31 -22.794  26.566 -16.448
  235   1HG1  VAL  31          1HG1      VAL  31 -21.531  28.193 -15.067
  236   2HG1  VAL  31          2HG1      VAL  31 -20.614  26.686 -15.337
  237   3HG1  VAL  31          3HG1      VAL  31 -20.216  28.171 -16.253
  238   1HG2  VAL  31          1HG2      VAL  31 -21.909  29.106 -17.862
  239   2HG2  VAL  31          2HG2      VAL  31 -23.437  28.231 -18.160
  240   3HG2  VAL  31          3HG2      VAL  31 -23.155  28.967 -16.592
  241    H    THR  32           H        THR  32 -18.795  26.039 -17.710
  242    HA   THR  32           HA       THR  32 -19.081  23.420 -16.290
  243    HB   THR  32           HB       THR  32 -16.559  24.498 -17.566
  244    HG1  THR  32           HG1      THR  32 -18.069  23.941 -19.155
  245   1HG2  THR  32          1HG2      THR  32 -17.284  21.737 -16.418
  246   2HG2  THR  32          2HG2      THR  32 -15.794  22.127 -17.303
  247   3HG2  THR  32          3HG2      THR  32 -16.117  22.874 -15.741
  248    H    LEU  33           H        LEU  33 -18.305  23.287 -14.204
  249    HA   LEU  33           HA       LEU  33 -16.337  25.132 -13.145
  250   1HB   LEU  33          HB2       LEU  33 -17.562  26.139 -11.428
  251   2HB   LEU  33          HB3       LEU  33 -18.463  26.440 -12.896
  252    HG   LEU  33           HG       LEU  33 -19.193  24.211 -10.938
  253   1HD1  LEU  33          1HD1      LEU  33 -20.403  26.989 -11.140
  254   2HD1  LEU  33          2HD1      LEU  33 -20.771  25.684  -9.983
  255   3HD1  LEU  33          3HD1      LEU  33 -19.212  26.508  -9.909
  256   1HD2  LEU  33          1HD2      LEU  33 -20.321  23.855 -13.092
  257   2HD2  LEU  33          2HD2      LEU  33 -21.469  24.464 -11.898
  258   3HD2  LEU  33          3HD2      LEU  33 -20.853  25.535 -13.152
  259    H    ALA  34           H        ALA  34 -15.788  24.504 -10.742
  260    HA   ALA  34           HA       ALA  34 -16.370  21.669 -10.174
  261   1HB   ALA  34          HB1       ALA  34 -14.179  20.870 -10.715
  262   2HB   ALA  34          HB2       ALA  34 -14.750  21.760 -12.146
  263   3HB   ALA  34          HB3       ALA  34 -13.597  22.510 -11.048
  264    H    CYS  35           H        CYS  35 -15.741  20.894  -8.329
  265    HA   CYS  35           HA       CYS  35 -14.102  22.525  -6.403
  266   1HB   CYS  35          HB2       CYS  35 -16.562  20.795  -5.971
  267   2HB   CYS  35          HB3       CYS  35 -15.309  20.845  -4.756
  268    H    ASP  36           H        ASP  36 -12.143  21.555  -7.383
  269    HA   ASP  36           HA       ASP  36 -12.269  18.712  -8.079
  270   1HB   ASP  36          HB2       ASP  36 -10.176  18.949  -9.123
  271   2HB   ASP  36          HB3       ASP  36 -11.149  20.346  -9.559
  272    H    ALA  37           H        ALA  37 -11.619  17.020  -7.063
  273    HA   ALA  37           HA       ALA  37 -10.220  17.396  -4.429
  274   1HB   ALA  37          HB1       ALA  37 -12.097  15.193  -5.320
  275   2HB   ALA  37          HB2       ALA  37 -11.374  15.361  -3.702
  276   3HB   ALA  37          HB3       ALA  37 -12.552  16.542  -4.286
  277    H    ASP  38           H        ASP  38  -8.694  15.973  -3.759
  278    HA   ASP  38           HA       ASP  38  -7.723  13.762  -5.440
  279   1HB   ASP  38          HB2       ASP  38  -6.506  15.725  -6.310
  280   2HB   ASP  38          HB3       ASP  38  -5.982  16.154  -4.684
  281    H    GLY  39           H        GLY  39  -6.519  12.272  -4.264
  282   1HA   GLY  39          HA2       GLY  39  -5.463  12.410  -1.670
  283   2HA   GLY  39          HA3       GLY  39  -7.148  11.993  -1.478
  284    H    PHE  40           H        PHE  40  -5.551  10.095  -0.586
  285    HA   PHE  40           HA       PHE  40  -5.994   7.891  -2.447
  286   1HB   PHE  40          HB2       PHE  40  -3.817   8.663  -3.215
  287   2HB   PHE  40          HB3       PHE  40  -3.165   8.552  -1.580
  288    HD1  PHE  40           HD1      PHE  40  -4.339   6.685  -4.554
  289    HD2  PHE  40           HD2      PHE  40  -2.730   6.334  -0.561
  290    HE1  PHE  40           HE1      PHE  40  -4.004   4.251  -4.894
  291    HE2  PHE  40           HE2      PHE  40  -2.498   3.899  -0.857
  292    HZ   PHE  40           HZ       PHE  40  -3.134   2.842  -3.037
  293    HA   PRO  41           HA       PRO  41  -6.228   5.602  -2.313
  294   1HB   PRO  41          HB2       PRO  41  -8.254   4.354  -0.504
  295   2HB   PRO  41          HB3       PRO  41  -7.248   3.610  -1.779
  296   1HG   PRO  41          HG2       PRO  41  -6.662   3.305   0.858
  297   2HG   PRO  41          HG3       PRO  41  -5.356   3.579  -0.324
  298   1HD   PRO  41          HD2       PRO  41  -6.672   5.605   1.519
  299   2HD   PRO  41          HD3       PRO  41  -4.937   5.358   1.155
  300    H    GLU  42           H        GLU  42  -8.240   5.645  -3.552
  301    HA   GLU  42           HA       GLU  42  -9.005   8.109  -4.072
  302   1HB   GLU  42          HB2       GLU  42 -10.624   7.313  -5.581
  303   2HB   GLU  42          HB3       GLU  42  -9.287   6.195  -5.564
  304   1HG   GLU  42          HG2       GLU  42 -12.015   5.798  -4.230
  305   2HG   GLU  42          HG3       GLU  42 -11.453   5.046  -5.720
  306    HA   PRO  43           HA       PRO  43 -12.033   9.398  -1.099
  307   1HB   PRO  43          HB2       PRO  43 -12.407  11.992  -1.814
  308   2HB   PRO  43          HB3       PRO  43 -10.776  11.392  -1.433
  309   1HG   PRO  43          HG2       PRO  43 -11.995  11.626  -4.179
  310   2HG   PRO  43          HG3       PRO  43 -10.438  12.300  -3.594
  311   1HD   PRO  43          HD2       PRO  43 -10.617   9.875  -4.900
  312   2HD   PRO  43          HD3       PRO  43  -9.419  10.196  -3.597
  313    H    THR  44           H        THR  44 -14.113  10.238  -0.752
  314    HA   THR  44           HA       THR  44 -16.173   9.925  -2.936
  315    HB   THR  44           HB       THR  44 -16.509   9.642   0.083
  316    HG1  THR  44           HG1      THR  44 -15.413   7.888  -0.881
  317   1HG2  THR  44          1HG2      THR  44 -18.462   9.209  -2.222
  318   2HG2  THR  44          2HG2      THR  44 -18.740   8.677  -0.552
  319   3HG2  THR  44          3HG2      THR  44 -18.576  10.422  -0.900
  320    H    MET  45           H        MET  45 -17.694  11.659  -3.090
  321    HA   MET  45           HA       MET  45 -17.432  13.996  -1.345
  322   1HB   MET  45          HB2       MET  45 -16.741  15.509  -3.182
  323   2HB   MET  45          HB3       MET  45 -15.525  14.300  -2.838
  324   1HG   MET  45          HG2       MET  45 -16.617  12.929  -4.746
  325   2HG   MET  45          HG3       MET  45 -17.432  14.429  -5.204
  326   1HE   MET  45          HE1       MET  45 -16.238  16.577  -5.973
  327   2HE   MET  45          HE2       MET  45 -15.143  16.624  -4.563
  328   3HE   MET  45          HE3       MET  45 -14.484  16.753  -6.207
  329    H    THR  46           H        THR  46 -18.969  15.646  -1.674
  330    HA   THR  46           HA       THR  46 -20.997  15.513  -3.767
  331    HB   THR  46           HB       THR  46 -22.933  15.679  -2.187
  332    HG1  THR  46           HG1      THR  46 -21.072  14.686  -0.292
  333   1HG2  THR  46          1HG2      THR  46 -23.282  13.353  -1.695
  334   2HG2  THR  46          2HG2      THR  46 -22.532  13.533  -3.305
  335   3HG2  THR  46          3HG2      THR  46 -21.546  13.000  -1.915
  336    H    TRP  47           H        TRP  47 -22.570  17.429  -3.513
  337    HA   TRP  47           HA       TRP  47 -21.681  19.671  -1.931
  338   1HB   TRP  47          HB2       TRP  47 -21.073  21.157  -3.839
  339   2HB   TRP  47          HB3       TRP  47 -19.979  19.858  -3.452
  340    HD1  TRP  47           HD1      TRP  47 -20.255  17.598  -5.119
  341    HE1  TRP  47           HE1      TRP  47 -19.569  17.749  -7.592
  342    HE3  TRP  47           HE3      TRP  47 -21.110  22.573  -5.861
  343    HZ2  TRP  47           HZ2      TRP  47 -18.945  19.888  -9.440
  344    HZ3  TRP  47           HZ3      TRP  47 -20.379  23.665  -7.954
  345    HH2  TRP  47           HH2      TRP  47 -19.294  22.352  -9.724
  346    H    THR  48           H        THR  48 -22.762  21.731  -2.480
  347    HA   THR  48           HA       THR  48 -25.637  21.229  -3.144
  348    HB   THR  48           HB       THR  48 -26.331  22.276  -1.052
  349    HG1  THR  48           HG1      THR  48 -23.571  22.529  -0.444
  350   1HG2  THR  48          1HG2      THR  48 -24.195  20.252  -0.276
  351   2HG2  THR  48          2HG2      THR  48 -25.589  20.776   0.677
  352   3HG2  THR  48          3HG2      THR  48 -25.850  19.859  -0.827
  353    H    LYS  49           H        LYS  49 -26.932  23.164  -3.432
  354    HA   LYS  49           HA       LYS  49 -25.347  25.666  -3.952
  355   1HB   LYS  49          HB2       LYS  49 -27.112  26.433  -5.411
  356   2HB   LYS  49          HB3       LYS  49 -26.275  25.030  -6.029
  357   1HG   LYS  49          HG2       LYS  49 -28.240  24.015  -6.387
  358   2HG   LYS  49          HG3       LYS  49 -28.602  24.040  -4.660
  359   1HD   LYS  49          HD2       LYS  49 -30.425  25.165  -5.704
  360   2HD   LYS  49          HD3       LYS  49 -29.445  26.429  -4.997
  361   1HE   LYS  49          HE2       LYS  49 -28.319  26.541  -7.434
  362   2HE   LYS  49          HE3       LYS  49 -29.762  25.672  -7.934
  363   1HZ   LYS  49          HZ1       LYS  49 -29.574  28.396  -6.819
  364   2HZ   LYS  49          HZ2       LYS  49 -30.300  27.899  -8.160
  365   3HZ   LYS  49          HZ3       LYS  49 -31.015  27.537  -6.745
  366    H    ASP  50           H        ASP  50 -25.329  26.545  -2.034
  367    HA   ASP  50           HA       ASP  50 -25.898  27.711  -0.239
  368   1HB   ASP  50          HB2       ASP  50 -27.357  28.977  -1.745
  369   2HB   ASP  50          HB3       ASP  50 -28.702  27.898  -1.401
  370    H    GLY  51           H        GLY  51 -27.931  24.900  -0.849
  371   1HA   GLY  51          HA2       GLY  51 -27.421  23.781   1.703
  372   2HA   GLY  51          HA3       GLY  51 -29.037  24.514   1.705
  373    H    GLU  52           H        GLU  52 -29.500  23.759  -1.206
  374    HA   GLU  52           HA       GLU  52 -30.312  20.978  -0.695
  375   1HB   GLU  52          HB2       GLU  52 -31.695  21.111  -2.637
  376   2HB   GLU  52          HB3       GLU  52 -31.964  22.474  -1.561
  377   1HG   GLU  52          HG2       GLU  52 -30.506  23.883  -3.083
  378   2HG   GLU  52          HG3       GLU  52 -30.356  22.474  -4.166
  379    HA   PRO  53           HA       PRO  53 -26.922  19.220  -2.660
  380   1HB   PRO  53          HB2       PRO  53 -27.717  16.636  -3.189
  381   2HB   PRO  53          HB3       PRO  53 -27.577  17.324  -1.547
  382   1HG   PRO  53          HG2       PRO  53 -30.058  17.110  -3.295
  383   2HG   PRO  53          HG3       PRO  53 -29.881  16.577  -1.601
  384   1HD   PRO  53          HD2       PRO  53 -30.960  18.983  -2.215
  385   2HD   PRO  53          HD3       PRO  53 -29.871  18.781  -0.792
  386    H    ILE  54           H        ILE  54 -25.800  18.727  -4.387
  387    HA   ILE  54           HA       ILE  54 -26.967  18.486  -7.108
  388    HB   ILE  54           HB       ILE  54 -24.254  19.641  -6.383
  389   1HG1  ILE  54          2HG1      ILE  54 -26.523  21.455  -7.238
  390   2HG1  ILE  54          3HG1      ILE  54 -26.324  21.099  -5.546
  391   1HG2  ILE  54          1HG2      ILE  54 -24.450  18.863  -8.740
  392   2HG2  ILE  54          2HG2      ILE  54 -25.923  19.831  -8.961
  393   3HG2  ILE  54          3HG2      ILE  54 -24.333  20.610  -8.686
  394   1HD1  ILE  54          1HD1      ILE  54 -25.130  23.133  -6.140
  395   2HD1  ILE  54          2HD1      ILE  54 -24.069  21.862  -5.516
  396   3HD1  ILE  54          3HD1      ILE  54 -24.080  22.209  -7.231
  397    H    GLU  55           H        GLU  55 -26.822  16.347  -5.435
  398    HA   GLU  55           HA       GLU  55 -24.497  14.887  -5.154
  399   1HB   GLU  55          HB2       GLU  55 -26.038  12.901  -4.966
  400   2HB   GLU  55          HB3       GLU  55 -26.281  14.283  -3.851
  401   1HG   GLU  55          HG2       GLU  55 -28.200  14.993  -5.401
  402   2HG   GLU  55          HG3       GLU  55 -27.984  13.449  -6.251
  403    H    GLN  56           H        GLN  56 -23.109  14.806  -6.874
  404    HA   GLN  56           HA       GLN  56 -23.657  13.721  -9.421
  405   1HB   GLN  56          HB2       GLN  56 -21.099  13.968  -7.806
  406   2HB   GLN  56          HB3       GLN  56 -21.116  13.432  -9.483
  407   1HG   GLN  56          HG2       GLN  56 -22.143  15.529 -10.205
  408   2HG   GLN  56          HG3       GLN  56 -22.160  16.131  -8.561
  409   1HE2  GLN  56          1HE2      GLN  56 -18.906  16.979 -10.627
  410   2HE2  GLN  56          2HE2      GLN  56 -20.501  16.694 -11.298
  411    H    GLU  57           H        GLU  57 -24.002  12.011  -6.622
  412    HA   GLU  57           HA       GLU  57 -23.130   9.409  -7.761
  413   1HB   GLU  57          HB2       GLU  57 -23.363   8.477  -5.617
  414   2HB   GLU  57          HB3       GLU  57 -22.426   9.967  -5.469
  415   1HG   GLU  57          HG2       GLU  57 -24.301  11.157  -4.551
  416   2HG   GLU  57          HG3       GLU  57 -25.398   9.784  -4.856
  417    H    ASP  58           H        ASP  58 -25.916  11.260  -7.906
  418    HA   ASP  58           HA       ASP  58 -27.490   8.939  -8.731
  419   1HB   ASP  58          HB2       ASP  58 -27.728   9.054  -6.195
  420   2HB   ASP  58          HB3       ASP  58 -28.409  10.653  -6.383
  421    H    ASN  59           H        ASN  59 -27.183  12.434  -8.430
  422    HA   ASN  59           HA       ASN  59 -29.587  12.836 -10.186
  423   1HB   ASN  59          HB2       ASN  59 -29.572  13.949  -8.001
  424   2HB   ASN  59          HB3       ASN  59 -28.122  14.830  -8.434
  425   1HD2  ASN  59          1HD2      ASN  59 -30.547  17.341  -9.169
  426   2HD2  ASN  59          2HD2      ASN  59 -29.393  16.781  -7.975
  427    H    GLU  60           H        GLU  60 -29.550  14.235 -11.922
  428    HA   GLU  60           HA       GLU  60 -27.077  15.001 -13.366
  429   1HB   GLU  60          HB2       GLU  60 -29.102  12.922 -14.326
  430   2HB   GLU  60          HB3       GLU  60 -27.835  13.606 -15.324
  431   1HG   GLU  60          HG2       GLU  60 -26.120  12.581 -13.796
  432   2HG   GLU  60          HG3       GLU  60 -27.444  11.769 -12.939
  433    H    GLU  61           H        GLU  61 -29.974  15.999 -12.381
  434    HA   GLU  61           HA       GLU  61 -31.906  16.537 -13.853
  435   1HB   GLU  61          HB2       GLU  61 -31.035  17.747 -11.685
  436   2HB   GLU  61          HB3       GLU  61 -30.638  19.079 -12.793
  437   1HG   GLU  61          HG2       GLU  61 -33.003  19.007 -13.624
  438   2HG   GLU  61          HG3       GLU  61 -33.350  17.714 -12.465
  439    H    LYS  62           H        LYS  62 -29.112  18.558 -14.575
  440    HA   LYS  62           HA       LYS  62 -29.590  18.451 -17.429
  441   1HB   LYS  62          HB2       LYS  62 -29.680  20.853 -17.917
  442   2HB   LYS  62          HB3       LYS  62 -31.107  20.241 -17.111
  443   1HG   LYS  62          HG2       LYS  62 -30.212  21.204 -14.925
  444   2HG   LYS  62          HG3       LYS  62 -28.895  21.928 -15.864
  445   1HD   LYS  62          HD2       LYS  62 -30.725  23.088 -17.267
  446   2HD   LYS  62          HD3       LYS  62 -31.871  22.543 -16.019
  447   1HE   LYS  62          HE2       LYS  62 -30.484  23.652 -14.259
  448   2HE   LYS  62          HE3       LYS  62 -29.340  24.151 -15.527
  449   1HZ   LYS  62          HZ1       LYS  62 -30.754  25.945 -15.050
  450   2HZ   LYS  62          HZ2       LYS  62 -31.165  25.451 -16.550
  451   3HZ   LYS  62          HZ3       LYS  62 -32.135  25.072 -15.266
  452    H    TYR  63           H        TYR  63 -27.613  17.332 -16.001
  453    HA   TYR  63           HA       TYR  63 -25.254  18.830 -16.879
  454   1HB   TYR  63          HB2       TYR  63 -24.228  18.982 -14.668
  455   2HB   TYR  63          HB3       TYR  63 -25.685  19.911 -14.794
  456    HD1  TYR  63           HD1      TYR  63 -27.363  19.741 -13.131
  457    HD2  TYR  63           HD2      TYR  63 -24.342  16.687 -13.499
  458    HE1  TYR  63           HE1      TYR  63 -28.056  18.786 -10.945
  459    HE2  TYR  63           HE2      TYR  63 -24.979  15.801 -11.280
  460    HH   TYR  63           HH       TYR  63 -26.322  15.989  -9.503
  461    H    SER  64           H        SER  64 -23.211  17.823 -16.474
  462    HA   SER  64           HA       SER  64 -23.044  14.923 -16.049
  463   1HB   SER  64          HB2       SER  64 -21.993  14.600 -18.338
  464   2HB   SER  64          HB3       SER  64 -23.741  14.843 -18.315
  465    HG   SER  64           HG       SER  64 -21.748  16.761 -19.015
  466    H    PHE  65           H        PHE  65 -21.011  14.282 -15.489
  467    HA   PHE  65           HA       PHE  65 -18.802  16.223 -15.433
  468   1HB   PHE  65          HB2       PHE  65 -18.807  15.772 -12.993
  469   2HB   PHE  65          HB3       PHE  65 -20.327  16.422 -13.602
  470    HD1  PHE  65           HD1      PHE  65 -22.406  15.313 -13.369
  471    HD2  PHE  65           HD2      PHE  65 -18.721  13.250 -12.454
  472    HE1  PHE  65           HE1      PHE  65 -23.716  13.351 -12.623
  473    HE2  PHE  65           HE2      PHE  65 -20.033  11.306 -11.663
  474    HZ   PHE  65           HZ       PHE  65 -22.507  11.291 -11.827
  475    H    ASN  66           H        ASN  66 -16.963  15.173 -14.036
  476    HA   ASN  66           HA       ASN  66 -16.538  12.309 -14.679
  477   1HB   ASN  66          HB2       ASN  66 -14.162  12.809 -15.184
  478   2HB   ASN  66          HB3       ASN  66 -15.276  13.502 -16.345
  479   1HD2  ASN  66          1HD2      ASN  66 -13.514  16.336 -13.925
  480   2HD2  ASN  66          2HD2      ASN  66 -14.422  15.040 -13.162
  481    H    TYR  67           H        TYR  67 -14.950  11.242 -13.401
  482    HA   TYR  67           HA       TYR  67 -14.652  12.181 -10.572
  483   1HB   TYR  67          HB2       TYR  67 -14.108   9.481 -11.881
  484   2HB   TYR  67          HB3       TYR  67 -13.946   9.843 -10.187
  485    HD1  TYR  67           HD1      TYR  67 -16.025  10.564  -8.858
  486    HD2  TYR  67           HD2      TYR  67 -16.234   8.840 -12.831
  487    HE1  TYR  67           HE1      TYR  67 -18.403  10.005  -8.498
  488    HE2  TYR  67           HE2      TYR  67 -18.621   8.228 -12.404
  489    HH   TYR  67           HH       TYR  67 -20.291   9.024  -9.348
  490    H    ASP  68           H        ASP  68 -12.394  11.364  -9.625
  491    HA   ASP  68           HA       ASP  68 -10.243  11.994  -9.358
  492   1HB   ASP  68          HB2       ASP  68  -9.992  10.265 -11.215
  493   2HB   ASP  68          HB3       ASP  68  -9.847  11.597 -12.351
  494    H    GLY  69           H        GLY  69 -12.119  14.040  -9.713
  495   1HA   GLY  69          HA2       GLY  69 -10.640  16.474  -9.950
  496   2HA   GLY  69          HA3       GLY  69 -11.526  16.143 -11.464
  497    H    SER  70           H        SER  70 -13.452  17.026 -11.541
  498    HA   SER  70           HA       SER  70 -15.583  16.393  -9.762
  499   1HB   SER  70          HB2       SER  70 -14.861  17.858  -8.117
  500   2HB   SER  70          HB3       SER  70 -14.241  19.025  -9.295
  501    HG   SER  70           HG       SER  70 -16.964  18.575  -8.701
  502    H    GLU  71           H        GLU  71 -14.307  18.473 -12.190
  503    HA   GLU  71           HA       GLU  71 -15.763  20.244 -13.287
  504   1HB   GLU  71          HB2       GLU  71 -14.778  17.872 -14.888
  505   2HB   GLU  71          HB3       GLU  71 -15.336  19.384 -15.584
  506   1HG   GLU  71          HG2       GLU  71 -12.927  19.361 -15.523
  507   2HG   GLU  71          HG3       GLU  71 -13.574  20.646 -14.512
  508    H    LEU  72           H        LEU  72 -17.781  20.419 -12.601
  509    HA   LEU  72           HA       LEU  72 -19.941  18.679 -13.635
  510   1HB   LEU  72          HB2       LEU  72 -19.993  19.455 -11.325
  511   2HB   LEU  72          HB3       LEU  72 -19.852  21.142 -11.837
  512    HG   LEU  72           HG       LEU  72 -22.082  20.892 -13.016
  513   1HD1  LEU  72          1HD1      LEU  72 -22.169  18.437 -13.188
  514   2HD1  LEU  72          2HD1      LEU  72 -22.186  18.294 -11.398
  515   3HD1  LEU  72          3HD1      LEU  72 -23.536  19.062 -12.257
  516   1HD2  LEU  72          1HD2      LEU  72 -21.911  21.984 -10.847
  517   2HD2  LEU  72          2HD2      LEU  72 -23.414  21.033 -10.976
  518   3HD2  LEU  72          3HD2      LEU  72 -22.054  20.412 -10.015
  519    H    ILE  73           H        ILE  73 -20.549  19.032 -15.676
  520    HA   ILE  73           HA       ILE  73 -20.536  21.796 -16.817
  521    HB   ILE  73           HB       ILE  73 -21.058  19.211 -18.288
  522   1HG1  ILE  73          2HG1      ILE  73 -18.411  20.644 -18.576
  523   2HG1  ILE  73          3HG1      ILE  73 -18.600  19.537 -17.235
  524   1HG2  ILE  73          1HG2      ILE  73 -20.553  20.730 -20.266
  525   2HG2  ILE  73          2HG2      ILE  73 -21.922  21.321 -19.300
  526   3HG2  ILE  73          3HG2      ILE  73 -20.345  22.071 -19.108
  527   1HD1  ILE  73          1HD1      ILE  73 -19.211  17.720 -18.744
  528   2HD1  ILE  73          2HD1      ILE  73 -19.054  18.795 -20.152
  529   3HD1  ILE  73          3HD1      ILE  73 -17.614  18.416 -19.169
  530    H    ILE  74           H        ILE  74 -22.337  22.856 -16.653
  531    HA   ILE  74           HA       ILE  74 -24.964  21.439 -16.338
  532    HB   ILE  74           HB       ILE  74 -24.292  24.303 -15.584
  533   1HG1  ILE  74          2HG1      ILE  74 -24.502  21.831 -13.785
  534   2HG1  ILE  74          3HG1      ILE  74 -23.063  22.817 -14.095
  535   1HG2  ILE  74          1HG2      ILE  74 -26.716  23.804 -16.197
  536   2HG2  ILE  74          2HG2      ILE  74 -26.730  22.541 -14.923
  537   3HG2  ILE  74          3HG2      ILE  74 -26.528  24.269 -14.510
  538   1HD1  ILE  74          1HD1      ILE  74 -25.513  23.611 -12.514
  539   2HD1  ILE  74          2HD1      ILE  74 -23.866  23.389 -11.963
  540   3HD1  ILE  74          3HD1      ILE  74 -24.228  24.756 -13.030
  541    H    LYS  75           H        LYS  75 -26.275  21.536 -18.045
  542    HA   LYS  75           HA       LYS  75 -25.842  23.651 -20.105
  543   1HB   LYS  75          HB2       LYS  75 -26.781  22.203 -21.748
  544   2HB   LYS  75          HB3       LYS  75 -25.436  21.427 -20.920
  545   1HG   LYS  75          HG2       LYS  75 -27.645  20.521 -19.433
  546   2HG   LYS  75          HG3       LYS  75 -28.320  20.659 -21.034
  547   1HD   LYS  75          HD2       LYS  75 -27.527  18.421 -20.736
  548   2HD   LYS  75          HD3       LYS  75 -26.450  19.213 -21.899
  549   1HE   LYS  75          HE2       LYS  75 -24.806  19.624 -20.028
  550   2HE   LYS  75          HE3       LYS  75 -25.915  18.788 -18.913
  551   1HZ   LYS  75          HZ1       LYS  75 -24.652  17.564 -21.289
  552   2HZ   LYS  75          HZ2       LYS  75 -24.169  17.290 -19.743
  553   3HZ   LYS  75          HZ3       LYS  75 -25.658  16.788 -20.231
  554    H    LYS  76           H        LYS  76 -27.605  24.576 -21.022
  555    HA   LYS  76           HA       LYS  76 -29.613  25.646 -21.200
  556   1HB   LYS  76          HB2       LYS  76 -30.424  23.257 -21.363
  557   2HB   LYS  76          HB3       LYS  76 -30.791  23.284 -19.651
  558   1HG   LYS  76          HG2       LYS  76 -32.429  25.100 -19.984
  559   2HG   LYS  76          HG3       LYS  76 -32.012  25.170 -21.703
  560   1HD   LYS  76          HD2       LYS  76 -33.231  22.717 -20.307
  561   2HD   LYS  76          HD3       LYS  76 -34.117  23.936 -21.226
  562   1HE   LYS  76          HE2       LYS  76 -32.796  23.378 -23.250
  563   2HE   LYS  76          HE3       LYS  76 -31.921  22.139 -22.324
  564   1HZ   LYS  76          HZ1       LYS  76 -34.867  22.138 -22.822
  565   2HZ   LYS  76          HZ2       LYS  76 -33.774  21.173 -23.562
  566   3HZ   LYS  76          HZ3       LYS  76 -34.054  20.993 -21.971
  567    H    VAL  77           H        VAL  77 -28.056  26.873 -19.622
  568    HA   VAL  77           HA       VAL  77 -28.894  27.031 -16.874
  569    HB   VAL  77           HB       VAL  77 -26.912  28.594 -18.544
  570   1HG1  VAL  77          1HG1      VAL  77 -25.943  29.453 -16.423
  571   2HG1  VAL  77          2HG1      VAL  77 -27.543  30.119 -16.727
  572   3HG1  VAL  77          3HG1      VAL  77 -27.361  28.835 -15.550
  573   1HG2  VAL  77          1HG2      VAL  77 -26.635  26.429 -16.396
  574   2HG2  VAL  77          2HG2      VAL  77 -26.342  26.218 -18.141
  575   3HG2  VAL  77          3HG2      VAL  77 -25.292  27.274 -17.179
  576    H    ASP  78           H        ASP  78 -29.968  28.550 -15.745
  577    HA   ASP  78           HA       ASP  78 -30.918  31.014 -17.042
  578   1HB   ASP  78          HB2       ASP  78 -32.601  28.935 -17.181
  579   2HB   ASP  78          HB3       ASP  78 -32.985  29.479 -15.542
  580    H    LYS  79           H        LYS  79 -32.367  32.176 -15.109
  581    HA   LYS  79           HA       LYS  79 -30.381  32.920 -13.169
  582   1HB   LYS  79          HB2       LYS  79 -33.351  33.594 -13.341
  583   2HB   LYS  79          HB3       LYS  79 -32.248  34.247 -12.126
  584   1HG   LYS  79          HG2       LYS  79 -30.801  35.185 -13.947
  585   2HG   LYS  79          HG3       LYS  79 -31.931  34.555 -15.141
  586   1HD   LYS  79          HD2       LYS  79 -32.372  36.909 -14.807
  587   2HD   LYS  79          HD3       LYS  79 -33.747  35.974 -14.235
  588   1HE   LYS  79          HE2       LYS  79 -32.983  36.210 -11.911
  589   2HE   LYS  79          HE3       LYS  79 -31.556  37.105 -12.457
  590   1HZ   LYS  79          HZ1       LYS  79 -34.369  38.010 -12.847
  591   2HZ   LYS  79          HZ2       LYS  79 -33.375  38.594 -11.720
  592   3HZ   LYS  79          HZ3       LYS  79 -33.017  38.849 -13.288
  593    H    SER  80           H        SER  80 -32.695  30.338 -13.033
  594    HA   SER  80           HA       SER  80 -32.792  30.013 -10.167
  595   1HB   SER  80          HB2       SER  80 -33.684  27.747 -10.846
  596   2HB   SER  80          HB3       SER  80 -34.536  29.137 -11.533
  597    HG   SER  80           HG       SER  80 -32.714  27.362 -12.828
  598    H    ASP  81           H        ASP  81 -30.246  29.467 -12.430
  599    HA   ASP  81           HA       ASP  81 -28.932  27.416 -10.788
  600   1HB   ASP  81          HB2       ASP  81 -28.047  28.810 -13.326
  601   2HB   ASP  81          HB3       ASP  81 -27.168  27.509 -12.542
  602    H    GLU  82           H        GLU  82 -29.254  30.722 -10.328
  603    HA   GLU  82           HA       GLU  82 -26.608  31.487  -9.550
  604   1HB   GLU  82          HB2       GLU  82 -28.387  33.103  -9.796
  605   2HB   GLU  82          HB3       GLU  82 -29.317  32.341  -8.492
  606   1HG   GLU  82          HG2       GLU  82 -27.570  32.946  -6.858
  607   2HG   GLU  82          HG3       GLU  82 -26.541  33.542  -8.147
  608    H    ALA  83           H        ALA  83 -25.371  30.878  -7.765
  609    HA   ALA  83           HA       ALA  83 -26.570  29.345  -5.570
  610   1HB   ALA  83          HB1       ALA  83 -26.413  27.651  -7.353
  611   2HB   ALA  83          HB2       ALA  83 -24.745  28.138  -7.688
  612   3HB   ALA  83          HB3       ALA  83 -25.122  27.324  -6.184
  613    H    GLU  84           H        GLU  84 -25.259  28.815  -3.893
  614    HA   GLU  84           HA       GLU  84 -22.479  29.838  -3.819
  615   1HB   GLU  84          HB2       GLU  84 -24.003  30.949  -2.211
  616   2HB   GLU  84          HB3       GLU  84 -24.366  29.372  -1.458
  617   1HG   GLU  84          HG2       GLU  84 -22.032  29.121  -0.786
  618   2HG   GLU  84          HG3       GLU  84 -21.559  30.515  -1.722
  619    H    TYR  85           H        TYR  85 -21.397  28.099  -4.527
  620    HA   TYR  85           HA       TYR  85 -22.455  25.406  -4.235
  621   1HB   TYR  85          HB2       TYR  85 -20.209  26.625  -5.799
  622   2HB   TYR  85          HB3       TYR  85 -20.466  24.880  -5.760
  623    HD1  TYR  85           HD1      TYR  85 -23.057  24.221  -6.134
  624    HD2  TYR  85           HD2      TYR  85 -21.069  27.679  -7.757
  625    HE1  TYR  85           HE1      TYR  85 -24.647  24.249  -8.077
  626    HE2  TYR  85           HE2      TYR  85 -22.611  27.644  -9.699
  627    HH   TYR  85           HH       TYR  85 -24.393  26.582 -10.718
  628    H    ILE  86           H        ILE  86 -22.210  25.173  -1.960
  629    HA   ILE  86           HA       ILE  86 -19.463  24.978  -0.827
  630    HB   ILE  86           HB       ILE  86 -22.146  24.305   0.448
  631   1HG1  ILE  86          2HG1      ILE  86 -20.454  26.838   0.679
  632   2HG1  ILE  86          3HG1      ILE  86 -21.991  26.700  -0.187
  633   1HG2  ILE  86          1HG2      ILE  86 -19.323  24.703   1.629
  634   2HG2  ILE  86          2HG2      ILE  86 -20.795  24.345   2.566
  635   3HG2  ILE  86          3HG2      ILE  86 -20.157  23.137   1.462
  636   1HD1  ILE  86          1HD1      ILE  86 -23.088  26.068   1.945
  637   2HD1  ILE  86          2HD1      ILE  86 -21.578  26.488   2.791
  638   3HD1  ILE  86          3HD1      ILE  86 -22.457  27.706   1.862
  639    H    CYS  87           H        CYS  87 -18.320  23.173  -0.709
  640    HA   CYS  87           HA       CYS  87 -19.538  20.601  -1.512
  641   1HB   CYS  87          HB2       CYS  87 -17.751  20.372  -3.214
  642   2HB   CYS  87          HB3       CYS  87 -18.734  21.785  -3.478
  643    H    ILE  88           H        ILE  88 -18.614  18.753  -0.843
  644    HA   ILE  88           HA       ILE  88 -16.499  18.909   1.283
  645    HB   ILE  88           HB       ILE  88 -19.172  17.458   1.349
  646   1HG1  ILE  88          2HG1      ILE  88 -18.166  19.817   2.986
  647   2HG1  ILE  88          3HG1      ILE  88 -19.380  19.894   1.709
  648   1HG2  ILE  88          1HG2      ILE  88 -17.471  16.098   2.492
  649   2HG2  ILE  88          2HG2      ILE  88 -16.929  17.503   3.414
  650   3HG2  ILE  88          3HG2      ILE  88 -18.534  16.820   3.690
  651   1HD1  ILE  88          1HD1      ILE  88 -19.735  18.534   4.380
  652   2HD1  ILE  88          2HD1      ILE  88 -20.518  19.983   3.794
  653   3HD1  ILE  88          3HD1      ILE  88 -20.879  18.436   3.019
  654    H    ALA  89           H        ALA  89 -15.109  17.225   1.410
  655    HA   ALA  89           HA       ALA  89 -15.648  14.742  -0.131
  656   1HB   ALA  89          HB1       ALA  89 -13.369  14.620  -0.944
  657   2HB   ALA  89          HB2       ALA  89 -14.112  16.122  -1.484
  658   3HB   ALA  89          HB3       ALA  89 -12.980  16.144  -0.093
  659    H    GLU  90           H        GLU  90 -14.763  12.869   0.681
  660    HA   GLU  90           HA       GLU  90 -13.481  12.888   3.348
  661   1HB   GLU  90          HB2       GLU  90 -16.023  12.935   3.568
  662   2HB   GLU  90          HB3       GLU  90 -16.052  11.395   2.686
  663   1HG   GLU  90          HG2       GLU  90 -14.651  10.386   4.526
  664   2HG   GLU  90          HG3       GLU  90 -14.750  11.936   5.382
  665    H    ASN  91           H        ASN  91 -12.186  11.048   3.719
  666    HA   ASN  91           HA       ASN  91 -12.634   8.657   2.098
  667   1HB   ASN  91          HB2       ASN  91 -10.665   8.490   0.894
  668   2HB   ASN  91          HB3       ASN  91 -11.121  10.180   0.667
  669   1HD2  ASN  91          1HD2      ASN  91  -7.450   9.940   1.329
  670   2HD2  ASN  91          2HD2      ASN  91  -8.501   9.119   0.173
  671    H    LYS  92           H        LYS  92 -10.257   7.362   2.614
  672    HA   LYS  92           HA       LYS  92 -10.769   6.425   5.311
  673   1HB   LYS  92          HB2       LYS  92  -8.451   5.154   4.293
  674   2HB   LYS  92          HB3       LYS  92 -10.074   4.502   4.422
  675   1HG   LYS  92          HG2       LYS  92  -8.986   5.994   1.985
  676   2HG   LYS  92          HG3       LYS  92  -8.945   4.259   2.222
  677   1HD   LYS  92          HD2       LYS  92 -11.480   4.238   2.262
  678   2HD   LYS  92          HD3       LYS  92 -11.447   5.973   1.793
  679   1HE   LYS  92          HE2       LYS  92 -10.002   5.371  -0.150
  680   2HE   LYS  92          HE3       LYS  92 -10.250   3.661   0.255
  681   1HZ   LYS  92          HZ1       LYS  92 -12.269   5.641  -0.637
  682   2HZ   LYS  92          HZ2       LYS  92 -11.796   4.284  -1.413
  683   3HZ   LYS  92          HZ3       LYS  92 -12.695   4.148  -0.050
  684    H    ALA  93           H        ALA  93  -8.679   8.802   4.141
  685    HA   ALA  93           HA       ALA  93  -6.820   8.657   6.469
  686   1HB   ALA  93          HB1       ALA  93  -5.401  10.124   5.126
  687   2HB   ALA  93          HB2       ALA  93  -5.788   8.631   4.247
  688   3HB   ALA  93          HB3       ALA  93  -6.588  10.148   3.824
  689    H    GLY  94           H        GLY  94  -9.414  10.682   5.103
  690   1HA   GLY  94          HA2       GLY  94  -9.598  12.342   7.453
  691   2HA   GLY  94          HA3       GLY  94  -8.637  13.163   6.232
  692    H    GLU  95           H        GLU  95 -10.236  14.783   6.261
  693    HA   GLU  95           HA       GLU  95 -12.524  14.497   4.437
  694   1HB   GLU  95          HB2       GLU  95 -13.322  13.717   6.682
  695   2HB   GLU  95          HB3       GLU  95 -12.886  15.289   7.341
  696   1HG   GLU  95          HG2       GLU  95 -14.500  16.344   5.704
  697   2HG   GLU  95          HG3       GLU  95 -15.010  14.718   5.237
  698    H    GLN  96           H        GLN  96 -13.135  16.559   3.553
  699    HA   GLN  96           HA       GLN  96 -12.128  19.030   4.770
  700   1HB   GLN  96          HB2       GLN  96 -10.187  17.781   3.374
  701   2HB   GLN  96          HB3       GLN  96 -11.071  18.453   2.017
  702   1HG   GLN  96          HG2       GLN  96  -9.132  19.779   2.655
  703   2HG   GLN  96          HG3       GLN  96 -10.619  20.720   2.756
  704   1HE2  GLN  96          1HE2      GLN  96  -9.868  18.495   5.476
  705   2HE2  GLN  96          2HE2      GLN  96  -9.266  19.783   6.511
  706    H    ASP  97           H        ASP  97 -12.518  20.972   3.186
  707    HA   ASP  97           HA       ASP  97 -14.772  20.617   1.345
  708   1HB   ASP  97          HB2       ASP  97 -16.299  22.037   2.571
  709   2HB   ASP  97          HB3       ASP  97 -15.848  20.662   3.559
  710    H    ALA  98           H        ALA  98 -15.354  22.418   0.140
  711    HA   ALA  98           HA       ALA  98 -13.925  24.991   0.413
  712   1HB   ALA  98          HB1       ALA  98 -12.591  23.607  -1.135
  713   2HB   ALA  98          HB2       ALA  98 -13.993  23.435  -2.213
  714   3HB   ALA  98          HB3       ALA  98 -13.241  25.039  -1.956
  715    H    THR  99           H        THR  99 -14.898  26.596  -1.408
  716    HA   THR  99           HA       THR  99 -17.803  26.169  -1.890
  717    HB   THR  99           HB       THR  99 -16.605  28.523  -0.383
  718    HG1  THR  99           HG1      THR  99 -17.037  26.650   0.853
  719   1HG2  THR  99          1HG2      THR  99 -19.456  27.983  -1.388
  720   2HG2  THR  99          2HG2      THR  99 -19.029  29.246  -0.186
  721   3HG2  THR  99          3HG2      THR  99 -18.423  29.353  -1.836
  722    H    ILE 100           H        ILE 100 -18.229  26.700  -3.912
  723    HA   ILE 100           HA       ILE 100 -16.707  28.855  -5.322
  724    HB   ILE 100           HB       ILE 100 -18.586  27.368  -7.007
  725   1HG1  ILE 100          2HG1      ILE 100 -16.159  25.772  -6.110
  726   2HG1  ILE 100          3HG1      ILE 100 -17.864  25.449  -5.667
  727   1HG2  ILE 100          1HG2      ILE 100 -16.912  29.075  -7.736
  728   2HG2  ILE 100          2HG2      ILE 100 -15.635  27.940  -7.298
  729   3HG2  ILE 100          3HG2      ILE 100 -16.770  27.536  -8.593
  730   1HD1  ILE 100          1HD1      ILE 100 -16.737  25.324  -8.476
  731   2HD1  ILE 100          2HD1      ILE 100 -17.334  23.999  -7.512
  732   3HD1  ILE 100          3HD1      ILE 100 -18.466  25.240  -8.058
  733    H    HIS 101           H        HIS 101 -18.247  30.128  -6.885
  734    HA   HIS 101           HA       HIS 101 -21.021  30.421  -5.873
  735   1HB   HIS 101          HB2       HIS 101 -19.164  32.758  -6.468
  736   2HB   HIS 101          HB3       HIS 101 -20.832  32.834  -5.904
  737    HD1  HIS 101           HD1      HIS 101 -17.264  32.219  -4.759
  738    HD2  HIS 101           HD2      HIS 101 -21.163  32.376  -3.193
  739    HE1  HIS 101           HE1      HIS 101 -16.989  32.324  -2.205
  740    H    LEU 102           H        LEU 102 -22.446  31.463  -7.517
  741    HA   LEU 102           HA       LEU 102 -21.355  31.931 -10.225
  742   1HB   LEU 102          HB2       LEU 102 -21.846  29.626 -10.353
  743   2HB   LEU 102          HB3       LEU 102 -23.387  29.831  -9.500
  744    HG   LEU 102           HG       LEU 102 -24.398  30.929 -11.374
  745   1HD1  LEU 102          1HD1      LEU 102 -21.772  30.635 -12.884
  746   2HD1  LEU 102          2HD1      LEU 102 -23.314  31.255 -13.531
  747   3HD1  LEU 102          3HD1      LEU 102 -22.475  32.173 -12.304
  748   1HD2  LEU 102          1HD2      LEU 102 -24.388  29.082 -13.015
  749   2HD2  LEU 102          2HD2      LEU 102 -22.884  28.457 -12.292
  750   3HD2  LEU 102          3HD2      LEU 102 -24.386  28.477 -11.340
  751    H    LYS 103           H        LYS 103 -21.821  33.988 -10.387
  752    HA   LYS 103           HA       LYS 103 -24.500  35.085  -9.633
  753   1HB   LYS 103          HB2       LYS 103 -21.883  36.346 -10.571
  754   2HB   LYS 103          HB3       LYS 103 -23.372  37.259 -10.318
  755   1HG   LYS 103          HG2       LYS 103 -21.870  35.669  -8.193
  756   2HG   LYS 103          HG3       LYS 103 -21.834  37.414  -8.390
  757   1HD   LYS 103          HD2       LYS 103 -24.264  35.744  -7.575
  758   2HD   LYS 103          HD3       LYS 103 -23.294  36.764  -6.526
  759   1HE   LYS 103          HE2       LYS 103 -23.951  38.779  -7.697
  760   2HE   LYS 103          HE3       LYS 103 -24.838  37.880  -8.916
  761   1HZ   LYS 103          HZ1       LYS 103 -25.533  37.829  -6.047
  762   2HZ   LYS 103          HZ2       LYS 103 -26.291  38.773  -7.154
  763   3HZ   LYS 103          HZ3       LYS 103 -26.384  37.130  -7.272
  764    H    VAL 104           H        VAL 104 -26.013  34.623 -11.075
  765    HA   VAL 104           HA       VAL 104 -25.472  34.617 -13.995
  766    HB   VAL 104           HB       VAL 104 -27.969  33.765 -12.451
  767   1HG1  VAL 104          1HG1      VAL 104 -28.475  32.516 -14.562
  768   2HG1  VAL 104          2HG1      VAL 104 -28.562  34.277 -14.721
  769   3HG1  VAL 104          3HG1      VAL 104 -27.151  33.378 -15.362
  770   1HG2  VAL 104          1HG2      VAL 104 -26.108  32.288 -11.877
  771   2HG2  VAL 104          2HG2      VAL 104 -27.200  31.449 -12.959
  772   3HG2  VAL 104          3HG2      VAL 104 -25.683  32.099 -13.596
  773    H    PHE 105           H        PHE 105 -26.326  36.095 -15.427
  774    HA   PHE 105           HA       PHE 105 -28.385  38.043 -14.536
  775   1HB   PHE 105          HB2       PHE 105 -27.029  39.572 -16.134
  776   2HB   PHE 105          HB3       PHE 105 -26.479  39.377 -14.486
  777    HD1  PHE 105           HD1      PHE 105 -25.885  38.024 -17.973
  778    HD2  PHE 105           HD2      PHE 105 -24.235  38.821 -14.077
  779    HE1  PHE 105           HE1      PHE 105 -23.638  37.363 -18.787
  780    HE2  PHE 105           HE2      PHE 105 -21.969  38.225 -14.938
  781    HZ   PHE 105           HZ       PHE 105 -21.701  37.490 -17.293
  782    H    ALA 106           H        ALA 106 -29.487  39.023 -16.501
  783    HA   ALA 106           HA       ALA 106 -29.778  36.990 -18.652
  784   1HB   ALA 106          HB1       ALA 106 -31.717  37.164 -17.117
  785   2HB   ALA 106          HB2       ALA 106 -31.878  38.888 -17.532
  786   3HB   ALA 106          HB3       ALA 106 -32.137  37.643 -18.766
  787    H    LYS 107           H        LYS 107 -27.881  39.027 -18.701
  788    HA   LYS 107           HA       LYS 107 -28.671  40.589 -21.135
  789   1HB   LYS 107          HB2       LYS 107 -26.896  41.550 -18.849
  790   2HB   LYS 107          HB3       LYS 107 -27.385  42.472 -20.288
  791   1HG   LYS 107          HG2       LYS 107 -29.765  42.275 -19.537
  792   2HG   LYS 107          HG3       LYS 107 -29.189  41.480 -18.067
  793   1HD   LYS 107          HD2       LYS 107 -28.437  44.300 -18.957
  794   2HD   LYS 107          HD3       LYS 107 -29.669  43.891 -17.747
  795   1HE   LYS 107          HE2       LYS 107 -27.930  42.882 -16.307
  796   2HE   LYS 107          HE3       LYS 107 -26.691  43.279 -17.520
  797   1HZ   LYS 107          HZ1       LYS 107 -28.334  45.273 -16.068
  798   2HZ   LYS 107          HZ2       LYS 107 -26.746  44.959 -15.807
  799   3HZ   LYS 107          HZ3       LYS 107 -27.228  45.627 -17.213
  Start of MODEL   19
    1   1H    GLY   1          H1        GLY   1 -11.373  -1.702   2.824
    2   2H    GLY   1          H2        GLY   1 -10.075  -2.375   3.539
    3   3H    GLY   1          H3        GLY   1 -10.240  -0.730   3.540
    4   1HA   GLY   1          HA2       GLY   1  -9.788  -2.421   1.138
    5   2HA   GLY   1          HA3       GLY   1 -10.003  -0.669   1.127
    6    H    LYS   2           H        LYS   2  -7.980   0.123   0.592
    7    HA   LYS   2           HA       LYS   2  -5.573  -1.074   1.838
    8   1HB   LYS   2          HB2       LYS   2  -5.863   0.921  -0.444
    9   2HB   LYS   2          HB3       LYS   2  -4.322   0.460   0.247
   10   1HG   LYS   2          HG2       LYS   2  -6.262  -1.430  -1.110
   11   2HG   LYS   2          HG3       LYS   2  -4.735  -0.799  -1.761
   12   1HD   LYS   2          HD2       LYS   2  -3.550  -1.975   0.217
   13   2HD   LYS   2          HD3       LYS   2  -5.099  -2.691   0.616
   14   1HE   LYS   2          HE2       LYS   2  -3.881  -4.336  -0.602
   15   2HE   LYS   2          HE3       LYS   2  -5.197  -3.784  -1.622
   16   1HZ   LYS   2          HZ1       LYS   2  -2.378  -2.856  -1.856
   17   2HZ   LYS   2          HZ2       LYS   2  -3.089  -3.966  -2.824
   18   3HZ   LYS   2          HZ3       LYS   2  -3.596  -2.435  -2.845
   19    H    ASP   3           H        ASP   3  -7.201   0.129   3.546
   20    HA   ASP   3           HA       ASP   3  -5.704   2.359   4.755
   21   1HB   ASP   3          HB2       ASP   3  -7.436   1.938   6.634
   22   2HB   ASP   3          HB3       ASP   3  -7.930   2.754   5.184
   23    H    ILE   4           H        ILE   4  -3.899   0.768   4.332
   24    HA   ILE   4           HA       ILE   4  -3.556  -1.581   5.974
   25    HB   ILE   4           HB       ILE   4  -1.543   0.071   4.406
   26   1HG1  ILE   4          2HG1      ILE   4  -3.263  -0.677   2.858
   27   2HG1  ILE   4          3HG1      ILE   4  -1.834  -1.635   2.610
   28   1HG2  ILE   4          1HG2      ILE   4  -0.282  -1.378   5.833
   29   2HG2  ILE   4          2HG2      ILE   4  -1.351  -2.767   5.526
   30   3HG2  ILE   4          3HG2      ILE   4  -0.280  -2.155   4.254
   31   1HD1  ILE   4          1HD1      ILE   4  -2.923  -3.477   3.997
   32   2HD1  ILE   4          2HD1      ILE   4  -4.399  -2.490   4.007
   33   3HD1  ILE   4          3HD1      ILE   4  -3.753  -3.103   2.479
   34    H    GLN   5           H        GLN   5  -1.787  -1.830   7.631
   35    HA   GLN   5           HA       GLN   5  -1.665   0.390   9.554
   36   1HB   GLN   5          HB2       GLN   5  -0.436  -2.404   9.608
   37   2HB   GLN   5          HB3       GLN   5  -0.398  -1.232  10.921
   38   1HG   GLN   5          HG2       GLN   5  -2.167  -2.748  11.464
   39   2HG   GLN   5          HG3       GLN   5  -2.937  -1.245  10.933
   40   1HE2  GLN   5          1HE2      GLN   5  -5.019  -3.399   9.003
   41   2HE2  GLN   5          2HE2      GLN   5  -4.933  -2.273  10.338
   42    H    VAL   6           H        VAL   6  -0.562   1.079   7.129
   43    HA   VAL   6           HA       VAL   6   2.180   1.926   7.642
   44    HB   VAL   6           HB       VAL   6   1.545   0.127   5.264
   45   1HG1  VAL   6          1HG1      VAL   6   4.026   0.282   4.852
   46   2HG1  VAL   6          2HG1      VAL   6   3.159   1.782   4.572
   47   3HG1  VAL   6          3HG1      VAL   6   4.106   1.540   6.095
   48   1HG2  VAL   6          1HG2      VAL   6   3.268  -1.389   6.156
   49   2HG2  VAL   6          2HG2      VAL   6   3.358  -0.394   7.640
   50   3HG2  VAL   6          3HG2      VAL   6   1.880  -1.298   7.240
   51    H    ILE   7           H        ILE   7   2.691   3.615   5.947
   52    HA   ILE   7           HA       ILE   7   0.384   5.181   5.142
   53    HB   ILE   7           HB       ILE   7   3.302   5.563   4.349
   54   1HG1  ILE   7          2HG1      ILE   7   1.759   6.754   6.688
   55   2HG1  ILE   7          3HG1      ILE   7   3.049   5.556   6.828
   56   1HG2  ILE   7          1HG2      ILE   7   2.640   7.857   3.811
   57   2HG2  ILE   7          2HG2      ILE   7   1.571   6.760   2.946
   58   3HG2  ILE   7          3HG2      ILE   7   0.979   7.531   4.395
   59   1HD1  ILE   7          1HD1      ILE   7   4.640   7.209   5.808
   60   2HD1  ILE   7          2HD1      ILE   7   3.363   8.442   5.933
   61   3HD1  ILE   7          3HD1      ILE   7   3.970   7.666   7.396
   62    H    VAL   8           H        VAL   8  -0.876   4.320   3.745
   63    HA   VAL   8           HA       VAL   8   0.029   3.611   0.987
   64    HB   VAL   8           HB       VAL   8  -1.800   1.872   2.680
   65   1HG1  VAL   8          1HG1      VAL   8  -0.872   1.498  -0.212
   66   2HG1  VAL   8          2HG1      VAL   8  -1.835   0.344   0.744
   67   3HG1  VAL   8          3HG1      VAL   8  -2.513   1.906   0.314
   68   1HG2  VAL   8          1HG2      VAL   8  -0.095   0.115   2.284
   69   2HG2  VAL   8          2HG2      VAL   8   1.003   1.329   1.610
   70   3HG2  VAL   8          3HG2      VAL   8   0.498   1.421   3.306
   71    H    ASN   9           H        ASN   9  -2.760   4.227   3.114
   72    HA   ASN   9           HA       ASN   9  -4.396   5.336   0.954
   73   1HB   ASN   9          HB2       ASN   9  -5.923   6.000   2.771
   74   2HB   ASN   9          HB3       ASN   9  -5.492   4.279   2.776
   75   1HD2  ASN   9          1HD2      ASN   9  -3.612   6.160   5.851
   76   2HD2  ASN   9          2HD2      ASN   9  -3.220   6.654   4.211
   77    H    VAL  10           H        VAL  10  -5.088   7.530   0.825
   78    HA   VAL  10           HA       VAL  10  -3.208   9.572   1.898
   79    HB   VAL  10           HB       VAL  10  -4.169   9.487  -0.963
   80   1HG1  VAL  10          1HG1      VAL  10  -2.661  11.503  -1.202
   81   2HG1  VAL  10          2HG1      VAL  10  -3.989  11.807  -0.090
   82   3HG1  VAL  10          3HG1      VAL  10  -2.375  11.455   0.560
   83   1HG2  VAL  10          1HG2      VAL  10  -1.416   9.068   0.256
   84   2HG2  VAL  10          2HG2      VAL  10  -2.369   7.870  -0.614
   85   3HG2  VAL  10          3HG2      VAL  10  -1.736   9.276  -1.467
   86    HA   PRO  11           HA       PRO  11  -7.176  11.296   3.366
   87   1HB   PRO  11          HB2       PRO  11  -5.178  13.561   3.663
   88   2HB   PRO  11          HB3       PRO  11  -6.510  13.103   4.777
   89   1HG   PRO  11          HG2       PRO  11  -4.022  12.330   5.318
   90   2HG   PRO  11          HG3       PRO  11  -5.358  11.134   5.466
   91   1HD   PRO  11          HD2       PRO  11  -3.345  11.448   3.233
   92   2HD   PRO  11          HD3       PRO  11  -3.987   9.951   4.006
   93    HA   PRO  12           HA       PRO  12  -8.166  13.643  -0.298
   94   1HB   PRO  12          HB2       PRO  12 -10.589  14.709   0.302
   95   2HB   PRO  12          HB3       PRO  12 -10.361  12.937   0.174
   96   1HG   PRO  12          HG2       PRO  12 -10.341  14.659   2.676
   97   2HG   PRO  12          HG3       PRO  12 -11.228  13.127   2.370
   98   1HD   PRO  12          HD2       PRO  12  -8.789  13.267   3.698
   99   2HD   PRO  12          HD3       PRO  12  -9.304  11.847   2.735
  100    H    SER  13           H        SER  13  -8.248  15.854  -1.107
  101    HA   SER  13           HA       SER  13  -7.649  18.043   0.827
  102   1HB   SER  13          HB2       SER  13  -5.542  18.544  -0.276
  103   2HB   SER  13          HB3       SER  13  -5.561  16.906   0.362
  104    HG   SER  13           HG       SER  13  -4.735  16.889  -1.748
  105    H    VAL  14           H        VAL  14 -10.025  18.105  -0.493
  106    HA   VAL  14           HA       VAL  14  -9.960  19.168  -3.086
  107    HB   VAL  14           HB       VAL  14 -11.893  18.083  -2.049
  108   1HG1  VAL  14          1HG1      VAL  14 -13.492  19.331  -0.683
  109   2HG1  VAL  14          2HG1      VAL  14 -11.949  19.168   0.163
  110   3HG1  VAL  14          3HG1      VAL  14 -12.384  20.717  -0.592
  111   1HG2  VAL  14          1HG2      VAL  14 -12.201  19.526  -4.099
  112   2HG2  VAL  14          2HG2      VAL  14 -13.640  19.427  -3.097
  113   3HG2  VAL  14          3HG2      VAL  14 -12.638  20.878  -3.023
  114    H    ARG  15           H        ARG  15 -10.118  21.129  -4.052
  115    HA   ARG  15           HA       ARG  15 -10.128  23.595  -2.375
  116   1HB   ARG  15          HB2       ARG  15  -8.685  23.859  -4.944
  117   2HB   ARG  15          HB3       ARG  15  -8.449  24.689  -3.423
  118   1HG   ARG  15          HG2       ARG  15  -6.543  23.584  -3.559
  119   2HG   ARG  15          HG3       ARG  15  -7.496  22.406  -2.609
  120   1HD   ARG  15          HD2       ARG  15  -8.112  21.728  -5.241
  121   2HD   ARG  15          HD3       ARG  15  -6.425  22.275  -5.429
  122    HE   ARG  15           HE       ARG  15  -6.746  20.387  -3.230
  123   1HH1  ARG  15          1HH1      ARG  15  -6.224  18.239  -3.402
  124   2HH1  ARG  15          2HH1      ARG  15  -6.182  17.527  -5.028
  125   1HH2  ARG  15          1HH2      ARG  15  -6.529  18.576  -6.726
  126   2HH2  ARG  15          2HH2      ARG  15  -7.049  20.266  -6.749
  127    H    ALA  16           H        ALA  16 -10.326  25.442  -3.866
  128    HA   ALA  16           HA       ALA  16 -12.722  25.096  -5.631
  129   1HB   ALA  16          HB1       ALA  16 -13.145  26.682  -3.828
  130   2HB   ALA  16          HB2       ALA  16 -11.650  27.573  -4.216
  131   3HB   ALA  16          HB3       ALA  16 -12.999  27.564  -5.376
  132    H    ARG  17           H        ARG  17 -12.312  25.196  -7.807
  133    HA   ARG  17           HA       ARG  17  -9.655  25.926  -8.833
  134   1HB   ARG  17          HB2       ARG  17 -11.262  24.116  -9.748
  135   2HB   ARG  17          HB3       ARG  17 -12.082  25.463 -10.561
  136   1HG   ARG  17          HG2       ARG  17  -9.821  26.080 -11.597
  137   2HG   ARG  17          HG3       ARG  17  -9.156  24.610 -10.873
  138   1HD   ARG  17          HD2       ARG  17 -11.524  24.658 -12.790
  139   2HD   ARG  17          HD3       ARG  17  -9.840  24.473 -13.304
  140    HE   ARG  17           HE       ARG  17 -11.554  22.418 -12.171
  141   1HH1  ARG  17          1HH1      ARG  17 -10.820  20.312 -12.188
  142   2HH1  ARG  17          2HH1      ARG  17  -9.113  19.993 -12.287
  143   1HH2  ARG  17          1HH2      ARG  17  -8.142  23.248 -12.546
  144   2HH2  ARG  17          2HH2      ARG  17  -7.669  21.575 -12.506
  145    H    GLN  18           H        GLN  18 -12.756  27.563  -8.587
  146    HA   GLN  18           HA       GLN  18 -11.465  30.155  -8.951
  147   1HB   GLN  18          HB2       GLN  18 -12.226  29.426 -11.263
  148   2HB   GLN  18          HB3       GLN  18 -13.882  29.504 -10.680
  149   1HG   GLN  18          HG2       GLN  18 -13.614  31.885 -10.136
  150   2HG   GLN  18          HG3       GLN  18 -11.896  31.824 -10.531
  151   1HE2  GLN  18          1HE2      GLN  18 -14.401  32.891 -13.395
  152   2HE2  GLN  18          2HE2      GLN  18 -14.725  32.973 -11.668
  153    H    SER  19           H        SER  19 -12.468  31.698  -7.627
  154    HA   SER  19           HA       SER  19 -14.186  30.615  -5.571
  155   1HB   SER  19          HB2       SER  19 -13.261  33.482  -6.008
  156   2HB   SER  19          HB3       SER  19 -13.867  32.793  -4.484
  157    HG   SER  19           HG       SER  19 -12.033  31.472  -4.398
  158    H    THR  20           H        THR  20 -14.941  32.483  -8.422
  159    HA   THR  20           HA       THR  20 -17.816  32.517  -7.853
  160    HB   THR  20           HB       THR  20 -16.315  35.169  -8.108
  161    HG1  THR  20           HG1      THR  20 -16.931  33.776  -6.003
  162   1HG2  THR  20          1HG2      THR  20 -18.457  35.344  -9.302
  163   2HG2  THR  20          2HG2      THR  20 -19.326  34.578  -7.954
  164   3HG2  THR  20          3HG2      THR  20 -18.587  36.180  -7.749
  165    H    MET  21           H        MET  21 -18.854  32.210  -9.611
  166    HA   MET  21           HA       MET  21 -17.638  32.615 -12.321
  167   1HB   MET  21          HB2       MET  21 -19.704  30.652 -11.227
  168   2HB   MET  21          HB3       MET  21 -19.351  30.844 -12.926
  169   1HG   MET  21          HG2       MET  21 -17.340  30.059 -10.771
  170   2HG   MET  21          HG3       MET  21 -18.194  28.934 -11.805
  171   1HE   MET  21          HE1       MET  21 -16.669  29.509 -15.338
  172   2HE   MET  21          HE2       MET  21 -17.999  28.823 -14.394
  173   3HE   MET  21          HE3       MET  21 -17.988  30.556 -14.771
  174    H    ASN  22           H        ASN  22 -19.136  33.123 -14.025
  175    HA   ASN  22           HA       ASN  22 -21.701  34.415 -13.270
  176   1HB   ASN  22          HB2       ASN  22 -19.576  35.612 -15.098
  177   2HB   ASN  22          HB3       ASN  22 -21.185  36.253 -14.889
  178   1HD2  ASN  22          1HD2      ASN  22 -18.360  37.279 -12.234
  179   2HD2  ASN  22          2HD2      ASN  22 -17.988  36.269 -13.621
  180    H    ALA  23           H        ALA  23 -23.284  34.327 -14.990
  181    HA   ALA  23           HA       ALA  23 -22.615  33.041 -17.554
  182   1HB   ALA  23          HB1       ALA  23 -24.147  31.146 -17.191
  183   2HB   ALA  23          HB2       ALA  23 -22.794  31.090 -16.036
  184   3HB   ALA  23          HB3       ALA  23 -24.396  31.626 -15.502
  185    H    THR  24           H        THR  24 -24.259  33.040 -19.102
  186    HA   THR  24           HA       THR  24 -26.276  35.174 -18.730
  187    HB   THR  24           HB       THR  24 -25.561  33.739 -21.292
  188    HG1  THR  24           HG1      THR  24 -24.305  35.956 -20.070
  189   1HG2  THR  24          1HG2      THR  24 -27.550  35.165 -21.442
  190   2HG2  THR  24          2HG2      THR  24 -26.689  36.506 -20.640
  191   3HG2  THR  24          3HG2      THR  24 -26.209  35.961 -22.259
  192    H    ALA  25           H        ALA  25 -28.335  34.734 -18.389
  193    HA   ALA  25           HA       ALA  25 -29.529  32.063 -18.847
  194   1HB   ALA  25          HB1       ALA  25 -30.072  33.228 -16.812
  195   2HB   ALA  25          HB2       ALA  25 -30.613  34.679 -17.707
  196   3HB   ALA  25          HB3       ALA  25 -31.536  33.204 -17.796
  197    H    ASN  26           H        ASN  26 -31.774  32.027 -19.774
  198    HA   ASN  26           HA       ASN  26 -33.258  32.143 -21.394
  199   1HB   ASN  26          HB2       ASN  26 -32.321  34.941 -22.042
  200   2HB   ASN  26          HB3       ASN  26 -33.858  34.236 -22.415
  201   1HD2  ASN  26          1HD2      ASN  26 -34.446  34.363 -18.604
  202   2HD2  ASN  26          2HD2      ASN  26 -33.967  32.952 -19.531
  203    H    LEU  27           H        LEU  27 -30.045  32.114 -22.222
  204    HA   LEU  27           HA       LEU  27 -30.444  31.789 -25.123
  205   1HB   LEU  27          HB2       LEU  27 -27.953  31.649 -23.389
  206   2HB   LEU  27          HB3       LEU  27 -28.000  31.545 -25.147
  207    HG   LEU  27           HG       LEU  27 -28.715  33.952 -23.487
  208   1HD1  LEU  27          1HD1      LEU  27 -26.309  33.435 -23.718
  209   2HD1  LEU  27          2HD1      LEU  27 -26.477  33.483 -25.481
  210   3HD1  LEU  27          3HD1      LEU  27 -26.761  34.948 -24.498
  211   1HD2  LEU  27          1HD2      LEU  27 -28.805  33.609 -26.512
  212   2HD2  LEU  27          2HD2      LEU  27 -30.159  34.028 -25.443
  213   3HD2  LEU  27          3HD2      LEU  27 -28.840  35.166 -25.691
  214    H    SER  28           H        SER  28 -30.676  29.760 -22.428
  215    HA   SER  28           HA       SER  28 -30.512  27.550 -21.981
  216   1HB   SER  28          HB2       SER  28 -31.105  27.206 -24.933
  217   2HB   SER  28          HB3       SER  28 -31.290  25.966 -23.663
  218    HG   SER  28           HG       SER  28 -33.259  27.090 -24.186
  219    H    GLN  29           H        GLN  29 -28.047  28.910 -22.551
  220    HA   GLN  29           HA       GLN  29 -26.301  27.239 -24.150
  221   1HB   GLN  29          HB2       GLN  29 -26.294  29.820 -23.571
  222   2HB   GLN  29          HB3       GLN  29 -25.417  29.333 -22.112
  223   1HG   GLN  29          HG2       GLN  29 -23.605  28.409 -23.522
  224   2HG   GLN  29          HG3       GLN  29 -24.567  28.709 -24.970
  225   1HE2  GLN  29          1HE2      GLN  29 -22.558  31.634 -25.231
  226   2HE2  GLN  29          2HE2      GLN  29 -22.733  29.978 -25.792
  227    H    SER  30           H        SER  30 -24.056  26.599 -23.000
  228    HA   SER  30           HA       SER  30 -24.623  25.187 -20.445
  229   1HB   SER  30          HB2       SER  30 -23.054  23.378 -21.251
  230   2HB   SER  30          HB3       SER  30 -24.538  23.518 -22.209
  231    HG   SER  30           HG       SER  30 -22.646  23.338 -23.514
  232    H    VAL  31           H        VAL  31 -23.007  24.991 -18.990
  233    HA   VAL  31           HA       VAL  31 -20.564  26.736 -19.306
  234    HB   VAL  31           HB       VAL  31 -22.705  27.103 -17.134
  235   1HG1  VAL  31          1HG1      VAL  31 -20.492  27.434 -16.125
  236   2HG1  VAL  31          2HG1      VAL  31 -20.007  28.474 -17.499
  237   3HG1  VAL  31          3HG1      VAL  31 -21.258  28.988 -16.354
  238   1HG2  VAL  31          1HG2      VAL  31 -21.728  28.969 -19.360
  239   2HG2  VAL  31          2HG2      VAL  31 -23.334  28.247 -19.221
  240   3HG2  VAL  31          3HG2      VAL  31 -22.825  29.421 -18.029
  241    H    THR  32           H        THR  32 -18.825  26.019 -18.216
  242    HA   THR  32           HA       THR  32 -19.096  23.743 -16.293
  243    HB   THR  32           HB       THR  32 -16.595  24.634 -17.775
  244    HG1  THR  32           HG1      THR  32 -17.013  23.053 -19.227
  245   1HG2  THR  32          1HG2      THR  32 -17.322  22.054 -16.289
  246   2HG2  THR  32          2HG2      THR  32 -15.891  22.258 -17.317
  247   3HG2  THR  32          3HG2      THR  32 -16.062  23.225 -15.855
  248    H    LEU  33           H        LEU  33 -18.098  23.759 -14.340
  249    HA   LEU  33           HA       LEU  33 -16.243  25.813 -13.508
  250   1HB   LEU  33          HB2       LEU  33 -17.541  26.588 -11.553
  251   2HB   LEU  33          HB3       LEU  33 -18.155  27.097 -13.097
  252    HG   LEU  33           HG       LEU  33 -20.029  25.500 -12.979
  253   1HD1  LEU  33          1HD1      LEU  33 -20.544  24.479 -10.775
  254   2HD1  LEU  33          2HD1      LEU  33 -19.192  23.720 -11.597
  255   3HD1  LEU  33          3HD1      LEU  33 -18.912  24.837 -10.236
  256   1HD2  LEU  33          1HD2      LEU  33 -20.256  27.813 -12.147
  257   2HD2  LEU  33          2HD2      LEU  33 -21.228  26.689 -11.205
  258   3HD2  LEU  33          3HD2      LEU  33 -19.681  27.305 -10.548
  259    H    ALA  34           H        ALA  34 -15.585  25.261 -11.006
  260    HA   ALA  34           HA       ALA  34 -15.935  22.403 -10.482
  261   1HB   ALA  34          HB1       ALA  34 -13.585  21.828 -10.941
  262   2HB   ALA  34          HB2       ALA  34 -14.295  22.524 -12.424
  263   3HB   ALA  34          HB3       ALA  34 -13.232  23.488 -11.386
  264    H    CYS  35           H        CYS  35 -15.401  21.628  -8.690
  265    HA   CYS  35           HA       CYS  35 -13.696  23.091  -6.707
  266   1HB   CYS  35          HB2       CYS  35 -16.059  23.045  -6.009
  267   2HB   CYS  35          HB3       CYS  35 -16.087  21.281  -6.133
  268    H    ASP  36           H        ASP  36 -11.703  22.091  -7.035
  269    HA   ASP  36           HA       ASP  36 -11.697  19.369  -8.097
  270   1HB   ASP  36          HB2       ASP  36  -9.478  19.795  -8.812
  271   2HB   ASP  36          HB3       ASP  36 -10.558  21.070  -9.323
  272    H    ALA  37           H        ALA  37 -11.523  17.658  -7.004
  273    HA   ALA  37           HA       ALA  37 -10.012  17.638  -4.427
  274   1HB   ALA  37          HB1       ALA  37 -12.445  17.159  -4.213
  275   2HB   ALA  37          HB2       ALA  37 -12.271  15.846  -5.391
  276   3HB   ALA  37          HB3       ALA  37 -11.458  15.748  -3.823
  277    H    ASP  38           H        ASP  38  -8.735  15.925  -3.866
  278    HA   ASP  38           HA       ASP  38  -8.206  13.707  -5.752
  279   1HB   ASP  38          HB2       ASP  38  -6.050  15.504  -4.574
  280   2HB   ASP  38          HB3       ASP  38  -5.730  13.950  -5.343
  281    H    GLY  39           H        GLY  39  -7.063  11.938  -4.619
  282   1HA   GLY  39          HA2       GLY  39  -6.072  11.764  -2.030
  283   2HA   GLY  39          HA3       GLY  39  -7.803  11.414  -1.869
  284    H    PHE  40           H        PHE  40  -6.690   9.295  -1.127
  285    HA   PHE  40           HA       PHE  40  -7.115   7.438  -3.342
  286   1HB   PHE  40          HB2       PHE  40  -4.762   7.955  -3.641
  287   2HB   PHE  40          HB3       PHE  40  -4.400   7.466  -1.990
  288    HD1  PHE  40           HD1      PHE  40  -4.241   5.087  -1.382
  289    HD2  PHE  40           HD2      PHE  40  -5.526   6.279  -5.321
  290    HE1  PHE  40           HE1      PHE  40  -4.034   2.757  -2.154
  291    HE2  PHE  40           HE2      PHE  40  -5.349   3.923  -6.100
  292    HZ   PHE  40           HZ       PHE  40  -4.595   2.163  -4.529
  293    HA   PRO  41           HA       PRO  41  -7.887   5.429  -3.639
  294   1HB   PRO  41          HB2       PRO  41 -10.170   4.019  -3.316
  295   2HB   PRO  41          HB3       PRO  41  -8.567   3.351  -2.858
  296   1HG   PRO  41          HG2       PRO  41 -10.580   4.719  -1.022
  297   2HG   PRO  41          HG3       PRO  41  -9.753   3.155  -0.752
  298   1HD   PRO  41          HD2       PRO  41  -8.845   5.486   0.325
  299   2HD   PRO  41          HD3       PRO  41  -7.720   4.212  -0.200
  300    H    GLU  42           H        GLU  42  -9.561   6.145  -5.115
  301    HA   GLU  42           HA       GLU  42 -10.533   8.498  -5.409
  302   1HB   GLU  42          HB2       GLU  42 -12.598   7.603  -6.482
  303   2HB   GLU  42          HB3       GLU  42 -11.062   6.919  -6.973
  304   1HG   GLU  42          HG2       GLU  42 -11.455   4.894  -5.626
  305   2HG   GLU  42          HG3       GLU  42 -13.021   5.499  -5.126
  306    HA   PRO  43           HA       PRO  43 -12.312   9.402  -1.384
  307   1HB   PRO  43          HB2       PRO  43 -12.479  12.117  -2.739
  308   2HB   PRO  43          HB3       PRO  43 -12.121  11.749  -1.004
  309   1HG   PRO  43          HG2       PRO  43 -10.090  12.182  -2.692
  310   2HG   PRO  43          HG3       PRO  43 -10.042  10.719  -1.630
  311   1HD   PRO  43          HD2       PRO  43 -10.819  10.872  -4.550
  312   2HD   PRO  43          HD3       PRO  43  -9.730   9.725  -3.702
  313    H    THR  44           H        THR  44 -14.121  10.329  -0.385
  314    HA   THR  44           HA       THR  44 -16.693  10.016  -1.907
  315    HB   THR  44           HB       THR  44 -16.235  10.130   1.096
  316    HG1  THR  44           HG1      THR  44 -15.442   8.279  -0.041
  317   1HG2  THR  44          1HG2      THR  44 -18.565   9.276   1.188
  318   2HG2  THR  44          2HG2      THR  44 -18.496  10.898   0.442
  319   3HG2  THR  44          3HG2      THR  44 -18.683   9.447  -0.575
  320    H    MET  45           H        MET  45 -16.795  11.989  -2.968
  321    HA   MET  45           HA       MET  45 -16.815  14.426  -1.246
  322   1HB   MET  45          HB2       MET  45 -15.771  15.699  -2.925
  323   2HB   MET  45          HB3       MET  45 -14.872  14.203  -2.827
  324   1HG   MET  45          HG2       MET  45 -14.997  14.410  -5.068
  325   2HG   MET  45          HG3       MET  45 -16.445  13.440  -4.825
  326   1HE   MET  45          HE1       MET  45 -15.668  17.414  -4.424
  327   2HE   MET  45          HE2       MET  45 -14.864  16.806  -5.888
  328   3HE   MET  45          HE3       MET  45 -16.232  17.934  -6.020
  329    H    THR  46           H        THR  46 -18.262  15.978  -1.486
  330    HA   THR  46           HA       THR  46 -20.550  15.753  -3.335
  331    HB   THR  46           HB       THR  46 -22.216  15.850  -1.468
  332    HG1  THR  46           HG1      THR  46 -21.540  15.047   0.562
  333   1HG2  THR  46          1HG2      THR  46 -22.364  13.516  -1.014
  334   2HG2  THR  46          2HG2      THR  46 -21.747  13.737  -2.674
  335   3HG2  THR  46          3HG2      THR  46 -20.629  13.266  -1.386
  336    H    TRP  47           H        TRP  47 -22.051  17.581  -3.084
  337    HA   TRP  47           HA       TRP  47 -21.222  19.929  -1.646
  338   1HB   TRP  47          HB2       TRP  47 -20.671  21.311  -3.657
  339   2HB   TRP  47          HB3       TRP  47 -19.507  20.129  -3.161
  340    HD1  TRP  47           HD1      TRP  47 -19.450  17.756  -4.640
  341    HE1  TRP  47           HE1      TRP  47 -18.749  17.763  -7.085
  342    HE3  TRP  47           HE3      TRP  47 -20.869  22.521  -5.822
  343    HZ2  TRP  47           HZ2      TRP  47 -18.392  19.776  -9.132
  344    HZ3  TRP  47           HZ3      TRP  47 -20.262  23.501  -8.020
  345    HH2  TRP  47           HH2      TRP  47 -19.032  22.145  -9.680
  346    H    THR  48           H        THR  48 -22.530  21.837  -1.971
  347    HA   THR  48           HA       THR  48 -25.312  21.003  -2.663
  348    HB   THR  48           HB       THR  48 -26.041  22.490  -0.865
  349    HG1  THR  48           HG1      THR  48 -24.424  23.474   0.422
  350   1HG2  THR  48          1HG2      THR  48 -25.202  21.301   1.050
  351   2HG2  THR  48          2HG2      THR  48 -25.312  20.140  -0.299
  352   3HG2  THR  48          3HG2      THR  48 -23.724  20.790   0.178
  353    H    LYS  49           H        LYS  49 -26.836  22.591  -3.187
  354    HA   LYS  49           HA       LYS  49 -25.870  24.958  -4.751
  355   1HB   LYS  49          HB2       LYS  49 -27.201  23.085  -5.927
  356   2HB   LYS  49          HB3       LYS  49 -28.571  23.530  -4.944
  357   1HG   LYS  49          HG2       LYS  49 -28.327  25.892  -5.906
  358   2HG   LYS  49          HG3       LYS  49 -27.085  25.208  -6.989
  359   1HD   LYS  49          HD2       LYS  49 -28.748  23.620  -7.920
  360   2HD   LYS  49          HD3       LYS  49 -30.000  24.333  -6.890
  361   1HE   LYS  49          HE2       LYS  49 -28.404  25.841  -9.021
  362   2HE   LYS  49          HE3       LYS  49 -30.011  25.133  -9.244
  363   1HZ   LYS  49          HZ1       LYS  49 -30.644  26.632  -7.264
  364   2HZ   LYS  49          HZ2       LYS  49 -29.260  27.461  -7.564
  365   3HZ   LYS  49          HZ3       LYS  49 -30.414  27.322  -8.722
  366    H    ASP  50           H        ASP  50 -25.628  26.116  -2.695
  367    HA   ASP  50           HA       ASP  50 -26.159  27.450  -0.992
  368   1HB   ASP  50          HB2       ASP  50 -27.611  28.515  -2.678
  369   2HB   ASP  50          HB3       ASP  50 -28.966  27.578  -2.085
  370    H    GLY  51           H        GLY  51 -27.918  24.464  -1.239
  371   1HA   GLY  51          HA2       GLY  51 -27.598  23.861   1.509
  372   2HA   GLY  51          HA3       GLY  51 -29.237  24.441   1.288
  373    H    GLU  52           H        GLU  52 -29.502  23.187  -1.425
  374    HA   GLU  52           HA       GLU  52 -30.051  20.390  -0.585
  375   1HB   GLU  52          HB2       GLU  52 -31.327  20.216  -2.654
  376   2HB   GLU  52          HB3       GLU  52 -31.845  21.591  -1.676
  377   1HG   GLU  52          HG2       GLU  52 -30.487  23.108  -3.111
  378   2HG   GLU  52          HG3       GLU  52 -30.099  21.730  -4.165
  379    HA   PRO  53           HA       PRO  53 -26.377  18.933  -2.417
  380   1HB   PRO  53          HB2       PRO  53 -26.783  16.300  -2.805
  381   2HB   PRO  53          HB3       PRO  53 -26.866  17.065  -1.189
  382   1HG   PRO  53          HG2       PRO  53 -29.197  16.403  -3.020
  383   2HG   PRO  53          HG3       PRO  53 -29.004  15.995  -1.299
  384   1HD   PRO  53          HD2       PRO  53 -30.380  18.212  -2.127
  385   2HD   PRO  53          HD3       PRO  53 -29.389  18.215  -0.633
  386    H    ILE  54           H        ILE  54 -25.167  18.590  -4.206
  387    HA   ILE  54           HA       ILE  54 -26.421  18.044  -6.839
  388    HB   ILE  54           HB       ILE  54 -23.799  19.487  -6.355
  389   1HG1  ILE  54          2HG1      ILE  54 -26.320  21.067  -7.015
  390   2HG1  ILE  54          3HG1      ILE  54 -25.835  20.798  -5.325
  391   1HG2  ILE  54          1HG2      ILE  54 -24.177  20.446  -8.663
  392   2HG2  ILE  54          2HG2      ILE  54 -24.141  18.695  -8.711
  393   3HG2  ILE  54          3HG2      ILE  54 -25.700  19.528  -8.757
  394   1HD1  ILE  54          1HD1      ILE  54 -23.945  22.060  -7.340
  395   2HD1  ILE  54          2HD1      ILE  54 -24.949  22.942  -6.194
  396   3HD1  ILE  54          3HD1      ILE  54 -23.717  21.811  -5.616
  397    H    GLU  55           H        GLU  55 -25.762  15.979  -5.007
  398    HA   GLU  55           HA       GLU  55 -23.154  14.898  -5.731
  399   1HB   GLU  55          HB2       GLU  55 -23.648  13.094  -4.240
  400   2HB   GLU  55          HB3       GLU  55 -23.898  14.658  -3.481
  401   1HG   GLU  55          HG2       GLU  55 -26.383  14.334  -3.724
  402   2HG   GLU  55          HG3       GLU  55 -26.085  12.759  -4.431
  403    H    GLN  56           H        GLN  56 -22.749  13.868  -7.530
  404    HA   GLN  56           HA       GLN  56 -24.693  13.373  -9.473
  405   1HB   GLN  56          HB2       GLN  56 -21.794  12.484  -9.300
  406   2HB   GLN  56          HB3       GLN  56 -22.794  12.305 -10.731
  407   1HG   GLN  56          HG2       GLN  56 -22.077  14.918  -9.380
  408   2HG   GLN  56          HG3       GLN  56 -21.331  14.273 -10.833
  409   1HE2  GLN  56          1HE2      GLN  56 -24.395  14.929 -12.802
  410   2HE2  GLN  56          2HE2      GLN  56 -23.436  13.496 -12.456
  411    H    GLU  57           H        GLU  57 -24.167  11.403  -6.876
  412    HA   GLU  57           HA       GLU  57 -24.515   8.702  -7.669
  413   1HB   GLU  57          HB2       GLU  57 -25.671  10.376  -5.398
  414   2HB   GLU  57          HB3       GLU  57 -25.728   8.608  -5.440
  415   1HG   GLU  57          HG2       GLU  57 -23.176  10.289  -5.307
  416   2HG   GLU  57          HG3       GLU  57 -23.942   9.417  -3.961
  417    H    ASP  58           H        ASP  58 -26.803  11.301  -7.476
  418    HA   ASP  58           HA       ASP  58 -28.819   9.877  -9.084
  419   1HB   ASP  58          HB2       ASP  58 -29.264   9.233  -6.697
  420   2HB   ASP  58          HB3       ASP  58 -29.455  10.950  -6.291
  421    H    ASN  59           H        ASN  59 -27.408  12.843  -7.915
  422    HA   ASN  59           HA       ASN  59 -29.556  14.526  -9.096
  423   1HB   ASN  59          HB2       ASN  59 -27.008  15.331  -7.649
  424   2HB   ASN  59          HB3       ASN  59 -28.329  16.402  -8.164
  425   1HD2  ASN  59          1HD2      ASN  59 -28.720  14.243  -4.741
  426   2HD2  ASN  59          2HD2      ASN  59 -27.342  14.023  -5.835
  427    H    GLU  60           H        GLU  60 -29.485  14.268 -11.241
  428    HA   GLU  60           HA       GLU  60 -26.993  15.016 -12.738
  429   1HB   GLU  60          HB2       GLU  60 -28.854  12.663 -13.276
  430   2HB   GLU  60          HB3       GLU  60 -27.469  13.168 -14.255
  431   1HG   GLU  60          HG2       GLU  60 -25.943  12.729 -12.354
  432   2HG   GLU  60          HG3       GLU  60 -27.310  12.160 -11.411
  433    H    GLU  61           H        GLU  61 -30.005  16.012 -12.202
  434    HA   GLU  61           HA       GLU  61 -31.752  16.094 -14.162
  435   1HB   GLU  61          HB2       GLU  61 -30.802  18.611 -12.753
  436   2HB   GLU  61          HB3       GLU  61 -32.344  18.413 -13.586
  437   1HG   GLU  61          HG2       GLU  61 -31.459  16.850 -11.123
  438   2HG   GLU  61          HG3       GLU  61 -32.513  18.242 -11.123
  439    H    LYS  62           H        LYS  62 -28.957  18.240 -14.470
  440    HA   LYS  62           HA       LYS  62 -28.895  17.942 -17.359
  441   1HB   LYS  62          HB2       LYS  62 -29.215  20.320 -17.967
  442   2HB   LYS  62          HB3       LYS  62 -30.663  19.559 -17.377
  443   1HG   LYS  62          HG2       LYS  62 -30.088  20.678 -15.065
  444   2HG   LYS  62          HG3       LYS  62 -28.904  21.621 -15.983
  445   1HD   LYS  62          HD2       LYS  62 -30.862  22.242 -17.555
  446   2HD   LYS  62          HD3       LYS  62 -31.913  21.464 -16.349
  447   1HE   LYS  62          HE2       LYS  62 -31.992  23.716 -15.702
  448   2HE   LYS  62          HE3       LYS  62 -30.776  23.016 -14.612
  449   1HZ   LYS  62          HZ1       LYS  62 -29.834  24.978 -15.429
  450   2HZ   LYS  62          HZ2       LYS  62 -29.093  23.815 -16.348
  451   3HZ   LYS  62          HZ3       LYS  62 -30.320  24.715 -16.978
  452    H    TYR  63           H        TYR  63 -27.126  17.147 -15.551
  453    HA   TYR  63           HA       TYR  63 -24.768  18.631 -16.189
  454   1HB   TYR  63          HB2       TYR  63 -24.262  19.065 -13.663
  455   2HB   TYR  63          HB3       TYR  63 -25.186  20.191 -14.590
  456    HD1  TYR  63           HD1      TYR  63 -27.420  20.792 -14.046
  457    HD2  TYR  63           HD2      TYR  63 -25.522  17.478 -12.094
  458    HE1  TYR  63           HE1      TYR  63 -29.220  20.799 -12.341
  459    HE2  TYR  63           HE2      TYR  63 -27.320  17.472 -10.362
  460    HH   TYR  63           HH       TYR  63 -29.245  18.506  -9.611
  461    H    SER  64           H        SER  64 -22.862  17.793 -15.658
  462    HA   SER  64           HA       SER  64 -22.413  15.332 -14.187
  463   1HB   SER  64          HB2       SER  64 -21.808  13.962 -16.137
  464   2HB   SER  64          HB3       SER  64 -23.536  14.389 -16.139
  465    HG   SER  64           HG       SER  64 -22.494  14.653 -18.175
  466    H    PHE  65           H        PHE  65 -20.141  14.665 -14.112
  467    HA   PHE  65           HA       PHE  65 -18.251  16.719 -15.065
  468   1HB   PHE  65          HB2       PHE  65 -17.372  16.720 -12.875
  469   2HB   PHE  65          HB3       PHE  65 -19.090  17.030 -12.895
  470    HD1  PHE  65           HD1      PHE  65 -18.775  16.854 -10.431
  471    HD2  PHE  65           HD2      PHE  65 -18.336  13.390 -12.971
  472    HE1  PHE  65           HE1      PHE  65 -18.962  15.363  -8.445
  473    HE2  PHE  65           HE2      PHE  65 -18.580  11.932 -11.026
  474    HZ   PHE  65           HZ       PHE  65 -18.888  12.896  -8.737
  475    H    ASN  66           H        ASN  66 -15.949  15.997 -14.184
  476    HA   ASN  66           HA       ASN  66 -15.110  13.829 -15.985
  477   1HB   ASN  66          HB2       ASN  66 -12.927  14.827 -15.763
  478   2HB   ASN  66          HB3       ASN  66 -14.105  16.099 -15.976
  479   1HD2  ASN  66          1HD2      ASN  66 -12.152  17.547 -13.343
  480   2HD2  ASN  66          2HD2      ASN  66 -12.219  17.467 -15.100
  481    H    TYR  67           H        TYR  67 -12.866  12.806 -15.015
  482    HA   TYR  67           HA       TYR  67 -13.768  10.754 -13.239
  483   1HB   TYR  67          HB2       TYR  67 -12.276  10.440 -15.191
  484   2HB   TYR  67          HB3       TYR  67 -11.016  11.339 -14.368
  485    HD1  TYR  67           HD1      TYR  67  -9.559  10.255 -12.781
  486    HD2  TYR  67           HD2      TYR  67 -13.113   8.277 -14.203
  487    HE1  TYR  67           HE1      TYR  67  -8.760   8.093 -11.817
  488    HE2  TYR  67           HE2      TYR  67 -12.293   6.108 -13.281
  489    HH   TYR  67           HH       TYR  67 -10.560   5.036 -12.175
  490    H    ASP  68           H        ASP  68 -12.179  13.745 -12.571
  491    HA   ASP  68           HA       ASP  68 -11.227  12.904  -9.836
  492   1HB   ASP  68          HB2       ASP  68 -11.065  15.567 -11.285
  493   2HB   ASP  68          HB3       ASP  68 -10.319  15.171  -9.736
  494    H    GLY  69           H        GLY  69 -14.139  13.888 -11.248
  495   1HA   GLY  69          HA2       GLY  69 -16.150  14.451 -10.312
  496   2HA   GLY  69          HA3       GLY  69 -15.477  14.418  -8.706
  497    H    SER  70           H        SER  70 -13.858  16.441 -11.069
  498    HA   SER  70           HA       SER  70 -14.498  18.757  -9.357
  499   1HB   SER  70          HB2       SER  70 -12.508  19.769 -10.208
  500   2HB   SER  70          HB3       SER  70 -12.164  18.136  -9.603
  501    HG   SER  70           HG       SER  70 -11.112  18.173 -11.433
  502    H    GLU  71           H        GLU  71 -14.034  18.400 -12.909
  503    HA   GLU  71           HA       GLU  71 -15.267  20.970 -13.444
  504   1HB   GLU  71          HB2       GLU  71 -14.411  18.714 -15.281
  505   2HB   GLU  71          HB3       GLU  71 -14.981  20.319 -15.814
  506   1HG   GLU  71          HG2       GLU  71 -13.107  21.417 -14.737
  507   2HG   GLU  71          HG3       GLU  71 -12.538  19.902 -14.025
  508    H    LEU  72           H        LEU  72 -17.337  20.858 -12.531
  509    HA   LEU  72           HA       LEU  72 -19.338  19.016 -13.642
  510   1HB   LEU  72          HB2       LEU  72 -19.393  19.709 -11.242
  511   2HB   LEU  72          HB3       LEU  72 -19.615  21.386 -11.764
  512    HG   LEU  72           HG       LEU  72 -21.775  20.633 -12.886
  513   1HD1  LEU  72          1HD1      LEU  72 -21.384  18.226 -13.061
  514   2HD1  LEU  72          2HD1      LEU  72 -21.214  18.096 -11.297
  515   3HD1  LEU  72          3HD1      LEU  72 -22.779  18.536 -12.023
  516   1HD2  LEU  72          1HD2      LEU  72 -21.755  21.733 -10.646
  517   2HD2  LEU  72          2HD2      LEU  72 -23.045  20.530 -10.813
  518   3HD2  LEU  72          3HD2      LEU  72 -21.580  20.144  -9.883
  519    H    ILE  73           H        ILE  73 -20.240  19.262 -15.481
  520    HA   ILE  73           HA       ILE  73 -20.368  21.939 -16.784
  521    HB   ILE  73           HB       ILE  73 -20.930  19.153 -17.923
  522   1HG1  ILE  73          2HG1      ILE  73 -18.455  20.738 -18.646
  523   2HG1  ILE  73          3HG1      ILE  73 -18.417  19.824 -17.150
  524   1HG2  ILE  73          1HG2      ILE  73 -20.514  21.899 -19.235
  525   2HG2  ILE  73          2HG2      ILE  73 -20.716  20.359 -20.109
  526   3HG2  ILE  73          3HG2      ILE  73 -22.042  20.993 -19.138
  527   1HD1  ILE  73          1HD1      ILE  73 -19.047  18.611 -19.881
  528   2HD1  ILE  73          2HD1      ILE  73 -17.495  18.523 -18.980
  529   3HD1  ILE  73          3HD1      ILE  73 -18.955  17.772 -18.286
  530    H    ILE  74           H        ILE  74 -22.286  22.962 -16.823
  531    HA   ILE  74           HA       ILE  74 -24.816  21.454 -16.298
  532    HB   ILE  74           HB       ILE  74 -24.137  24.379 -15.727
  533   1HG1  ILE  74          2HG1      ILE  74 -25.040  22.257 -13.734
  534   2HG1  ILE  74          3HG1      ILE  74 -23.336  22.489 -14.060
  535   1HG2  ILE  74          1HG2      ILE  74 -26.450  24.232 -16.490
  536   2HG2  ILE  74          2HG2      ILE  74 -26.792  22.933 -15.321
  537   3HG2  ILE  74          3HG2      ILE  74 -26.427  24.577 -14.770
  538   1HD1  ILE  74          1HD1      ILE  74 -23.454  24.834 -13.351
  539   2HD1  ILE  74          2HD1      ILE  74 -25.176  24.610 -12.895
  540   3HD1  ILE  74          3HD1      ILE  74 -23.923  23.713 -12.062
  541    H    LYS  75           H        LYS  75 -26.219  21.385 -17.955
  542    HA   LYS  75           HA       LYS  75 -25.872  23.338 -20.168
  543   1HB   LYS  75          HB2       LYS  75 -26.912  21.711 -21.652
  544   2HB   LYS  75          HB3       LYS  75 -25.482  21.048 -20.849
  545   1HG   LYS  75          HG2       LYS  75 -27.023  19.904 -19.202
  546   2HG   LYS  75          HG3       LYS  75 -28.401  20.413 -20.189
  547   1HD   LYS  75          HD2       LYS  75 -27.308  19.221 -22.146
  548   2HD   LYS  75          HD3       LYS  75 -26.015  18.697 -21.035
  549   1HE   LYS  75          HE2       LYS  75 -27.651  17.500 -19.638
  550   2HE   LYS  75          HE3       LYS  75 -28.970  18.075 -20.682
  551   1HZ   LYS  75          HZ1       LYS  75 -28.317  15.822 -21.257
  552   2HZ   LYS  75          HZ2       LYS  75 -28.028  16.827 -22.512
  553   3HZ   LYS  75          HZ3       LYS  75 -26.790  16.272 -21.569
  554    H    LYS  76           H        LYS  76 -27.623  24.186 -21.149
  555    HA   LYS  76           HA       LYS  76 -29.587  25.289 -21.378
  556   1HB   LYS  76          HB2       LYS  76 -30.981  23.337 -19.533
  557   2HB   LYS  76          HB3       LYS  76 -31.693  24.357 -20.776
  558   1HG   LYS  76          HG2       LYS  76 -30.253  23.066 -22.480
  559   2HG   LYS  76          HG3       LYS  76 -29.986  21.900 -21.155
  560   1HD   LYS  76          HD2       LYS  76 -32.684  22.639 -22.343
  561   2HD   LYS  76          HD3       LYS  76 -31.759  21.175 -22.613
  562   1HE   LYS  76          HE2       LYS  76 -31.954  20.578 -20.191
  563   2HE   LYS  76          HE3       LYS  76 -32.845  22.080 -19.903
  564   1HZ   LYS  76          HZ1       LYS  76 -34.607  21.300 -21.397
  565   2HZ   LYS  76          HZ2       LYS  76 -33.806  19.909 -21.671
  566   3HZ   LYS  76          HZ3       LYS  76 -34.393  20.236 -20.178
  567    H    VAL  77           H        VAL  77 -27.956  26.635 -19.962
  568    HA   VAL  77           HA       VAL  77 -28.683  27.060 -17.233
  569    HB   VAL  77           HB       VAL  77 -26.837  28.606 -19.077
  570   1HG1  VAL  77          1HG1      VAL  77 -25.959  29.678 -16.968
  571   2HG1  VAL  77          2HG1      VAL  77 -27.594  30.218 -17.362
  572   3HG1  VAL  77          3HG1      VAL  77 -27.342  29.034 -16.079
  573   1HG2  VAL  77          1HG2      VAL  77 -26.352  26.690 -16.749
  574   2HG2  VAL  77          2HG2      VAL  77 -26.081  26.351 -18.464
  575   3HG2  VAL  77          3HG2      VAL  77 -25.100  27.570 -17.644
  576    H    ASP  78           H        ASP  78 -29.946  28.438 -16.219
  577    HA   ASP  78           HA       ASP  78 -30.814  30.954 -17.405
  578   1HB   ASP  78          HB2       ASP  78 -32.502  28.997 -18.022
  579   2HB   ASP  78          HB3       ASP  78 -33.028  29.228 -16.347
  580    H    LYS  79           H        LYS  79 -32.573  31.889 -15.551
  581    HA   LYS  79           HA       LYS  79 -30.875  32.627 -13.405
  582   1HB   LYS  79          HB2       LYS  79 -33.852  32.897 -13.957
  583   2HB   LYS  79          HB3       LYS  79 -33.142  33.496 -12.464
  584   1HG   LYS  79          HG2       LYS  79 -32.177  34.408 -15.219
  585   2HG   LYS  79          HG3       LYS  79 -33.432  35.222 -14.294
  586   1HD   LYS  79          HD2       LYS  79 -31.767  35.401 -12.364
  587   2HD   LYS  79          HD3       LYS  79 -30.528  34.813 -13.480
  588   1HE   LYS  79          HE2       LYS  79 -30.300  37.143 -13.437
  589   2HE   LYS  79          HE3       LYS  79 -31.028  36.748 -14.977
  590   1HZ   LYS  79          HZ1       LYS  79 -32.140  38.662 -13.876
  591   2HZ   LYS  79          HZ2       LYS  79 -33.178  37.439 -14.059
  592   3HZ   LYS  79          HZ3       LYS  79 -32.543  37.741 -12.606
  593    H    SER  80           H        SER  80 -32.920  29.821 -13.590
  594    HA   SER  80           HA       SER  80 -33.083  29.331 -10.749
  595   1HB   SER  80          HB2       SER  80 -33.757  27.027 -11.566
  596   2HB   SER  80          HB3       SER  80 -34.747  28.369 -12.151
  597    HG   SER  80           HG       SER  80 -34.125  26.869 -13.826
  598    H    ASP  81           H        ASP  81 -30.447  29.035 -12.942
  599    HA   ASP  81           HA       ASP  81 -29.069  26.942 -11.389
  600   1HB   ASP  81          HB2       ASP  81 -28.194  28.539 -13.803
  601   2HB   ASP  81          HB3       ASP  81 -27.274  27.241 -13.087
  602    H    GLU  82           H        GLU  82 -29.482  30.180 -10.802
  603    HA   GLU  82           HA       GLU  82 -26.821  30.979  -9.974
  604   1HB   GLU  82          HB2       GLU  82 -28.648  32.524 -10.425
  605   2HB   GLU  82          HB3       GLU  82 -29.598  31.923  -9.082
  606   1HG   GLU  82          HG2       GLU  82 -28.133  32.852  -7.479
  607   2HG   GLU  82          HG3       GLU  82 -26.806  33.013  -8.628
  608    H    ALA  83           H        ALA  83 -25.722  30.599  -8.069
  609    HA   ALA  83           HA       ALA  83 -26.942  29.133  -5.836
  610   1HB   ALA  83          HB1       ALA  83 -26.658  27.400  -7.633
  611   2HB   ALA  83          HB2       ALA  83 -24.932  27.743  -7.690
  612   3HB   ALA  83          HB3       ALA  83 -25.635  27.040  -6.224
  613    H    GLU  84           H        GLU  84 -25.438  28.501  -4.162
  614    HA   GLU  84           HA       GLU  84 -22.701  29.656  -4.267
  615   1HB   GLU  84          HB2       GLU  84 -24.075  31.165  -2.876
  616   2HB   GLU  84          HB3       GLU  84 -24.511  29.803  -1.823
  617   1HG   GLU  84          HG2       GLU  84 -22.174  29.521  -1.146
  618   2HG   GLU  84          HG3       GLU  84 -21.627  30.590  -2.410
  619    H    TYR  85           H        TYR  85 -21.306  28.048  -4.012
  620    HA   TYR  85           HA       TYR  85 -22.398  25.354  -3.292
  621   1HB   TYR  85          HB2       TYR  85 -19.838  26.043  -4.732
  622   2HB   TYR  85          HB3       TYR  85 -20.579  24.478  -4.580
  623    HD1  TYR  85           HD1      TYR  85 -22.681  23.928  -5.820
  624    HD2  TYR  85           HD2      TYR  85 -20.502  27.571  -6.520
  625    HE1  TYR  85           HE1      TYR  85 -23.737  24.116  -8.073
  626    HE2  TYR  85           HE2      TYR  85 -21.578  27.770  -8.752
  627    HH   TYR  85           HH       TYR  85 -23.916  25.400 -10.012
  628    H    ILE  86           H        ILE  86 -21.889  24.498  -1.458
  629    HA   ILE  86           HA       ILE  86 -19.201  25.050  -0.210
  630    HB   ILE  86           HB       ILE  86 -21.739  24.010   1.100
  631   1HG1  ILE  86          2HG1      ILE  86 -21.316  25.899   2.685
  632   2HG1  ILE  86          3HG1      ILE  86 -20.079  26.527   1.602
  633   1HG2  ILE  86          1HG2      ILE  86 -20.311  23.885   3.182
  634   2HG2  ILE  86          2HG2      ILE  86 -19.765  22.744   1.936
  635   3HG2  ILE  86          3HG2      ILE  86 -18.890  24.269   2.195
  636   1HD1  ILE  86          1HD1      ILE  86 -22.993  26.163   0.796
  637   2HD1  ILE  86          2HD1      ILE  86 -22.351  27.645   1.541
  638   3HD1  ILE  86          3HD1      ILE  86 -21.735  27.114  -0.032
  639    H    CYS  87           H        CYS  87 -17.780  23.454  -0.509
  640    HA   CYS  87           HA       CYS  87 -18.796  20.799  -1.341
  641   1HB   CYS  87          HB2       CYS  87 -16.967  20.695  -3.015
  642   2HB   CYS  87          HB3       CYS  87 -18.220  21.857  -3.382
  643    H    ILE  88           H        ILE  88 -17.921  19.010  -0.660
  644    HA   ILE  88           HA       ILE  88 -15.661  19.197   1.307
  645    HB   ILE  88           HB       ILE  88 -18.271  17.670   1.608
  646   1HG1  ILE  88          2HG1      ILE  88 -17.384  20.266   2.949
  647   2HG1  ILE  88          3HG1      ILE  88 -18.688  20.087   1.780
  648   1HG2  ILE  88          1HG2      ILE  88 -16.003  18.204   3.618
  649   2HG2  ILE  88          2HG2      ILE  88 -17.463  17.235   3.900
  650   3HG2  ILE  88          3HG2      ILE  88 -16.307  16.645   2.764
  651   1HD1  ILE  88          1HD1      ILE  88 -19.711  20.257   3.914
  652   2HD1  ILE  88          2HD1      ILE  88 -19.911  18.590   3.355
  653   3HD1  ILE  88          3HD1      ILE  88 -18.700  18.976   4.611
  654    H    ALA  89           H        ALA  89 -14.305  17.464   1.329
  655    HA   ALA  89           HA       ALA  89 -14.978  15.017  -0.230
  656   1HB   ALA  89          HB1       ALA  89 -12.282  16.387  -0.167
  657   2HB   ALA  89          HB2       ALA  89 -12.672  14.856  -1.004
  658   3HB   ALA  89          HB3       ALA  89 -13.398  16.384  -1.557
  659    H    GLU  90           H        GLU  90 -14.712  13.182   0.893
  660    HA   GLU  90           HA       GLU  90 -13.277  13.213   3.511
  661   1HB   GLU  90          HB2       GLU  90 -15.841  13.519   3.518
  662   2HB   GLU  90          HB3       GLU  90 -15.925  11.895   2.855
  663   1HG   GLU  90          HG2       GLU  90 -14.684  11.062   4.872
  664   2HG   GLU  90          HG3       GLU  90 -14.767  12.694   5.551
  665    H    ASN  91           H        ASN  91 -12.410  11.208   4.175
  666    HA   ASN  91           HA       ASN  91 -12.853   8.795   2.565
  667   1HB   ASN  91          HB2       ASN  91 -10.588  10.318   1.934
  668   2HB   ASN  91          HB3       ASN  91  -9.955   9.139   3.110
  669   1HD2  ASN  91          1HD2      ASN  91  -9.871   7.910  -0.485
  670   2HD2  ASN  91          2HD2      ASN  91  -9.262   9.339   0.316
  671    H    LYS  92           H        LYS  92 -11.755   6.896   3.787
  672    HA   LYS  92           HA       LYS  92 -12.261   7.007   6.594
  673   1HB   LYS  92          HB2       LYS  92 -11.403   4.831   6.710
  674   2HB   LYS  92          HB3       LYS  92 -12.221   4.966   5.159
  675   1HG   LYS  92          HG2       LYS  92  -9.207   4.979   5.659
  676   2HG   LYS  92          HG3       LYS  92 -10.159   3.646   5.044
  677   1HD   LYS  92          HD2       LYS  92 -10.714   5.091   2.998
  678   2HD   LYS  92          HD3       LYS  92  -9.562   6.297   3.619
  679   1HE   LYS  92          HE2       LYS  92  -8.277   5.023   2.141
  680   2HE   LYS  92          HE3       LYS  92  -7.839   4.384   3.717
  681   1HZ   LYS  92          HZ1       LYS  92  -8.350   2.603   2.038
  682   2HZ   LYS  92          HZ2       LYS  92  -9.322   2.461   3.328
  683   3HZ   LYS  92          HZ3       LYS  92  -9.906   3.100   1.946
  684    H    ALA  93           H        ALA  93  -9.439   7.876   4.884
  685    HA   ALA  93           HA       ALA  93  -7.660   8.035   7.199
  686   1HB   ALA  93          HB1       ALA  93  -6.012   8.685   5.555
  687   2HB   ALA  93          HB2       ALA  93  -6.920   7.309   4.943
  688   3HB   ALA  93          HB3       ALA  93  -7.267   8.946   4.319
  689    H    GLY  94           H        GLY  94  -9.929  10.352   5.842
  690   1HA   GLY  94          HA2       GLY  94  -9.283  12.446   7.595
  691   2HA   GLY  94          HA3       GLY  94  -8.315  12.700   6.163
  692    H    GLU  95           H        GLU  95  -9.512  14.752   6.085
  693    HA   GLU  95           HA       GLU  95 -11.934  14.723   4.475
  694   1HB   GLU  95          HB2       GLU  95 -12.727  14.246   6.812
  695   2HB   GLU  95          HB3       GLU  95 -12.079  15.808   7.308
  696   1HG   GLU  95          HG2       GLU  95 -13.628  16.911   5.627
  697   2HG   GLU  95          HG3       GLU  95 -14.312  15.320   5.306
  698    H    GLN  96           H        GLN  96 -12.326  16.758   3.503
  699    HA   GLN  96           HA       GLN  96 -11.048  19.205   4.503
  700   1HB   GLN  96          HB2       GLN  96  -9.289  17.926   3.146
  701   2HB   GLN  96          HB3       GLN  96 -10.289  18.193   1.734
  702   1HG   GLN  96          HG2       GLN  96  -8.416  19.820   1.915
  703   2HG   GLN  96          HG3       GLN  96  -9.983  20.617   1.937
  704   1HE2  GLN  96          1HE2      GLN  96  -7.759  19.156   4.428
  705   2HE2  GLN  96          2HE2      GLN  96  -7.925  20.514   5.516
  706    H    ASP  97           H        ASP  97 -11.666  21.147   3.064
  707    HA   ASP  97           HA       ASP  97 -14.017  20.801   1.330
  708   1HB   ASP  97          HB2       ASP  97 -15.454  22.248   2.666
  709   2HB   ASP  97          HB3       ASP  97 -15.049  20.763   3.514
  710    H    ALA  98           H        ALA  98 -14.666  22.597   0.152
  711    HA   ALA  98           HA       ALA  98 -13.245  25.197   0.406
  712   1HB   ALA  98          HB1       ALA  98 -12.725  25.278  -2.011
  713   2HB   ALA  98          HB2       ALA  98 -11.953  23.899  -1.296
  714   3HB   ALA  98          HB3       ALA  98 -13.433  23.692  -2.244
  715    H    THR  99           H        THR  99 -14.303  26.760  -1.425
  716    HA   THR  99           HA       THR  99 -17.246  26.481  -1.442
  717    HB   THR  99           HB       THR  99 -15.765  28.857  -0.259
  718    HG1  THR  99           HG1      THR  99 -16.909  26.612   0.992
  719   1HG2  THR  99          1HG2      THR  99 -17.997  29.450   0.725
  720   2HG2  THR  99          2HG2      THR  99 -17.975  29.502  -1.032
  721   3HG2  THR  99          3HG2      THR  99 -18.732  28.120  -0.214
  722    H    ILE 100           H        ILE 100 -18.233  27.623  -3.070
  723    HA   ILE 100           HA       ILE 100 -16.762  29.522  -4.843
  724    HB   ILE 100           HB       ILE 100 -18.229  27.006  -5.805
  725   1HG1  ILE 100          2HG1      ILE 100 -15.258  27.565  -5.816
  726   2HG1  ILE 100          3HG1      ILE 100 -16.082  26.371  -4.818
  727   1HG2  ILE 100          1HG2      ILE 100 -18.528  28.679  -7.522
  728   2HG2  ILE 100          2HG2      ILE 100 -16.848  29.243  -7.349
  729   3HG2  ILE 100          3HG2      ILE 100 -17.235  27.684  -8.079
  730   1HD1  ILE 100          1HD1      ILE 100 -15.675  26.227  -7.767
  731   2HD1  ILE 100          2HD1      ILE 100 -15.071  25.163  -6.498
  732   3HD1  ILE 100          3HD1      ILE 100 -16.821  25.186  -6.892
  733    H    HIS 101           H        HIS 101 -18.364  30.648  -6.329
  734    HA   HIS 101           HA       HIS 101 -21.234  30.388  -5.615
  735   1HB   HIS 101          HB2       HIS 101 -20.114  32.309  -4.333
  736   2HB   HIS 101          HB3       HIS 101 -19.837  33.077  -5.888
  737    HD1  HIS 101           HD1      HIS 101 -22.293  32.997  -3.137
  738    HD2  HIS 101           HD2      HIS 101 -22.242  33.708  -7.278
  739    HE1  HIS 101           HE1      HIS 101 -24.462  34.178  -3.655
  740    H    LEU 102           H        LEU 102 -22.681  30.958  -7.351
  741    HA   LEU 102           HA       LEU 102 -21.449  31.690  -9.947
  742   1HB   LEU 102          HB2       LEU 102 -21.789  29.371 -10.174
  743   2HB   LEU 102          HB3       LEU 102 -23.381  29.433  -9.378
  744    HG   LEU 102           HG       LEU 102 -24.316  30.659 -11.327
  745   1HD1  LEU 102          1HD1      LEU 102 -23.077  30.836 -13.403
  746   2HD1  LEU 102          2HD1      LEU 102 -22.212  31.733 -12.144
  747   3HD1  LEU 102          3HD1      LEU 102 -21.634  30.141 -12.660
  748   1HD2  LEU 102          1HD2      LEU 102 -22.891  28.106 -12.145
  749   2HD2  LEU 102          2HD2      LEU 102 -24.416  28.191 -11.225
  750   3HD2  LEU 102          3HD2      LEU 102 -24.328  28.799 -12.900
  751    H    LYS 103           H        LYS 103 -22.164  33.645 -10.284
  752    HA   LYS 103           HA       LYS 103 -24.986  34.430  -9.703
  753   1HB   LYS 103          HB2       LYS 103 -22.680  35.973 -10.973
  754   2HB   LYS 103          HB3       LYS 103 -24.276  36.624 -10.604
  755   1HG   LYS 103          HG2       LYS 103 -23.870  36.017  -8.136
  756   2HG   LYS 103          HG3       LYS 103 -22.209  35.622  -8.616
  757   1HD   LYS 103          HD2       LYS 103 -23.539  38.366  -8.940
  758   2HD   LYS 103          HD3       LYS 103 -22.451  37.882  -7.634
  759   1HE   LYS 103          HE2       LYS 103 -20.637  37.433  -9.290
  760   2HE   LYS 103          HE3       LYS 103 -21.719  37.923 -10.594
  761   1HZ   LYS 103          HZ1       LYS 103 -20.294  39.767  -9.900
  762   2HZ   LYS 103          HZ2       LYS 103 -21.864  40.144  -9.596
  763   3HZ   LYS 103          HZ3       LYS 103 -20.864  39.700  -8.374
  764    H    VAL 104           H        VAL 104 -26.518  34.954 -11.344
  765    HA   VAL 104           HA       VAL 104 -25.787  34.315 -14.188
  766    HB   VAL 104           HB       VAL 104 -28.345  33.529 -12.767
  767   1HG1  VAL 104          1HG1      VAL 104 -28.783  32.254 -14.887
  768   2HG1  VAL 104          2HG1      VAL 104 -28.734  33.993 -15.129
  769   3HG1  VAL 104          3HG1      VAL 104 -27.351  32.979 -15.610
  770   1HG2  VAL 104          1HG2      VAL 104 -27.608  31.176 -13.168
  771   2HG2  VAL 104          2HG2      VAL 104 -26.043  31.770 -13.734
  772   3HG2  VAL 104          3HG2      VAL 104 -26.535  32.022 -12.043
  773    H    PHE 105           H        PHE 105 -26.380  35.883 -15.677
  774    HA   PHE 105           HA       PHE 105 -28.292  37.976 -14.820
  775   1HB   PHE 105          HB2       PHE 105 -27.066  39.394 -16.360
  776   2HB   PHE 105          HB3       PHE 105 -26.087  38.882 -14.987
  777    HD1  PHE 105           HD1      PHE 105 -24.220  37.239 -15.314
  778    HD2  PHE 105           HD2      PHE 105 -26.422  38.929 -18.637
  779    HE1  PHE 105           HE1      PHE 105 -22.382  36.613 -16.873
  780    HE2  PHE 105           HE2      PHE 105 -24.548  38.325 -20.172
  781    HZ   PHE 105           HZ       PHE 105 -22.526  37.171 -19.272
  782    H    ALA 106           H        ALA 106 -29.849  38.686 -16.232
  783    HA   ALA 106           HA       ALA 106 -30.620  36.779 -18.382
  784   1HB   ALA 106          HB1       ALA 106 -32.827  37.829 -18.165
  785   2HB   ALA 106          HB2       ALA 106 -32.246  37.179 -16.640
  786   3HB   ALA 106          HB3       ALA 106 -32.173  38.940 -16.947
  787    H    LYS 107           H        LYS 107 -28.559  37.952 -19.252
  788    HA   LYS 107           HA       LYS 107 -27.615  38.978 -21.060
  789   1HB   LYS 107          HB2       LYS 107 -30.457  39.446 -22.044
  790   2HB   LYS 107          HB3       LYS 107 -28.977  39.563 -22.982
  791   1HG   LYS 107          HG2       LYS 107 -28.562  37.189 -22.793
  792   2HG   LYS 107          HG3       LYS 107 -29.862  36.993 -21.625
  793   1HD   LYS 107          HD2       LYS 107 -30.574  36.180 -23.809
  794   2HD   LYS 107          HD3       LYS 107 -31.521  37.593 -23.317
  795   1HE   LYS 107          HE2       LYS 107 -30.085  39.018 -24.802
  796   2HE   LYS 107          HE3       LYS 107 -29.160  37.594 -25.273
  797   1HZ   LYS 107          HZ1       LYS 107 -30.893  38.114 -26.900
  798   2HZ   LYS 107          HZ2       LYS 107 -31.212  36.661 -26.229
  799   3HZ   LYS 107          HZ3       LYS 107 -32.066  37.992 -25.784
  Start of MODEL   20
    1   1H    GLY   1          H1        GLY   1   4.001  14.009   0.773
    2   2H    GLY   1          H2        GLY   1   3.492  14.658  -0.638
    3   3H    GLY   1          H3        GLY   1   2.399  14.227   0.497
    4   1HA   GLY   1          HA2       GLY   1   4.162  12.375  -0.924
    5   2HA   GLY   1          HA3       GLY   1   2.929  11.913   0.262
    6    H    LYS   2           H        LYS   2   2.800  10.681  -2.092
    7    HA   LYS   2           HA       LYS   2   0.240  11.500  -3.259
    8   1HB   LYS   2          HB2       LYS   2   1.030  11.710  -5.560
    9   2HB   LYS   2          HB3       LYS   2   1.739  12.931  -4.540
   10   1HG   LYS   2          HG2       LYS   2   3.835  11.530  -4.421
   11   2HG   LYS   2          HG3       LYS   2   3.083  10.358  -5.487
   12   1HD   LYS   2          HD2       LYS   2   2.889  12.108  -7.250
   13   2HD   LYS   2          HD3       LYS   2   3.720  13.248  -6.152
   14   1HE   LYS   2          HE2       LYS   2   5.680  11.762  -6.071
   15   2HE   LYS   2          HE3       LYS   2   4.878  10.580  -7.126
   16   1HZ   LYS   2          HZ1       LYS   2   6.372  12.045  -8.365
   17   2HZ   LYS   2          HZ2       LYS   2   4.829  12.292  -8.872
   18   3HZ   LYS   2          HZ3       LYS   2   5.581  13.374  -7.898
   19    H    ASP   3           H        ASP   3  -0.582   9.896  -4.827
   20    HA   ASP   3           HA       ASP   3   0.184   7.147  -4.138
   21   1HB   ASP   3          HB2       ASP   3  -1.668   6.469  -5.497
   22   2HB   ASP   3          HB3       ASP   3  -2.182   7.783  -4.493
   23    H    ILE   4           H        ILE   4   1.139   5.638  -5.697
   24    HA   ILE   4           HA       ILE   4   2.717   6.967  -7.895
   25    HB   ILE   4           HB       ILE   4   3.575   4.556  -6.260
   26   1HG1  ILE   4          2HG1      ILE   4   3.476   6.503  -4.750
   27   2HG1  ILE   4          3HG1      ILE   4   5.102   5.949  -5.053
   28   1HG2  ILE   4          1HG2      ILE   4   5.794   5.054  -7.244
   29   2HG2  ILE   4          2HG2      ILE   4   4.609   4.644  -8.484
   30   3HG2  ILE   4          3HG2      ILE   4   5.089   6.341  -8.225
   31   1HD1  ILE   4          1HD1      ILE   4   5.568   7.857  -6.501
   32   2HD1  ILE   4          2HD1      ILE   4   3.878   8.355  -6.449
   33   3HD1  ILE   4          3HD1      ILE   4   4.873   8.422  -4.961
   34    H    GLN   5           H        GLN   5   2.232   3.544  -7.237
   35    HA   GLN   5           HA       GLN   5   0.173   3.088  -9.177
   36   1HB   GLN   5          HB2       GLN   5   1.365   1.698 -10.777
   37   2HB   GLN   5          HB3       GLN   5   2.007   3.319 -10.798
   38   1HG   GLN   5          HG2       GLN   5   3.949   2.543  -9.352
   39   2HG   GLN   5          HG3       GLN   5   3.310   0.903  -9.457
   40   1HE2  GLN   5          1HE2      GLN   5   5.427   2.466 -12.583
   41   2HE2  GLN   5          2HE2      GLN   5   5.109   3.416 -11.143
   42    H    VAL   6           H        VAL   6   0.640   2.681  -6.494
   43    HA   VAL   6           HA       VAL   6   0.134  -0.120  -5.866
   44    HB   VAL   6           HB       VAL   6   2.664   1.249  -4.792
   45   1HG1  VAL   6          1HG1      VAL   6   3.092  -1.014  -3.779
   46   2HG1  VAL   6          2HG1      VAL   6   1.737  -0.178  -3.065
   47   3HG1  VAL   6          3HG1      VAL   6   1.459  -1.517  -4.243
   48   1HG2  VAL   6          1HG2      VAL   6   3.921  -0.621  -5.861
   49   2HG2  VAL   6          2HG2      VAL   6   2.425  -1.156  -6.645
   50   3HG2  VAL   6          3HG2      VAL   6   3.149   0.429  -7.047
   51    H    ILE   7           H        ILE   7  -0.498  -0.211  -3.566
   52    HA   ILE   7           HA       ILE   7  -2.137   1.989  -2.721
   53    HB   ILE   7           HB       ILE   7  -1.158  -0.355  -1.073
   54   1HG1  ILE   7          2HG1      ILE   7  -3.718  -0.065  -2.756
   55   2HG1  ILE   7          3HG1      ILE   7  -2.336  -1.062  -3.167
   56   1HG2  ILE   7          1HG2      ILE   7  -3.546   1.524  -0.652
   57   2HG2  ILE   7          2HG2      ILE   7  -3.101   0.111   0.359
   58   3HG2  ILE   7          3HG2      ILE   7  -2.035   1.481   0.313
   59   1HD1  ILE   7          1HD1      ILE   7  -4.206  -1.486  -0.819
   60   2HD1  ILE   7          2HD1      ILE   7  -4.047  -2.495  -2.255
   61   3HD1  ILE   7          3HD1      ILE   7  -2.724  -2.418  -1.078
   62    H    VAL   8           H        VAL   8  -1.273   3.896  -2.329
   63    HA   VAL   8           HA       VAL   8   0.541   4.390  -0.072
   64    HB   VAL   8           HB       VAL   8   1.111   5.493  -2.884
   65   1HG1  VAL   8          1HG1      VAL   8   2.512   5.884  -0.178
   66   2HG1  VAL   8          2HG1      VAL   8   3.089   6.541  -1.706
   67   3HG1  VAL   8          3HG1      VAL   8   1.551   7.122  -1.014
   68   1HG2  VAL   8          1HG2      VAL   8   3.289   4.378  -2.732
   69   2HG2  VAL   8          2HG2      VAL   8   2.775   3.565  -1.246
   70   3HG2  VAL   8          3HG2      VAL   8   1.974   3.225  -2.801
   71    H    ASN   9           H        ASN   9  -1.033   5.415   1.025
   72    HA   ASN   9           HA       ASN   9  -3.207   6.658  -0.320
   73   1HB   ASN   9          HB2       ASN   9  -4.258   6.827   1.835
   74   2HB   ASN   9          HB3       ASN   9  -3.436   5.257   1.727
   75   1HD2  ASN   9          1HD2      ASN   9  -1.132   6.107   4.315
   76   2HD2  ASN   9          2HD2      ASN   9  -1.653   4.863   3.184
   77    H    VAL  10           H        VAL  10  -4.209   8.592   0.099
   78    HA   VAL  10           HA       VAL  10  -2.573  10.945   0.814
   79    HB   VAL  10           HB       VAL  10  -4.064  10.868  -1.847
   80   1HG1  VAL  10          1HG1      VAL  10  -1.938  12.779  -0.745
   81   2HG1  VAL  10          2HG1      VAL  10  -2.719  12.858  -2.347
   82   3HG1  VAL  10          3HG1      VAL  10  -3.679  13.135  -0.878
   83   1HG2  VAL  10          1HG2      VAL  10  -2.194   9.294  -2.095
   84   2HG2  VAL  10          2HG2      VAL  10  -1.937  10.781  -3.011
   85   3HG2  VAL  10          3HG2      VAL  10  -1.068  10.519  -1.479
   86    HA   PRO  11           HA       PRO  11  -6.642  12.028   2.515
   87   1HB   PRO  11          HB2       PRO  11  -5.373  14.764   2.374
   88   2HB   PRO  11          HB3       PRO  11  -6.357  14.089   3.722
   89   1HG   PRO  11          HG2       PRO  11  -3.681  14.055   3.985
   90   2HG   PRO  11          HG3       PRO  11  -4.594  12.549   4.321
   91   1HD   PRO  11          HD2       PRO  11  -3.095  13.287   1.761
   92   2HD   PRO  11          HD3       PRO  11  -3.033  11.785   2.707
   93    HA   PRO  12           HA       PRO  12  -8.893  13.744  -0.955
   94   1HB   PRO  12          HB2       PRO  12 -11.336  14.004   0.104
   95   2HB   PRO  12          HB3       PRO  12 -10.456  12.440   0.256
   96   1HG   PRO  12          HG2       PRO  12 -10.721  14.625   2.333
   97   2HG   PRO  12          HG3       PRO  12 -10.921  12.868   2.529
   98   1HD   PRO  12          HD2       PRO  12  -8.561  14.281   3.024
   99   2HD   PRO  12          HD3       PRO  12  -8.678  12.527   2.745
  100    H    SER  13           H        SER  13  -7.388  15.668  -0.947
  101    HA   SER  13           HA       SER  13  -8.012  18.012   0.650
  102   1HB   SER  13          HB2       SER  13  -5.904  17.545  -1.487
  103   2HB   SER  13          HB3       SER  13  -6.005  18.957  -0.420
  104    HG   SER  13           HG       SER  13  -4.573  17.304   0.338
  105    H    VAL  14           H        VAL  14 -10.301  17.998  -0.470
  106    HA   VAL  14           HA       VAL  14 -10.416  19.159  -3.051
  107    HB   VAL  14           HB       VAL  14 -12.343  18.000  -2.062
  108   1HG1  VAL  14          1HG1      VAL  14 -12.881  20.518  -0.426
  109   2HG1  VAL  14          2HG1      VAL  14 -13.947  19.119  -0.575
  110   3HG1  VAL  14          3HG1      VAL  14 -12.384  18.945   0.215
  111   1HG2  VAL  14          1HG2      VAL  14 -14.057  19.341  -3.019
  112   2HG2  VAL  14          2HG2      VAL  14 -13.129  20.827  -2.804
  113   3HG2  VAL  14          3HG2      VAL  14 -12.594  19.619  -3.995
  114    H    ARG  15           H        ARG  15 -10.496  21.139  -3.788
  115    HA   ARG  15           HA       ARG  15 -10.460  23.562  -2.024
  116   1HB   ARG  15          HB2       ARG  15  -8.465  22.810  -4.198
  117   2HB   ARG  15          HB3       ARG  15  -8.684  24.484  -3.639
  118   1HG   ARG  15          HG2       ARG  15  -8.201  23.827  -1.329
  119   2HG   ARG  15          HG3       ARG  15  -8.007  22.138  -1.832
  120   1HD   ARG  15          HD2       ARG  15  -6.099  22.865  -3.311
  121   2HD   ARG  15          HD3       ARG  15  -6.234  24.486  -2.598
  122    HE   ARG  15           HE       ARG  15  -6.098  22.557  -0.475
  123   1HH1  ARG  15          1HH1      ARG  15  -2.480  23.282  -1.994
  124   2HH1  ARG  15          2HH1      ARG  15  -3.878  23.704  -2.965
  125   1HH2  ARG  15          1HH2      ARG  15  -4.278  22.181   0.706
  126   2HH2  ARG  15          2HH2      ARG  15  -2.709  22.476  -0.010
  127    H    ALA  16           H        ALA  16 -10.625  25.528  -3.572
  128    HA   ALA  16           HA       ALA  16 -12.959  25.102  -5.412
  129   1HB   ALA  16          HB1       ALA  16 -11.829  27.645  -4.184
  130   2HB   ALA  16          HB2       ALA  16 -13.210  27.520  -5.288
  131   3HB   ALA  16          HB3       ALA  16 -13.298  26.763  -3.679
  132    H    ARG  17           H        ARG  17 -12.549  24.917  -7.550
  133    HA   ARG  17           HA       ARG  17  -9.950  25.598  -8.663
  134   1HB   ARG  17          HB2       ARG  17 -11.530  23.689  -9.389
  135   2HB   ARG  17          HB3       ARG  17 -12.394  24.922 -10.294
  136   1HG   ARG  17          HG2       ARG  17 -10.280  25.508 -11.478
  137   2HG   ARG  17          HG3       ARG  17  -9.450  24.204 -10.613
  138   1HD   ARG  17          HD2       ARG  17 -11.796  23.879 -12.527
  139   2HD   ARG  17          HD3       ARG  17 -10.100  23.652 -12.963
  140    HE   ARG  17           HE       ARG  17 -11.840  21.791 -11.536
  141   1HH1  ARG  17          1HH1      ARG  17  -8.443  22.488 -12.091
  142   2HH1  ARG  17          2HH1      ARG  17  -7.987  20.825 -11.907
  143   1HH2  ARG  17          1HH2      ARG  17 -11.175  19.677 -11.290
  144   2HH2  ARG  17          2HH2      ARG  17  -9.457  19.316 -11.395
  145    H    GLN  18           H        GLN  18 -13.011  27.196  -8.473
  146    HA   GLN  18           HA       GLN  18 -11.867  29.818  -9.149
  147   1HB   GLN  18          HB2       GLN  18 -14.226  28.549 -10.621
  148   2HB   GLN  18          HB3       GLN  18 -14.099  30.297 -10.429
  149   1HG   GLN  18          HG2       GLN  18 -11.956  28.659 -11.820
  150   2HG   GLN  18          HG3       GLN  18 -13.284  29.456 -12.627
  151   1HE2  GLN  18          1HE2      GLN  18 -11.973  32.803 -12.075
  152   2HE2  GLN  18          2HE2      GLN  18 -13.495  31.935 -12.183
  153    H    SER  19           H        SER  19 -12.775  31.382  -7.741
  154    HA   SER  19           HA       SER  19 -14.563  30.316  -5.657
  155   1HB   SER  19          HB2       SER  19 -14.101  32.486  -4.569
  156   2HB   SER  19          HB3       SER  19 -12.618  31.595  -4.989
  157    HG   SER  19           HG       SER  19 -12.511  33.834  -5.539
  158    H    THR  20           H        THR  20 -14.883  32.533  -8.374
  159    HA   THR  20           HA       THR  20 -17.839  32.615  -7.937
  160    HB   THR  20           HB       THR  20 -16.181  35.056  -8.636
  161    HG1  THR  20           HG1      THR  20 -16.161  34.581  -6.412
  162   1HG2  THR  20          1HG2      THR  20 -19.156  34.597  -8.392
  163   2HG2  THR  20          2HG2      THR  20 -18.417  36.205  -8.353
  164   3HG2  THR  20          3HG2      THR  20 -18.259  35.210  -9.797
  165    H    MET  21           H        MET  21 -18.756  31.882  -9.625
  166    HA   MET  21           HA       MET  21 -17.582  32.055 -12.389
  167   1HB   MET  21          HB2       MET  21 -19.611  30.157 -11.105
  168   2HB   MET  21          HB3       MET  21 -19.235  30.175 -12.834
  169   1HG   MET  21          HG2       MET  21 -17.212  29.658 -10.646
  170   2HG   MET  21          HG3       MET  21 -18.023  28.420 -11.591
  171   1HE   MET  21          HE1       MET  21 -16.486  29.059 -15.210
  172   2HE   MET  21          HE2       MET  21 -17.792  28.236 -14.305
  173   3HE   MET  21          HE3       MET  21 -17.875  29.975 -14.640
  174    H    ASN  22           H        ASN  22 -19.156  32.388 -14.093
  175    HA   ASN  22           HA       ASN  22 -21.749  33.508 -13.434
  176   1HB   ASN  22          HB2       ASN  22 -21.351  35.702 -14.458
  177   2HB   ASN  22          HB3       ASN  22 -20.230  35.428 -13.136
  178   1HD2  ASN  22          1HD2      ASN  22 -17.353  35.699 -15.179
  179   2HD2  ASN  22          2HD2      ASN  22 -17.979  35.399 -13.581
  180    H    ALA  23           H        ALA  23 -23.033  33.976 -15.334
  181    HA   ALA  23           HA       ALA  23 -22.420  32.724 -17.900
  182   1HB   ALA  23          HB1       ALA  23 -24.228  31.295 -15.867
  183   2HB   ALA  23          HB2       ALA  23 -23.972  30.778 -17.558
  184   3HB   ALA  23          HB3       ALA  23 -22.642  30.725 -16.381
  185    H    THR  24           H        THR  24 -24.311  32.646 -19.320
  186    HA   THR  24           HA       THR  24 -26.090  34.970 -18.743
  187    HB   THR  24           HB       THR  24 -25.517  33.809 -21.502
  188    HG1  THR  24           HG1      THR  24 -23.549  34.367 -20.557
  189   1HG2  THR  24          1HG2      THR  24 -26.420  36.518 -20.424
  190   2HG2  THR  24          2HG2      THR  24 -26.017  36.185 -22.135
  191   3HG2  THR  24          3HG2      THR  24 -27.379  35.355 -21.377
  192    H    ALA  25           H        ALA  25 -28.109  34.583 -18.315
  193    HA   ALA  25           HA       ALA  25 -29.550  32.087 -18.992
  194   1HB   ALA  25          HB1       ALA  25 -30.342  34.644 -17.522
  195   2HB   ALA  25          HB2       ALA  25 -31.370  33.210 -17.696
  196   3HB   ALA  25          HB3       ALA  25 -29.852  33.086 -16.790
  197    H    ASN  26           H        ASN  26 -31.721  32.259 -19.951
  198    HA   ASN  26           HA       ASN  26 -33.043  32.492 -21.730
  199   1HB   ASN  26          HB2       ASN  26 -31.947  35.286 -22.193
  200   2HB   ASN  26          HB3       ASN  26 -33.451  34.621 -22.769
  201   1HD2  ASN  26          1HD2      ASN  26 -33.276  36.243 -19.077
  202   2HD2  ASN  26          2HD2      ASN  26 -31.838  36.122 -20.105
  203    H    LEU  27           H        LEU  27 -29.681  32.678 -22.167
  204    HA   LEU  27           HA       LEU  27 -29.849  32.069 -25.067
  205   1HB   LEU  27          HB2       LEU  27 -27.422  32.596 -23.316
  206   2HB   LEU  27          HB3       LEU  27 -27.396  32.347 -25.067
  207    HG   LEU  27           HG       LEU  27 -28.594  34.695 -23.524
  208   1HD1  LEU  27          1HD1      LEU  27 -26.929  35.984 -24.742
  209   2HD1  LEU  27          2HD1      LEU  27 -26.109  34.628 -23.935
  210   3HD1  LEU  27          3HD1      LEU  27 -26.438  34.565 -25.684
  211   1HD2  LEU  27          1HD2      LEU  27 -28.717  34.125 -26.510
  212   2HD2  LEU  27          2HD2      LEU  27 -30.104  34.297 -25.421
  213   3HD2  LEU  27          3HD2      LEU  27 -29.097  35.712 -25.781
  214    H    SER  28           H        SER  28 -29.989  30.332 -22.245
  215    HA   SER  28           HA       SER  28 -29.758  28.140 -21.666
  216   1HB   SER  28          HB2       SER  28 -30.003  27.699 -24.677
  217   2HB   SER  28          HB3       SER  28 -30.328  26.511 -23.385
  218    HG   SER  28           HG       SER  28 -32.226  27.655 -24.187
  219    H    GLN  29           H        GLN  29 -27.287  29.334 -21.686
  220    HA   GLN  29           HA       GLN  29 -25.313  28.031 -23.275
  221   1HB   GLN  29          HB2       GLN  29 -25.168  29.568 -20.656
  222   2HB   GLN  29          HB3       GLN  29 -23.719  28.919 -21.450
  223   1HG   GLN  29          HG2       GLN  29 -24.270  30.138 -23.517
  224   2HG   GLN  29          HG3       GLN  29 -25.655  30.891 -22.710
  225   1HE2  GLN  29          1HE2      GLN  29 -22.612  33.158 -22.528
  226   2HE2  GLN  29          2HE2      GLN  29 -23.291  32.241 -23.866
  227    H    SER  30           H        SER  30 -23.643  26.621 -22.693
  228    HA   SER  30           HA       SER  30 -24.181  24.694 -20.468
  229   1HB   SER  30          HB2       SER  30 -22.684  24.222 -23.061
  230   2HB   SER  30          HB3       SER  30 -22.779  23.076 -21.717
  231    HG   SER  30           HG       SER  30 -24.367  22.701 -23.372
  232    H    VAL  31           H        VAL  31 -22.765  24.691 -18.832
  233    HA   VAL  31           HA       VAL  31 -20.160  26.171 -19.152
  234    HB   VAL  31           HB       VAL  31 -22.224  26.671 -16.964
  235   1HG1  VAL  31          1HG1      VAL  31 -19.602  28.080 -17.601
  236   2HG1  VAL  31          2HG1      VAL  31 -20.789  28.583 -16.363
  237   3HG1  VAL  31          3HG1      VAL  31 -19.932  27.059 -16.160
  238   1HG2  VAL  31          1HG2      VAL  31 -21.446  28.457 -19.315
  239   2HG2  VAL  31          2HG2      VAL  31 -23.040  27.688 -19.036
  240   3HG2  VAL  31          3HG2      VAL  31 -22.458  28.934 -17.946
  241    H    THR  32           H        THR  32 -18.508  25.503 -17.923
  242    HA   THR  32           HA       THR  32 -18.918  23.161 -16.096
  243    HB   THR  32           HB       THR  32 -16.318  23.975 -17.396
  244    HG1  THR  32           HG1      THR  32 -17.774  23.339 -18.966
  245   1HG2  THR  32          1HG2      THR  32 -17.230  21.397 -16.000
  246   2HG2  THR  32          2HG2      THR  32 -15.735  21.585 -16.918
  247   3HG2  THR  32          3HG2      THR  32 -15.993  22.540 -15.437
  248    H    LEU  33           H        LEU  33 -18.247  23.244 -14.024
  249    HA   LEU  33           HA       LEU  33 -16.368  25.264 -13.039
  250   1HB   LEU  33          HB2       LEU  33 -17.862  26.050 -11.223
  251   2HB   LEU  33          HB3       LEU  33 -18.289  26.581 -12.855
  252    HG   LEU  33           HG       LEU  33 -20.154  24.918 -12.916
  253   1HD1  LEU  33          1HD1      LEU  33 -19.490  24.553  -9.979
  254   2HD1  LEU  33          2HD1      LEU  33 -21.019  24.042 -10.749
  255   3HD1  LEU  33          3HD1      LEU  33 -19.498  23.293 -11.230
  256   1HD2  LEU  33          1HD2      LEU  33 -20.490  27.320 -12.297
  257   2HD2  LEU  33          2HD2      LEU  33 -21.609  26.244 -11.460
  258   3HD2  LEU  33          3HD2      LEU  33 -20.204  26.885 -10.597
  259    H    ALA  34           H        ALA  34 -15.802  24.764 -10.627
  260    HA   ALA  34           HA       ALA  34 -16.176  21.912  -9.979
  261   1HB   ALA  34          HB1       ALA  34 -13.504  22.958 -10.995
  262   2HB   ALA  34          HB2       ALA  34 -13.904  21.263 -10.515
  263   3HB   ALA  34          HB3       ALA  34 -14.603  21.986 -11.984
  264    H    CYS  35           H        CYS  35 -15.491  21.177  -8.157
  265    HA   CYS  35           HA       CYS  35 -13.796  22.885  -6.337
  266   1HB   CYS  35          HB2       CYS  35 -15.983  20.891  -5.742
  267   2HB   CYS  35          HB3       CYS  35 -14.644  21.084  -4.624
  268    H    ASP  36           H        ASP  36 -11.686  22.287  -6.764
  269    HA   ASP  36           HA       ASP  36 -11.131  19.830  -8.156
  270   1HB   ASP  36          HB2       ASP  36  -8.921  20.583  -8.405
  271   2HB   ASP  36          HB3       ASP  36 -10.071  21.802  -8.879
  272    H    ALA  37           H        ALA  37 -11.856  18.289  -6.675
  273    HA   ALA  37           HA       ALA  37 -10.185  17.667  -4.337
  274   1HB   ALA  37          HB1       ALA  37 -12.656  17.292  -4.340
  275   2HB   ALA  37          HB2       ALA  37 -12.462  16.141  -5.684
  276   3HB   ALA  37          HB3       ALA  37 -11.778  15.781  -4.094
  277    H    ASP  38           H        ASP  38  -8.879  16.042  -4.075
  278    HA   ASP  38           HA       ASP  38  -8.469  13.888  -6.032
  279   1HB   ASP  38          HB2       ASP  38  -7.005  15.748  -6.928
  280   2HB   ASP  38          HB3       ASP  38  -6.245  15.886  -5.347
  281    H    GLY  39           H        GLY  39  -7.175  12.176  -5.047
  282   1HA   GLY  39          HA2       GLY  39  -5.868  12.128  -2.612
  283   2HA   GLY  39          HA3       GLY  39  -7.591  11.847  -2.224
  284    H    PHE  40           H        PHE  40  -6.142   9.812  -1.519
  285    HA   PHE  40           HA       PHE  40  -6.926   7.696  -3.374
  286   1HB   PHE  40          HB2       PHE  40  -4.663   8.365  -4.118
  287   2HB   PHE  40          HB3       PHE  40  -4.016   7.856  -2.567
  288    HD1  PHE  40           HD1      PHE  40  -4.263   5.381  -1.871
  289    HD2  PHE  40           HD2      PHE  40  -5.124   6.781  -5.870
  290    HE1  PHE  40           HE1      PHE  40  -4.179   3.043  -2.706
  291    HE2  PHE  40           HE2      PHE  40  -4.975   4.454  -6.702
  292    HZ   PHE  40           HZ       PHE  40  -4.508   2.590  -5.139
  293    HA   PRO  41           HA       PRO  41  -7.533   5.496  -3.273
  294   1HB   PRO  41          HB2       PRO  41  -9.654   4.597  -1.358
  295   2HB   PRO  41          HB3       PRO  41  -8.868   3.682  -2.692
  296   1HG   PRO  41          HG2       PRO  41  -8.159   3.203  -0.122
  297   2HG   PRO  41          HG3       PRO  41  -6.883   3.354  -1.373
  298   1HD   PRO  41          HD2       PRO  41  -7.856   5.472   0.568
  299   2HD   PRO  41          HD3       PRO  41  -6.180   4.982   0.167
  300    H    GLU  42           H        GLU  42  -9.431   5.906  -4.434
  301    HA   GLU  42           HA       GLU  42 -10.335   8.297  -5.002
  302   1HB   GLU  42          HB2       GLU  42 -12.320   7.331  -6.019
  303   2HB   GLU  42          HB3       GLU  42 -10.828   6.494  -6.358
  304   1HG   GLU  42          HG2       GLU  42 -11.472   4.742  -4.581
  305   2HG   GLU  42          HG3       GLU  42 -13.046   5.518  -4.503
  306    HA   PRO  43           HA       PRO  43 -12.304   9.693  -1.228
  307   1HB   PRO  43          HB2       PRO  43 -12.604  12.167  -2.946
  308   2HB   PRO  43          HB3       PRO  43 -12.182  12.060  -1.208
  309   1HG   PRO  43          HG2       PRO  43 -10.243  12.423  -3.045
  310   2HG   PRO  43          HG3       PRO  43 -10.005  11.177  -1.760
  311   1HD   PRO  43          HD2       PRO  43 -10.929  10.780  -4.620
  312   2HD   PRO  43          HD3       PRO  43  -9.672   9.884  -3.710
  313    H    THR  44           H        THR  44 -14.255  10.338  -0.411
  314    HA   THR  44           HA       THR  44 -16.700  10.118  -2.210
  315    HB   THR  44           HB       THR  44 -16.422   9.973   0.831
  316    HG1  THR  44           HG1      THR  44 -15.667   8.112  -0.298
  317   1HG2  THR  44          1HG2      THR  44 -18.661  10.850   0.128
  318   2HG2  THR  44          2HG2      THR  44 -18.863   9.466  -0.948
  319   3HG2  THR  44          3HG2      THR  44 -18.789   9.223   0.802
  320    H    MET  45           H        MET  45 -17.981  12.001  -2.477
  321    HA   MET  45           HA       MET  45 -17.550  14.290  -0.693
  322   1HB   MET  45          HB2       MET  45 -16.690  15.785  -2.490
  323   2HB   MET  45          HB3       MET  45 -15.579  14.501  -2.120
  324   1HG   MET  45          HG2       MET  45 -16.289  13.231  -4.073
  325   2HG   MET  45          HG3       MET  45 -17.419  14.509  -4.523
  326   1HE   MET  45          HE1       MET  45 -16.780  16.840  -5.309
  327   2HE   MET  45          HE2       MET  45 -15.702  17.231  -3.948
  328   3HE   MET  45          HE3       MET  45 -15.137  17.441  -5.608
  329    H    THR  46           H        THR  46 -18.936  16.080  -1.073
  330    HA   THR  46           HA       THR  46 -20.859  16.052  -3.276
  331    HB   THR  46           HB       THR  46 -22.885  16.295  -1.876
  332    HG1  THR  46           HG1      THR  46 -21.188  15.356   0.223
  333   1HG2  THR  46          1HG2      THR  46 -23.327  14.041  -1.353
  334   2HG2  THR  46          2HG2      THR  46 -22.351  14.071  -2.827
  335   3HG2  THR  46          3HG2      THR  46 -21.618  13.596  -1.274
  336    H    TRP  47           H        TRP  47 -22.487  17.986  -2.893
  337    HA   TRP  47           HA       TRP  47 -21.418  20.281  -1.554
  338   1HB   TRP  47          HB2       TRP  47 -21.004  21.646  -3.629
  339   2HB   TRP  47          HB3       TRP  47 -19.839  20.519  -3.083
  340    HD1  TRP  47           HD1      TRP  47 -20.860  17.923  -4.889
  341    HE1  TRP  47           HE1      TRP  47 -19.799  17.882  -7.223
  342    HE3  TRP  47           HE3      TRP  47 -19.909  22.897  -5.406
  343    HZ2  TRP  47           HZ2      TRP  47 -18.679  19.784  -9.066
  344    HZ3  TRP  47           HZ3      TRP  47 -19.026  23.801  -7.541
  345    HH2  TRP  47           HH2      TRP  47 -18.453  22.205  -9.399
  346    H    THR  48           H        THR  48 -22.643  22.408  -2.388
  347    HA   THR  48           HA       THR  48 -25.534  21.613  -2.406
  348    HB   THR  48           HB       THR  48 -25.899  23.518  -0.887
  349    HG1  THR  48           HG1      THR  48 -24.146  24.431   0.123
  350   1HG2  THR  48          1HG2      THR  48 -23.865  21.571   0.281
  351   2HG2  THR  48          2HG2      THR  48 -25.102  22.518   1.154
  352   3HG2  THR  48          3HG2      THR  48 -25.586  21.215   0.052
  353    H    LYS  49           H        LYS  49 -27.086  22.892  -3.213
  354    HA   LYS  49           HA       LYS  49 -26.300  25.002  -5.177
  355   1HB   LYS  49          HB2       LYS  49 -27.530  22.789  -5.856
  356   2HB   LYS  49          HB3       LYS  49 -28.908  23.430  -4.978
  357   1HG   LYS  49          HG2       LYS  49 -29.336  23.942  -7.194
  358   2HG   LYS  49          HG3       LYS  49 -28.719  25.488  -6.547
  359   1HD   LYS  49          HD2       LYS  49 -26.557  25.113  -7.657
  360   2HD   LYS  49          HD3       LYS  49 -27.026  23.455  -8.085
  361   1HE   LYS  49          HE2       LYS  49 -28.878  24.338  -9.485
  362   2HE   LYS  49          HE3       LYS  49 -28.426  25.986  -9.052
  363   1HZ   LYS  49          HZ1       LYS  49 -27.551  25.116 -11.235
  364   2HZ   LYS  49          HZ2       LYS  49 -26.383  25.721 -10.218
  365   3HZ   LYS  49          HZ3       LYS  49 -26.573  24.105 -10.405
  366    H    ASP  50           H        ASP  50 -26.140  26.090  -2.859
  367    HA   ASP  50           HA       ASP  50 -26.746  27.768  -1.474
  368   1HB   ASP  50          HB2       ASP  50 -27.710  28.794  -3.527
  369   2HB   ASP  50          HB3       ASP  50 -29.271  28.099  -3.116
  370    H    GLY  51           H        GLY  51 -28.945  25.094  -1.799
  371   1HA   GLY  51          HA2       GLY  51 -29.460  24.943   1.039
  372   2HA   GLY  51          HA3       GLY  51 -30.863  25.592   0.190
  373    H    GLU  52           H        GLU  52 -28.958  23.169  -1.503
  374    HA   GLU  52           HA       GLU  52 -30.373  20.881  -0.545
  375   1HB   GLU  52          HB2       GLU  52 -31.616  20.330  -2.574
  376   2HB   GLU  52          HB3       GLU  52 -32.194  21.843  -1.861
  377   1HG   GLU  52          HG2       GLU  52 -30.851  23.117  -3.585
  378   2HG   GLU  52          HG3       GLU  52 -30.385  21.586  -4.310
  379    HA   PRO  53           HA       PRO  53 -26.665  19.240  -2.025
  380   1HB   PRO  53          HB2       PRO  53 -27.046  16.556  -2.156
  381   2HB   PRO  53          HB3       PRO  53 -27.184  17.508  -0.649
  382   1HG   PRO  53          HG2       PRO  53 -29.459  16.619  -2.462
  383   2HG   PRO  53          HG3       PRO  53 -29.328  16.412  -0.704
  384   1HD   PRO  53          HD2       PRO  53 -30.685  18.490  -1.807
  385   2HD   PRO  53          HD3       PRO  53 -29.740  18.684  -0.305
  386    H    ILE  54           H        ILE  54 -25.496  19.247  -3.754
  387    HA   ILE  54           HA       ILE  54 -26.402  18.397  -6.433
  388    HB   ILE  54           HB       ILE  54 -23.811  19.699  -5.456
  389   1HG1  ILE  54          2HG1      ILE  54 -26.209  20.923  -6.909
  390   2HG1  ILE  54          3HG1      ILE  54 -25.921  21.116  -5.178
  391   1HG2  ILE  54          1HG2      ILE  54 -23.289  20.191  -7.777
  392   2HG2  ILE  54          2HG2      ILE  54 -23.530  18.452  -7.641
  393   3HG2  ILE  54          3HG2      ILE  54 -24.830  19.460  -8.314
  394   1HD1  ILE  54          1HD1      ILE  54 -24.194  22.189  -7.429
  395   2HD1  ILE  54          2HD1      ILE  54 -25.142  23.087  -6.259
  396   3HD1  ILE  54          3HD1      ILE  54 -23.736  22.169  -5.693
  397    H    GLU  55           H        GLU  55 -26.706  16.288  -5.245
  398    HA   GLU  55           HA       GLU  55 -24.504  14.479  -4.915
  399   1HB   GLU  55          HB2       GLU  55 -26.329  12.760  -4.915
  400   2HB   GLU  55          HB3       GLU  55 -26.461  14.057  -3.710
  401   1HG   GLU  55          HG2       GLU  55 -28.174  15.149  -5.239
  402   2HG   GLU  55          HG3       GLU  55 -28.128  13.690  -6.207
  403    H    GLN  56           H        GLN  56 -23.612  15.408  -7.034
  404    HA   GLN  56           HA       GLN  56 -24.300  14.986  -9.609
  405   1HB   GLN  56          HB2       GLN  56 -21.943  14.945 -10.129
  406   2HB   GLN  56          HB3       GLN  56 -22.298  16.079  -8.833
  407   1HG   GLN  56          HG2       GLN  56 -21.511  14.270  -7.182
  408   2HG   GLN  56          HG3       GLN  56 -20.977  13.362  -8.632
  409   1HE2  GLN  56          1HE2      GLN  56 -17.883  15.032  -7.910
  410   2HE2  GLN  56          2HE2      GLN  56 -18.735  13.485  -7.817
  411    H    GLU  57           H        GLU  57 -23.494  12.357  -7.534
  412    HA   GLU  57           HA       GLU  57 -22.963  10.368  -9.650
  413   1HB   GLU  57          HB2       GLU  57 -23.373  10.039  -6.656
  414   2HB   GLU  57          HB3       GLU  57 -22.760   8.797  -7.777
  415   1HG   GLU  57          HG2       GLU  57 -20.862  10.370  -8.348
  416   2HG   GLU  57          HG3       GLU  57 -21.387  11.421  -7.040
  417    H    ASP  58           H        ASP  58 -25.774  11.587  -8.091
  418    HA   ASP  58           HA       ASP  58 -27.467   9.296  -9.034
  419   1HB   ASP  58          HB2       ASP  58 -27.060   9.312  -6.527
  420   2HB   ASP  58          HB3       ASP  58 -27.851  10.907  -6.482
  421    H    ASN  59           H        ASN  59 -27.184  12.804  -8.638
  422    HA   ASN  59           HA       ASN  59 -29.802  13.161  -9.977
  423   1HB   ASN  59          HB2       ASN  59 -29.562  15.499  -9.604
  424   2HB   ASN  59          HB3       ASN  59 -29.047  14.691  -8.145
  425   1HD2  ASN  59          1HD2      ASN  59 -26.500  17.195  -8.403
  426   2HD2  ASN  59          2HD2      ASN  59 -28.069  16.859  -7.682
  427    H    GLU  60           H        GLU  60 -30.060  14.342 -11.991
  428    HA   GLU  60           HA       GLU  60 -27.847  14.409 -13.940
  429   1HB   GLU  60          HB2       GLU  60 -29.190  12.002 -13.430
  430   2HB   GLU  60          HB3       GLU  60 -30.130  12.655 -14.763
  431   1HG   GLU  60          HG2       GLU  60 -28.004  12.954 -16.052
  432   2HG   GLU  60          HG3       GLU  60 -27.129  12.305 -14.656
  433    H    GLU  61           H        GLU  61 -30.586  15.925 -12.918
  434    HA   GLU  61           HA       GLU  61 -32.272  16.078 -15.143
  435   1HB   GLU  61          HB2       GLU  61 -31.877  18.005 -12.825
  436   2HB   GLU  61          HB3       GLU  61 -33.197  18.153 -14.005
  437   1HG   GLU  61          HG2       GLU  61 -33.967  15.838 -13.383
  438   2HG   GLU  61          HG3       GLU  61 -32.661  15.735 -12.216
  439    H    LYS  62           H        LYS  62 -29.411  18.035 -14.657
  440    HA   LYS  62           HA       LYS  62 -29.344  18.712 -17.469
  441   1HB   LYS  62          HB2       LYS  62 -29.386  21.177 -17.274
  442   2HB   LYS  62          HB3       LYS  62 -30.929  20.457 -16.884
  443   1HG   LYS  62          HG2       LYS  62 -30.299  20.676 -14.405
  444   2HG   LYS  62          HG3       LYS  62 -28.885  21.593 -14.912
  445   1HD   LYS  62          HD2       LYS  62 -31.781  22.326 -15.466
  446   2HD   LYS  62          HD3       LYS  62 -30.754  23.020 -14.207
  447   1HE   LYS  62          HE2       LYS  62 -29.162  23.796 -16.025
  448   2HE   LYS  62          HE3       LYS  62 -30.327  23.213 -17.211
  449   1HZ   LYS  62          HZ1       LYS  62 -31.949  24.774 -15.966
  450   2HZ   LYS  62          HZ2       LYS  62 -30.585  25.445 -15.336
  451   3HZ   LYS  62          HZ3       LYS  62 -30.812  25.449 -16.951
  452    H    TYR  63           H        TYR  63 -27.625  17.226 -16.018
  453    HA   TYR  63           HA       TYR  63 -25.120  18.642 -16.310
  454   1HB   TYR  63          HB2       TYR  63 -24.710  18.175 -13.666
  455   2HB   TYR  63          HB3       TYR  63 -25.153  19.720 -14.348
  456    HD1  TYR  63           HD1      TYR  63 -26.793  16.579 -13.001
  457    HD2  TYR  63           HD2      TYR  63 -26.895  20.901 -13.359
  458    HE1  TYR  63           HE1      TYR  63 -28.787  16.673 -11.549
  459    HE2  TYR  63           HE2      TYR  63 -28.894  20.968 -11.874
  460    HH   TYR  63           HH       TYR  63 -30.394  19.711 -10.574
  461    H    SER  64           H        SER  64 -23.254  17.555 -15.618
  462    HA   SER  64           HA       SER  64 -23.077  14.743 -14.926
  463   1HB   SER  64          HB2       SER  64 -22.739  15.628 -17.804
  464   2HB   SER  64          HB3       SER  64 -21.855  14.237 -17.172
  465    HG   SER  64           HG       SER  64 -24.655  14.442 -16.805
  466    H    PHE  65           H        PHE  65 -20.743  14.120 -14.694
  467    HA   PHE  65           HA       PHE  65 -18.865  16.401 -14.652
  468   1HB   PHE  65          HB2       PHE  65 -18.544  15.949 -12.349
  469   2HB   PHE  65          HB3       PHE  65 -20.272  16.008 -12.651
  470    HD1  PHE  65           HD1      PHE  65 -21.603  13.802 -12.711
  471    HD2  PHE  65           HD2      PHE  65 -17.503  14.061 -11.377
  472    HE1  PHE  65           HE1      PHE  65 -21.764  11.527 -11.715
  473    HE2  PHE  65           HE2      PHE  65 -17.695  11.815 -10.318
  474    HZ   PHE  65           HZ       PHE  65 -19.828  10.539 -10.520
  475    H    ASN  66           H        ASN  66 -16.678  15.641 -13.690
  476    HA   ASN  66           HA       ASN  66 -15.590  13.790 -15.665
  477   1HB   ASN  66          HB2       ASN  66 -13.532  14.937 -15.238
  478   2HB   ASN  66          HB3       ASN  66 -14.763  16.162 -15.165
  479   1HD2  ASN  66          1HD2      ASN  66 -12.500  16.774 -12.287
  480   2HD2  ASN  66          2HD2      ASN  66 -12.482  16.971 -14.051
  481    H    TYR  67           H        TYR  67 -13.370  12.688 -14.849
  482    HA   TYR  67           HA       TYR  67 -14.268  10.484 -13.175
  483   1HB   TYR  67          HB2       TYR  67 -11.584  10.934 -14.542
  484   2HB   TYR  67          HB3       TYR  67 -12.208   9.400 -13.920
  485    HD1  TYR  67           HD1      TYR  67 -14.444   8.528 -14.880
  486    HD2  TYR  67           HD2      TYR  67 -12.001  11.489 -16.818
  487    HE1  TYR  67           HE1      TYR  67 -15.486   7.947 -17.073
  488    HE2  TYR  67           HE2      TYR  67 -13.071  10.939 -19.006
  489    HH   TYR  67           HH       TYR  67 -15.539   8.380 -19.318
  490    H    ASP  68           H        ASP  68 -12.551  13.317 -12.467
  491    HA   ASP  68           HA       ASP  68 -11.146  12.274 -10.044
  492   1HB   ASP  68          HB2       ASP  68 -11.474  15.074 -11.180
  493   2HB   ASP  68          HB3       ASP  68 -10.511  14.676  -9.765
  494    H    GLY  69           H        GLY  69 -14.262  13.485 -10.892
  495   1HA   GLY  69          HA2       GLY  69 -16.193  13.554  -9.561
  496   2HA   GLY  69          HA3       GLY  69 -15.203  13.400  -8.107
  497    H    SER  70           H        SER  70 -14.040  15.804 -10.271
  498    HA   SER  70           HA       SER  70 -14.860  17.903  -8.289
  499   1HB   SER  70          HB2       SER  70 -12.876  19.073  -9.140
  500   2HB   SER  70          HB3       SER  70 -12.523  17.480  -8.432
  501    HG   SER  70           HG       SER  70 -11.368  17.448 -10.264
  502    H    GLU  71           H        GLU  71 -14.460  17.560 -11.844
  503    HA   GLU  71           HA       GLU  71 -15.632  20.239 -12.264
  504   1HB   GLU  71          HB2       GLU  71 -14.615  18.228 -14.282
  505   2HB   GLU  71          HB3       GLU  71 -15.185  19.851 -14.633
  506   1HG   GLU  71          HG2       GLU  71 -13.333  20.862 -13.491
  507   2HG   GLU  71          HG3       GLU  71 -12.817  19.350 -12.790
  508    H    LEU  72           H        LEU  72 -17.677  20.514 -12.094
  509    HA   LEU  72           HA       LEU  72 -19.618  18.516 -13.138
  510   1HB   LEU  72          HB2       LEU  72 -19.929  19.225 -10.823
  511   2HB   LEU  72          HB3       LEU  72 -19.928  20.923 -11.318
  512    HG   LEU  72           HG       LEU  72 -22.036  20.443 -12.659
  513   1HD1  LEU  72          1HD1      LEU  72 -21.796  17.753 -11.215
  514   2HD1  LEU  72          2HD1      LEU  72 -23.296  18.353 -11.924
  515   3HD1  LEU  72          3HD1      LEU  72 -21.885  18.016 -12.958
  516   1HD2  LEU  72          1HD2      LEU  72 -22.122  21.469 -10.430
  517   2HD2  LEU  72          2HD2      LEU  72 -23.468  20.356 -10.666
  518   3HD2  LEU  72          3HD2      LEU  72 -22.082  19.851  -9.689
  519    H    ILE  73           H        ILE  73 -20.601  18.878 -14.990
  520    HA   ILE  73           HA       ILE  73 -20.373  21.513 -16.335
  521    HB   ILE  73           HB       ILE  73 -21.058  18.841 -17.585
  522   1HG1  ILE  73          2HG1      ILE  73 -18.298  20.045 -17.902
  523   2HG1  ILE  73          3HG1      ILE  73 -18.615  19.003 -16.510
  524   1HG2  ILE  73          1HG2      ILE  73 -20.118  21.514 -18.715
  525   2HG2  ILE  73          2HG2      ILE  73 -20.482  20.052 -19.685
  526   3HG2  ILE  73          3HG2      ILE  73 -21.751  20.900 -18.788
  527   1HD1  ILE  73          1HD1      ILE  73 -17.675  17.717 -18.256
  528   2HD1  ILE  73          2HD1      ILE  73 -19.308  17.161 -17.872
  529   3HD1  ILE  73          3HD1      ILE  73 -19.019  18.098 -19.367
  530    H    ILE  74           H        ILE  74 -22.211  22.673 -16.481
  531    HA   ILE  74           HA       ILE  74 -24.864  21.383 -15.991
  532    HB   ILE  74           HB       ILE  74 -23.979  24.253 -15.550
  533   1HG1  ILE  74          2HG1      ILE  74 -24.766  22.169 -13.462
  534   2HG1  ILE  74          3HG1      ILE  74 -23.098  22.547 -13.859
  535   1HG2  ILE  74          1HG2      ILE  74 -26.253  24.503 -14.504
  536   2HG2  ILE  74          2HG2      ILE  74 -26.326  24.154 -16.211
  537   3HG2  ILE  74          3HG2      ILE  74 -26.667  22.861 -15.026
  538   1HD1  ILE  74          1HD1      ILE  74 -23.538  24.971 -13.184
  539   2HD1  ILE  74          2HD1      ILE  74 -25.129  24.400 -12.587
  540   3HD1  ILE  74          3HD1      ILE  74 -23.662  23.739 -11.875
  541    H    LYS  75           H        LYS  75 -26.151  21.286 -17.735
  542    HA   LYS  75           HA       LYS  75 -25.573  22.985 -20.104
  543   1HB   LYS  75          HB2       LYS  75 -26.984  21.472 -21.370
  544   2HB   LYS  75          HB3       LYS  75 -25.629  20.652 -20.611
  545   1HG   LYS  75          HG2       LYS  75 -27.107  19.811 -18.812
  546   2HG   LYS  75          HG3       LYS  75 -28.499  20.627 -19.550
  547   1HD   LYS  75          HD2       LYS  75 -26.816  18.454 -20.831
  548   2HD   LYS  75          HD3       LYS  75 -28.346  18.188 -19.997
  549   1HE   LYS  75          HE2       LYS  75 -29.498  19.656 -21.670
  550   2HE   LYS  75          HE3       LYS  75 -27.972  19.881 -22.513
  551   1HZ   LYS  75          HZ1       LYS  75 -29.275  18.126 -23.532
  552   2HZ   LYS  75          HZ2       LYS  75 -27.918  17.490 -22.937
  553   3HZ   LYS  75          HZ3       LYS  75 -29.325  17.254 -22.149
  554    H    LYS  76           H        LYS  76 -27.260  23.972 -21.179
  555    HA   LYS  76           HA       LYS  76 -28.827  25.582 -21.300
  556   1HB   LYS  76          HB2       LYS  76 -31.097  24.855 -21.223
  557   2HB   LYS  76          HB3       LYS  76 -30.079  23.599 -21.907
  558   1HG   LYS  76          HG2       LYS  76 -30.131  22.340 -19.788
  559   2HG   LYS  76          HG3       LYS  76 -31.200  23.555 -19.060
  560   1HD   LYS  76          HD2       LYS  76 -31.836  21.930 -21.558
  561   2HD   LYS  76          HD3       LYS  76 -32.382  21.521 -19.918
  562   1HE   LYS  76          HE2       LYS  76 -33.588  23.694 -19.759
  563   2HE   LYS  76          HE3       LYS  76 -33.055  24.101 -21.393
  564   1HZ   LYS  76          HZ1       LYS  76 -34.770  21.762 -20.720
  565   2HZ   LYS  76          HZ2       LYS  76 -35.292  23.173 -21.391
  566   3HZ   LYS  76          HZ3       LYS  76 -34.316  22.187 -22.225
  567    H    VAL  77           H        VAL  77 -27.351  26.336 -19.381
  568    HA   VAL  77           HA       VAL  77 -28.434  26.860 -16.827
  569    HB   VAL  77           HB       VAL  77 -26.443  28.405 -18.515
  570   1HG1  VAL  77          1HG1      VAL  77 -27.282  30.054 -16.935
  571   2HG1  VAL  77          2HG1      VAL  77 -27.181  28.865 -15.609
  572   3HG1  VAL  77          3HG1      VAL  77 -25.699  29.459 -16.356
  573   1HG2  VAL  77          1HG2      VAL  77 -24.792  27.386 -16.982
  574   2HG2  VAL  77          2HG2      VAL  77 -26.117  26.572 -16.102
  575   3HG2  VAL  77          3HG2      VAL  77 -25.741  26.136 -17.779
  576    H    ASP  78           H        ASP  78 -29.670  28.340 -15.908
  577    HA   ASP  78           HA       ASP  78 -30.363  30.823 -17.233
  578   1HB   ASP  78          HB2       ASP  78 -32.160  28.895 -17.797
  579   2HB   ASP  78          HB3       ASP  78 -32.718  29.283 -16.164
  580    H    LYS  79           H        LYS  79 -32.138  31.925 -15.426
  581    HA   LYS  79           HA       LYS  79 -30.331  32.362 -13.194
  582   1HB   LYS  79          HB2       LYS  79 -33.102  33.421 -13.874
  583   2HB   LYS  79          HB3       LYS  79 -32.361  33.725 -12.316
  584   1HG   LYS  79          HG2       LYS  79 -30.275  34.578 -13.667
  585   2HG   LYS  79          HG3       LYS  79 -31.381  34.615 -15.038
  586   1HD   LYS  79          HD2       LYS  79 -31.321  36.832 -14.058
  587   2HD   LYS  79          HD3       LYS  79 -32.899  36.101 -13.688
  588   1HE   LYS  79          HE2       LYS  79 -32.257  37.132 -11.670
  589   2HE   LYS  79          HE3       LYS  79 -31.924  35.434 -11.421
  590   1HZ   LYS  79          HZ1       LYS  79 -29.536  36.073 -12.210
  591   2HZ   LYS  79          HZ2       LYS  79 -29.983  37.589 -11.820
  592   3HZ   LYS  79          HZ3       LYS  79 -29.982  36.384 -10.682
  593    H    SER  80           H        SER  80 -32.603  29.866 -13.540
  594    HA   SER  80           HA       SER  80 -33.095  29.359 -10.709
  595   1HB   SER  80          HB2       SER  80 -33.766  27.132 -11.590
  596   2HB   SER  80          HB3       SER  80 -34.596  28.491 -12.338
  597    HG   SER  80           HG       SER  80 -33.848  26.952 -13.899
  598    H    ASP  81           H        ASP  81 -30.250  29.101 -12.664
  599    HA   ASP  81           HA       ASP  81 -29.023  27.043 -10.953
  600   1HB   ASP  81          HB2       ASP  81 -28.132  28.359 -13.530
  601   2HB   ASP  81          HB3       ASP  81 -27.076  27.332 -12.593
  602    H    GLU  82           H        GLU  82 -29.355  30.402 -10.795
  603    HA   GLU  82           HA       GLU  82 -26.840  31.298  -9.812
  604   1HB   GLU  82          HB2       GLU  82 -28.885  32.676 -10.329
  605   2HB   GLU  82          HB3       GLU  82 -29.595  32.077  -8.820
  606   1HG   GLU  82          HG2       GLU  82 -27.585  33.088  -7.617
  607   2HG   GLU  82          HG3       GLU  82 -27.068  33.727  -9.151
  608    H    ALA  83           H        ALA  83 -25.659  30.654  -7.984
  609    HA   ALA  83           HA       ALA  83 -27.034  29.414  -5.691
  610   1HB   ALA  83          HB1       ALA  83 -26.913  27.577  -7.359
  611   2HB   ALA  83          HB2       ALA  83 -25.194  27.883  -7.594
  612   3HB   ALA  83          HB3       ALA  83 -25.765  27.239  -6.054
  613    H    GLU  84           H        GLU  84 -25.724  28.861  -3.947
  614    HA   GLU  84           HA       GLU  84 -22.888  29.808  -3.950
  615   1HB   GLU  84          HB2       GLU  84 -24.404  31.348  -2.658
  616   2HB   GLU  84          HB3       GLU  84 -24.808  29.987  -1.585
  617   1HG   GLU  84          HG2       GLU  84 -22.362  29.783  -0.999
  618   2HG   GLU  84          HG3       GLU  84 -22.020  31.156  -2.072
  619    H    TYR  85           H        TYR  85 -21.526  28.171  -3.576
  620    HA   TYR  85           HA       TYR  85 -22.693  25.529  -2.810
  621   1HB   TYR  85          HB2       TYR  85 -20.156  26.178  -4.330
  622   2HB   TYR  85          HB3       TYR  85 -20.871  24.617  -4.079
  623    HD1  TYR  85           HD1      TYR  85 -22.070  23.682  -5.894
  624    HD2  TYR  85           HD2      TYR  85 -21.556  27.966  -5.710
  625    HE1  TYR  85           HE1      TYR  85 -22.964  23.874  -8.185
  626    HE2  TYR  85           HE2      TYR  85 -22.505  28.153  -7.984
  627    HH   TYR  85           HH       TYR  85 -23.588  25.307  -9.856
  628    H    ILE  86           H        ILE  86 -21.918  24.453  -1.079
  629    HA   ILE  86           HA       ILE  86 -19.150  25.079  -0.122
  630    HB   ILE  86           HB       ILE  86 -21.462  24.154   1.664
  631   1HG1  ILE  86          2HG1      ILE  86 -20.831  26.402   2.849
  632   2HG1  ILE  86          3HG1      ILE  86 -20.189  26.899   1.308
  633   1HG2  ILE  86          1HG2      ILE  86 -19.752  24.450   3.452
  634   2HG2  ILE  86          2HG2      ILE  86 -19.224  23.248   2.278
  635   3HG2  ILE  86          3HG2      ILE  86 -18.543  24.879   2.222
  636   1HD1  ILE  86          1HD1      ILE  86 -23.053  25.970   1.745
  637   2HD1  ILE  86          2HD1      ILE  86 -22.507  27.685   1.821
  638   3HD1  ILE  86          3HD1      ILE  86 -22.437  26.788   0.314
  639    H    CYS  87           H        CYS  87 -17.860  23.432  -0.551
  640    HA   CYS  87           HA       CYS  87 -19.035  20.774  -1.189
  641   1HB   CYS  87          HB2       CYS  87 -17.302  20.547  -2.896
  642   2HB   CYS  87          HB3       CYS  87 -18.246  22.005  -3.162
  643    H    ILE  88           H        ILE  88 -18.252  18.989  -0.362
  644    HA   ILE  88           HA       ILE  88 -16.030  19.173   1.649
  645    HB   ILE  88           HB       ILE  88 -18.678  17.722   2.036
  646   1HG1  ILE  88          2HG1      ILE  88 -18.706  19.553   4.053
  647   2HG1  ILE  88          3HG1      ILE  88 -17.847  20.515   2.842
  648   1HG2  ILE  88          1HG2      ILE  88 -16.361  18.258   3.937
  649   2HG2  ILE  88          2HG2      ILE  88 -17.891  17.459   4.370
  650   3HG2  ILE  88          3HG2      ILE  88 -16.793  16.677   3.255
  651   1HD1  ILE  88          1HD1      ILE  88 -20.271  20.924   2.809
  652   2HD1  ILE  88          2HD1      ILE  88 -19.814  20.155   1.281
  653   3HD1  ILE  88          3HD1      ILE  88 -20.584  19.181   2.533
  654    H    ALA  89           H        ALA  89 -14.647  17.424   1.654
  655    HA   ALA  89           HA       ALA  89 -15.441  14.975   0.207
  656   1HB   ALA  89          HB1       ALA  89 -13.273  14.855  -0.906
  657   2HB   ALA  89          HB2       ALA  89 -14.061  16.399  -1.314
  658   3HB   ALA  89          HB3       ALA  89 -12.776  16.372  -0.098
  659    H    GLU  90           H        GLU  90 -14.607  13.083   0.979
  660    HA   GLU  90           HA       GLU  90 -12.965  13.087   3.477
  661   1HB   GLU  90          HB2       GLU  90 -15.449  13.369   3.915
  662   2HB   GLU  90          HB3       GLU  90 -15.663  11.774   3.187
  663   1HG   GLU  90          HG2       GLU  90 -14.127  10.836   4.932
  664   2HG   GLU  90          HG3       GLU  90 -14.022  12.435   5.660
  665    H    ASN  91           H        ASN  91 -11.830  11.124   3.795
  666    HA   ASN  91           HA       ASN  91 -12.739   8.705   2.514
  667   1HB   ASN  91          HB2       ASN  91 -10.931   8.129   1.123
  668   2HB   ASN  91          HB3       ASN  91 -11.405   9.734   0.647
  669   1HD2  ASN  91          1HD2      ASN  91  -7.765   9.719   0.596
  670   2HD2  ASN  91          2HD2      ASN  91  -9.088   8.969  -0.290
  671    H    LYS  92           H        LYS  92 -10.546   7.019   2.919
  672    HA   LYS  92           HA       LYS  92 -10.432   6.771   5.823
  673   1HB   LYS  92          HB2       LYS  92  -8.719   4.942   5.173
  674   2HB   LYS  92          HB3       LYS  92 -10.432   4.726   4.844
  675   1HG   LYS  92          HG2       LYS  92  -8.618   5.826   2.684
  676   2HG   LYS  92          HG3       LYS  92  -8.513   4.115   3.078
  677   1HD   LYS  92          HD2       LYS  92 -11.126   5.469   2.248
  678   2HD   LYS  92          HD3       LYS  92 -10.032   4.645   1.134
  679   1HE   LYS  92          HE2       LYS  92 -10.255   2.550   2.432
  680   2HE   LYS  92          HE3       LYS  92 -11.365   3.345   3.541
  681   1HZ   LYS  92          HZ1       LYS  92 -11.862   2.932   0.624
  682   2HZ   LYS  92          HZ2       LYS  92 -12.603   2.136   1.851
  683   3HZ   LYS  92          HZ3       LYS  92 -12.880   3.722   1.648
  684    H    ALA  93           H        ALA  93  -8.349   8.422   3.649
  685    HA   ALA  93           HA       ALA  93  -6.114   8.529   5.555
  686   1HB   ALA  93          HB1       ALA  93  -4.986   9.769   3.731
  687   2HB   ALA  93          HB2       ALA  93  -5.721   8.244   3.159
  688   3HB   ALA  93          HB3       ALA  93  -6.504   9.791   2.810
  689    H    GLY  94           H        GLY  94  -8.828  10.673   4.637
  690   1HA   GLY  94          HA2       GLY  94  -8.366  12.420   6.869
  691   2HA   GLY  94          HA3       GLY  94  -7.709  13.123   5.430
  692    H    GLU  95           H        GLU  95  -9.151  14.846   5.751
  693    HA   GLU  95           HA       GLU  95 -11.743  14.631   4.440
  694   1HB   GLU  95          HB2       GLU  95 -12.182  14.055   6.844
  695   2HB   GLU  95          HB3       GLU  95 -11.535  15.636   7.297
  696   1HG   GLU  95          HG2       GLU  95 -13.343  16.721   5.932
  697   2HG   GLU  95          HG3       GLU  95 -14.003  15.091   5.634
  698    H    GLN  96           H        GLN  96 -12.390  16.725   3.557
  699    HA   GLN  96           HA       GLN  96 -11.149  19.163   4.497
  700   1HB   GLN  96          HB2       GLN  96  -9.617  17.802   2.703
  701   2HB   GLN  96          HB3       GLN  96 -10.617  18.709   1.599
  702   1HG   GLN  96          HG2       GLN  96  -9.345  20.527   1.874
  703   2HG   GLN  96          HG3       GLN  96  -9.765  20.584   3.576
  704   1HE2  GLN  96          1HE2      GLN  96  -6.675  18.614   4.376
  705   2HE2  GLN  96          2HE2      GLN  96  -8.393  18.332   4.643
  706    H    ASP  97           H        ASP  97 -11.776  21.063   2.894
  707    HA   ASP  97           HA       ASP  97 -14.287  20.815   1.466
  708   1HB   ASP  97          HB2       ASP  97 -15.621  22.151   2.920
  709   2HB   ASP  97          HB3       ASP  97 -15.109  20.725   3.772
  710    H    ALA  98           H        ALA  98 -14.972  22.671   0.363
  711    HA   ALA  98           HA       ALA  98 -13.594  25.253   0.718
  712   1HB   ALA  98          HB1       ALA  98 -12.165  24.025  -0.867
  713   2HB   ALA  98          HB2       ALA  98 -13.541  23.714  -1.928
  714   3HB   ALA  98          HB3       ALA  98 -12.928  25.378  -1.686
  715    H    THR  99           H        THR  99 -14.507  26.839  -1.183
  716    HA   THR  99           HA       THR  99 -17.499  26.651  -1.223
  717    HB   THR  99           HB       THR  99 -15.858  29.022  -0.272
  718    HG1  THR  99           HG1      THR  99 -16.786  28.517   1.759
  719   1HG2  THR  99          1HG2      THR  99 -18.874  28.527  -0.261
  720   2HG2  THR  99          2HG2      THR  99 -18.055  29.872   0.569
  721   3HG2  THR  99          3HG2      THR  99 -18.023  29.781  -1.206
  722    H    ILE 100           H        ILE 100 -18.539  27.722  -2.927
  723    HA   ILE 100           HA       ILE 100 -17.025  29.377  -4.872
  724    HB   ILE 100           HB       ILE 100 -18.587  26.884  -5.669
  725   1HG1  ILE 100          2HG1      ILE 100 -15.599  27.470  -5.753
  726   2HG1  ILE 100          3HG1      ILE 100 -16.428  26.264  -4.778
  727   1HG2  ILE 100          1HG2      ILE 100 -17.823  27.396  -8.014
  728   2HG2  ILE 100          2HG2      ILE 100 -18.981  28.497  -7.408
  729   3HG2  ILE 100          3HG2      ILE 100 -17.272  28.970  -7.426
  730   1HD1  ILE 100          1HD1      ILE 100 -15.426  25.098  -6.533
  731   2HD1  ILE 100          2HD1      ILE 100 -17.155  25.088  -6.868
  732   3HD1  ILE 100          3HD1      ILE 100 -16.067  26.160  -7.786
  733    H    HIS 101           H        HIS 101 -18.486  30.585  -6.285
  734    HA   HIS 101           HA       HIS 101 -21.395  30.526  -5.627
  735   1HB   HIS 101          HB2       HIS 101 -20.433  32.425  -4.446
  736   2HB   HIS 101          HB3       HIS 101 -19.581  32.952  -5.897
  737    HD1  HIS 101           HD1      HIS 101 -23.429  32.131  -5.639
  738    HD2  HIS 101           HD2      HIS 101 -20.694  35.219  -6.434
  739    HE1  HIS 101           HE1      HIS 101 -24.786  34.145  -6.298
  740    H    LEU 102           H        LEU 102 -22.761  30.999  -7.402
  741    HA   LEU 102           HA       LEU 102 -21.538  31.558 -10.040
  742   1HB   LEU 102          HB2       LEU 102 -22.050  29.212 -10.095
  743   2HB   LEU 102          HB3       LEU 102 -23.649  29.475  -9.354
  744    HG   LEU 102           HG       LEU 102 -24.469  30.575 -11.364
  745   1HD1  LEU 102          1HD1      LEU 102 -23.109  30.620 -13.463
  746   2HD1  LEU 102          2HD1      LEU 102 -22.454  31.675 -12.215
  747   3HD1  LEU 102          3HD1      LEU 102 -21.706  30.093 -12.531
  748   1HD2  LEU 102          1HD2      LEU 102 -24.509  28.719 -12.855
  749   2HD2  LEU 102          2HD2      LEU 102 -23.044  28.018 -12.126
  750   3HD2  LEU 102          3HD2      LEU 102 -24.550  28.096 -11.187
  751    H    LYS 103           H        LYS 103 -22.146  33.547 -10.460
  752    HA   LYS 103           HA       LYS 103 -24.954  34.446  -9.929
  753   1HB   LYS 103          HB2       LYS 103 -24.094  36.715 -10.504
  754   2HB   LYS 103          HB3       LYS 103 -23.464  36.023  -9.014
  755   1HG   LYS 103          HG2       LYS 103 -21.334  35.451 -10.210
  756   2HG   LYS 103          HG3       LYS 103 -21.953  36.230 -11.664
  757   1HD   LYS 103          HD2       LYS 103 -21.456  37.579  -8.973
  758   2HD   LYS 103          HD3       LYS 103 -20.423  37.676 -10.419
  759   1HE   LYS 103          HE2       LYS 103 -22.308  38.752 -11.664
  760   2HE   LYS 103          HE3       LYS 103 -23.302  38.664 -10.219
  761   1HZ   LYS 103          HZ1       LYS 103 -22.294  40.848 -10.462
  762   2HZ   LYS 103          HZ2       LYS 103 -21.689  40.124  -9.122
  763   3HZ   LYS 103          HZ3       LYS 103 -20.776  40.218 -10.460
  764    H    VAL 104           H        VAL 104 -26.334  33.945 -11.465
  765    HA   VAL 104           HA       VAL 104 -25.465  33.943 -14.315
  766    HB   VAL 104           HB       VAL 104 -28.100  32.955 -13.214
  767   1HG1  VAL 104          1HG1      VAL 104 -28.031  33.481 -15.642
  768   2HG1  VAL 104          2HG1      VAL 104 -26.652  32.341 -15.821
  769   3HG1  VAL 104          3HG1      VAL 104 -28.239  31.741 -15.327
  770   1HG2  VAL 104          1HG2      VAL 104 -27.160  30.667 -13.489
  771   2HG2  VAL 104          2HG2      VAL 104 -25.551  31.377 -13.745
  772   3HG2  VAL 104          3HG2      VAL 104 -26.393  31.580 -12.186
  773    H    PHE 105           H        PHE 105 -26.034  35.665 -15.648
  774    HA   PHE 105           HA       PHE 105 -28.005  37.635 -14.643
  775   1HB   PHE 105          HB2       PHE 105 -26.781  39.153 -16.119
  776   2HB   PHE 105          HB3       PHE 105 -25.849  38.596 -14.733
  777    HD1  PHE 105           HD1      PHE 105 -26.144  38.615 -18.382
  778    HD2  PHE 105           HD2      PHE 105 -23.887  37.100 -15.063
  779    HE1  PHE 105           HE1      PHE 105 -24.293  38.059 -19.933
  780    HE2  PHE 105           HE2      PHE 105 -22.038  36.496 -16.618
  781    HZ   PHE 105           HZ       PHE 105 -22.223  36.997 -19.038
  782    H    ALA 106           H        ALA 106 -29.496  38.533 -15.963
  783    HA   ALA 106           HA       ALA 106 -30.458  36.861 -18.191
  784   1HB   ALA 106          HB1       ALA 106 -31.901  37.512 -16.303
  785   2HB   ALA 106          HB2       ALA 106 -31.692  39.222 -16.708
  786   3HB   ALA 106          HB3       ALA 106 -32.524  38.142 -17.846
  787    H    LYS 107           H        LYS 107 -28.227  37.904 -19.103
  788    HA   LYS 107           HA       LYS 107 -27.213  38.890 -20.862
  789   1HB   LYS 107          HB2       LYS 107 -29.949  39.850 -21.783
  790   2HB   LYS 107          HB3       LYS 107 -28.466  39.693 -22.743
  791   1HG   LYS 107          HG2       LYS 107 -28.456  37.258 -22.403
  792   2HG   LYS 107          HG3       LYS 107 -29.955  37.342 -21.500
  793   1HD   LYS 107          HD2       LYS 107 -29.596  38.131 -24.405
  794   2HD   LYS 107          HD3       LYS 107 -30.338  36.647 -23.830
  795   1HE   LYS 107          HE2       LYS 107 -32.081  38.020 -22.615
  796   2HE   LYS 107          HE3       LYS 107 -31.381  39.466 -23.323
  797   1HZ   LYS 107          HZ1       LYS 107 -32.571  37.248 -24.898
  798   2HZ   LYS 107          HZ2       LYS 107 -33.252  38.713 -24.627
  799   3HZ   LYS 107          HZ3       LYS 107 -31.899  38.586 -25.523