*HEADER    TRANSCRIPTION/TRANSFERASE               30-MAY-12   2LTO              
*TITLE     TDRD3 COMPLEX                                                         
*COMPND    MOL_ID: 1;                                                            
*COMPND   2 MOLECULE: TUDOR DOMAIN-CONTAINING PROTEIN 3;                         
*COMPND   3 CHAIN: A;                                                            
*COMPND   4 FRAGMENT: TUDOR DOMAIN RESIDUES 554-608;                             
*COMPND   5 ENGINEERED: YES;                                                     
*COMPND   6 MOL_ID: 2;                                                           
*COMPND   7 MOLECULE: DNA-DIRECTED RNA POLYMERASE II SUBUNIT RPB1;               
*COMPND   8 CHAIN: B;                                                            
*COMPND   9 FRAGMENT: UNP RESIDUES 1804-1816;                                    
*COMPND  10 SYNONYM: RNA POLYMERASE II SUBUNIT B1, DNA-DIRECTED RNA POLYMERASE II
*COMPND  11 SUBUNIT A, DNA-DIRECTED RNA POLYMERASE III LARGEST SUBUNIT, RNA-     
*COMPND  12 DIRECTED RNA POLYMERASE II SUBUNIT RPB1;                             
*COMPND  13 EC: 2.7.7.6, 2.7.7.48;                                               
*COMPND  14 ENGINEERED: YES                                                      
*SOURCE    MOL_ID: 1;                                                            
*SOURCE   2 ORGANISM_SCIENTIFIC: HOMO SAPIENS;                                   
*SOURCE   3 ORGANISM_COMMON: HUMAN;                                              
*SOURCE   4 ORGANISM_TAXID: 9606;                                                
*SOURCE   5 GENE: TDRD3;                                                         
*SOURCE   6 EXPRESSION_SYSTEM: ESCHERICHIA COLI;                                 
*SOURCE   7 EXPRESSION_SYSTEM_TAXID: 562;                                        
*SOURCE   8 EXPRESSION_SYSTEM_VECTOR: PET22B;                                    
*SOURCE   9 MOL_ID: 2;                                                           
*SOURCE  10 SYNTHETIC: YES;                                                      
*SOURCE  11 ORGANISM_SCIENTIFIC: HOMO SAPIENS;                                   
*SOURCE  12 ORGANISM_COMMON: HUMAN;                                              
*SOURCE  13 ORGANISM_TAXID: 9606                                                 
*KEYWDS    ADMA, TRANSCRIPTION-TRANSFERASE COMPLEX                               
*EXPDTA    SOLUTION NMR                                                          
*NUMMDL    20                                                                    
*AUTHOR    T.SIKORSKY                                                            
*REVDAT   2   15-NOV-23 2LTO    1                                                
*REVDAT   1   16-JAN-13 2LTO    0                                                


#
# 576 GLU H 591 PHE HA 4.32
 &rst
  ixpk= 0, nxpk= 0, iat= 397, 615, r1= 1.30, r2= 1.80, r3= 4.32, r4= 4.82, 
      rk2=20.0, rk3=20.0, ir6=1, ialtd=0,
 &end
#
# 591 PHE HA 591 PHE QD 3.89
 &rst
  ixpk= 0, nxpk= 0, iat= 615,  -1, r1= 1.30, r2= 1.80, r3= 4.37, r4= 4.87,
 igr2= 621, 629,
 &end
#
# 575 ALA HA 591 PHE HA 3.28
 &rst
  ixpk= 0, nxpk= 0, iat= 389, 615, r1= 1.30, r2= 1.80, r3= 3.28, r4= 3.78,  &end
#
# 591 PHE HA 592 ILE HG12 4.40
 &rst
  ixpk= 0, nxpk= 0, iat= 615, 643, r1= 1.30, r2= 1.80, r3= 4.40, r4= 4.90,  &end
#
# 575 ALA QB 591 PHE HA 3.36
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 615, r1= 1.30, r2= 1.80, r3= 4.04, r4= 4.54,
 igr1= 391, 392, 393,
 &end
#
# 602 LEU QB 603 SER HA 3.98
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 813, r1= 1.30, r2= 1.80, r3= 4.47, r4= 4.97,
 igr1= 796, 797,
 &end
#
# 601 LEU QQD 603 SER HA 4.71
 &rst
  ixpk= 0, nxpk= 0, iat= 779, 813, r1= 1.30, r2= 1.80, r3= 6.91, r4= 7.41,  &end
#
# 583 SER HA 583 SER QB 2.83
 &rst
  ixpk= 0, nxpk= 0, iat= 502,  -1, r1= 1.30, r2= 1.80, r3= 3.18, r4= 3.68,
 igr2= 504, 505,
 &end
#
# 565 LEU HA 566 TYR H 3.05
 &rst
  ixpk= 0, nxpk= 0, iat= 197, 214, r1= 1.30, r2= 1.80, r3= 3.05, r4= 3.55,  &end
#
# 565 LEU HA 573 TYR H 4.21
 &rst
  ixpk= 0, nxpk= 0, iat= 197, 342, r1= 1.30, r2= 1.80, r3= 4.21, r4= 4.71,  &end
#
# 565 LEU HA 573 TYR QE 5.36
 &rst
  ixpk= 0, nxpk= 0, iat= 197,  -1, r1= 1.30, r2= 1.80, r3= 6.02, r4= 6.52,
 igr2= 352, 357,
 &end
#
# 565 LEU HA 572 PHE QD 4.23
 &rst
  ixpk= 0, nxpk= 0, iat= 197,  -1, r1= 1.30, r2= 1.80, r3= 4.75, r4= 5.25,
 igr2= 330, 338,
 &end
#
# 565 LEU HA 572 PHE HA 3.37
 &rst
  ixpk= 0, nxpk= 0, iat= 197, 324, r1= 1.30, r2= 1.80, r3= 3.37, r4= 3.87,  &end
#
# 590 LYS HA 591 PHE QD 4.48
 &rst
  ixpk= 0, nxpk= 0, iat= 593,  -1, r1= 1.30, r2= 1.80, r3= 5.03, r4= 5.53,
 igr2= 621, 629,
 &end
#
# 590 LYS HA 590 LYS HG2 3.83
 &rst
  ixpk= 0, nxpk= 0, iat= 593, 598, r1= 1.30, r2= 1.80, r3= 3.83, r4= 4.33,  &end
#
# 590 LYS HA 590 LYS HG3 3.85
 &rst
  ixpk= 0, nxpk= 0, iat= 593, 599, r1= 1.30, r2= 1.80, r3= 3.85, r4= 4.35,  &end
#
# 580 LEU HA 587 ALA QB 3.67
 &rst
  ixpk= 0, nxpk= 0, iat= 455,  -1, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,
 igr2= 553, 554, 555,
 &end
#
# 563 PHE HB3 564 ALA QB 4.97
 &rst
  ixpk= 0, nxpk= 0, iat= 170,  -1, r1= 1.30, r2= 1.80, r3= 5.97, r4= 6.47,
 igr2= 189, 190, 191,
 &end
#
# 590 LYS HE3 596 ASN HA 4.46
 &rst
  ixpk= 0, nxpk= 0, iat= 605, 694, r1= 1.30, r2= 1.80, r3= 4.46, r4= 4.96,  &end
#
# 590 LYS HG2 590 LYS HE3 4.16
 &rst
  ixpk= 0, nxpk= 0, iat= 598, 605, r1= 1.30, r2= 1.80, r3= 4.16, r4= 4.66,  &end
#
# 563 PHE HB2 606 LYS H 4.52
 &rst
  ixpk= 0, nxpk= 0, iat= 169, 855, r1= 1.30, r2= 1.80, r3= 4.52, r4= 5.02,  &end
#
# 563 PHE H 563 PHE HB2 4.00
 &rst
  ixpk= 0, nxpk= 0, iat= 165, 169, r1= 1.30, r2= 1.80, r3= 4.00, r4= 4.50,  &end
#
# 590 LYS HE2 596 ASN HA 4.46
 &rst
  ixpk= 0, nxpk= 0, iat= 604, 694, r1= 1.30, r2= 1.80, r3= 4.46, r4= 4.96,  &end
#
# 590 LYS HB2 590 LYS HE2 4.69
 &rst
  ixpk= 0, nxpk= 0, iat= 595, 604, r1= 1.30, r2= 1.80, r3= 4.69, r4= 5.19,  &end
#
# 590 LYS HG2 590 LYS HE2 4.16
 &rst
  ixpk= 0, nxpk= 0, iat= 598, 604, r1= 1.30, r2= 1.80, r3= 4.16, r4= 4.66,  &end
#
# 571 LYS HA 573 TYR QE 4.77
 &rst
  ixpk= 0, nxpk= 0, iat= 302,  -1, r1= 1.30, r2= 1.80, r3= 5.35, r4= 5.85,
 igr2= 352, 357,
 &end
#
# 571 LYS HA 572 PHE QD 4.36
 &rst
  ixpk= 0, nxpk= 0, iat= 302,  -1, r1= 1.30, r2= 1.80, r3= 4.89, r4= 5.39,
 igr2= 330, 338,
 &end
#
# 571 LYS HA 572 PHE QE 4.99
 &rst
  ixpk= 0, nxpk= 0, iat= 302,  -1, r1= 1.30, r2= 1.80, r3= 5.60, r4= 6.10,
 igr2= 332, 336,
 &end
#
# 571 LYS HA 572 PHE HB2 4.96
 &rst
  ixpk= 0, nxpk= 0, iat= 302, 326, r1= 1.30, r2= 1.80, r3= 4.96, r4= 5.46,  &end
#
# 575 ALA HA 591 PHE H 4.41
 &rst
  ixpk= 0, nxpk= 0, iat= 389, 613, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,  &end
#
# 575 ALA HA 592 ILE H 3.41
 &rst
  ixpk= 0, nxpk= 0, iat= 389, 633, r1= 1.30, r2= 1.80, r3= 3.41, r4= 3.91,  &end
#
# 575 ALA HA 576 GLU QB 4.54
 &rst
  ixpk= 0, nxpk= 0, iat= 389,  -1, r1= 1.30, r2= 1.80, r3= 5.10, r4= 5.60,
 igr2= 401, 402,
 &end
#
# 575 ALA HA 592 ILE HG12 3.82
 &rst
  ixpk= 0, nxpk= 0, iat= 389, 643, r1= 1.30, r2= 1.80, r3= 3.82, r4= 4.32,  &end
#
# 570 ASN H 570 ASN HA 2.91
 &rst
  ixpk= 0, nxpk= 0, iat= 286, 288, r1= 1.30, r2= 1.80, r3= 2.91, r4= 3.41,  &end
#
# 570 ASN HA 571 LYS H 3.46
 &rst
  ixpk= 0, nxpk= 0, iat= 288, 300, r1= 1.30, r2= 1.80, r3= 3.46, r4= 3.96,  &end
#
# 569 ASP H 570 ASN HA 4.28
 &rst
  ixpk= 0, nxpk= 0, iat= 274, 288, r1= 1.30, r2= 1.80, r3= 4.28, r4= 4.78,  &end
#
# 570 ASN HA 571 LYS HA 4.69
 &rst
  ixpk= 0, nxpk= 0, iat= 288, 302, r1= 1.30, r2= 1.80, r3= 4.69, r4= 5.19,  &end
#
# 609 LEU HA 609 LEU QB 2.84
 &rst
  ixpk= 0, nxpk= 0, iat= 912,  -1, r1= 1.30, r2= 1.80, r3= 3.19, r4= 3.69,
 igr2= 914, 915,
 &end
#
# 600 VAL HA 601 LEU H 2.91
 &rst
  ixpk= 0, nxpk= 0, iat= 759, 773, r1= 1.30, r2= 1.80, r3= 2.91, r4= 3.41,  &end
#
# 564 ALA HA 605 ILE H 4.66
 &rst
  ixpk= 0, nxpk= 0, iat= 187, 836, r1= 1.30, r2= 1.80, r3= 4.66, r4= 5.16,  &end
#
# 564 ALA HA 572 PHE QD 3.90
 &rst
  ixpk= 0, nxpk= 0, iat= 187,  -1, r1= 1.30, r2= 1.80, r3= 4.38, r4= 4.88,
 igr2= 330, 338,
 &end
#
# 564 ALA HA 605 ILE HA 3.22
 &rst
  ixpk= 0, nxpk= 0, iat= 187, 838, r1= 1.30, r2= 1.80, r3= 3.22, r4= 3.72,  &end
#
# 564 ALA HA 565 LEU HB2 4.46
 &rst
  ixpk= 0, nxpk= 0, iat= 187, 199, r1= 1.30, r2= 1.80, r3= 4.46, r4= 4.96,  &end
#
# 599 GLU HA 600 VAL H 2.89
 &rst
  ixpk= 0, nxpk= 0, iat= 744, 757, r1= 1.30, r2= 1.80, r3= 2.89, r4= 3.39,  &end
#
# 587 ALA H 599 GLU HA 3.57
 &rst
  ixpk= 0, nxpk= 0, iat= 549, 744, r1= 1.30, r2= 1.80, r3= 3.57, r4= 4.07,  &end
#
# 588 VAL HA 599 GLU HA 3.21
 &rst
  ixpk= 0, nxpk= 0, iat= 561, 744, r1= 1.30, r2= 1.80, r3= 3.21, r4= 3.71,  &end
#
# 599 GLU HA 599 GLU QG 3.59
 &rst
  ixpk= 0, nxpk= 0, iat= 744,  -1, r1= 1.30, r2= 1.80, r3= 4.03, r4= 4.53,
 igr2= 749, 750,
 &end
#
# 599 GLU HA 599 GLU QB 3.02
 &rst
  ixpk= 0, nxpk= 0, iat= 744,  -1, r1= 1.30, r2= 1.80, r3= 3.39, r4= 3.89,
 igr2= 746, 747,
 &end
#
# 588 VAL QG2 599 GLU HA 3.41
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 744, r1= 1.30, r2= 1.80, r3= 4.10, r4= 4.60,
 igr1= 569, 570, 571,
 &end
#
# 589 VAL QG2 599 GLU HA 4.89
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 744, r1= 1.30, r2= 1.80, r3= 5.87, r4= 6.37,
 igr1= 585, 586, 587,
 &end
#
# 566 TYR HA 573 TYR QD 4.48
 &rst
  ixpk= 0, nxpk= 0, iat= 216,  -1, r1= 1.30, r2= 1.80, r3= 5.03, r4= 5.53,
 igr2= 350, 359,
 &end
#
# 569 ASP HA 569 ASP HB3 2.90
 &rst
  ixpk= 0, nxpk= 0, iat= 276, 279, r1= 1.30, r2= 1.80, r3= 2.90, r4= 3.40,  &end
#
# 569 ASP HA 570 ASN HB2 4.30
 &rst
  ixpk= 0, nxpk= 0, iat= 276, 290, r1= 1.30, r2= 1.80, r3= 4.30, r4= 4.80,  &end
#
# 569 ASP HA 569 ASP HB2 2.94
 &rst
  ixpk= 0, nxpk= 0, iat= 276, 278, r1= 1.30, r2= 1.80, r3= 2.94, r4= 3.44,  &end
#
# 568 GLU HB2 569 ASP HA 5.50
 &rst
  ixpk= 0, nxpk= 0, iat= 263, 276, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
# 579 ALA HA 580 LEU H 2.92
 &rst
  ixpk= 0, nxpk= 0, iat= 445, 453, r1= 1.30, r2= 1.80, r3= 2.92, r4= 3.42,  &end
#
# 557 LYS HA 579 ALA HA 5.50
 &rst
  ixpk= 0, nxpk= 0, iat=  86, 445, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
# 558 PRO HB2 579 ALA HA 3.70
 &rst
  ixpk= 0, nxpk= 0, iat= 113, 445, r1= 1.30, r2= 1.80, r3= 3.70, r4= 4.20,  &end
#
# 579 ALA HA 580 LEU HG 4.24
 &rst
  ixpk= 0, nxpk= 0, iat= 445, 460, r1= 1.30, r2= 1.80, r3= 4.24, r4= 4.74,  &end
#
# 577 VAL QG1 579 ALA HA 4.27
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 445, r1= 1.30, r2= 1.80, r3= 5.13, r4= 5.63,
 igr1= 418, 419, 420,
 &end
#
# 560 ASP HA 577 VAL HB 4.06
 &rst
  ixpk= 0, nxpk= 0, iat= 129, 416, r1= 1.30, r2= 1.80, r3= 4.06, r4= 4.56,  &end
#
# 562 CYS H 576 GLU HA 3.77
 &rst
  ixpk= 0, nxpk= 0, iat= 154, 399, r1= 1.30, r2= 1.80, r3= 3.77, r4= 4.27,  &end
#
# 597 TYR HA 598 GLU HA 4.68
 &rst
  ixpk= 0, nxpk= 0, iat= 708, 729, r1= 1.30, r2= 1.80, r3= 4.68, r4= 5.18,  &end
#
# 598 GLU HA 599 GLU QB 4.83
 &rst
  ixpk= 0, nxpk= 0, iat= 729,  -1, r1= 1.30, r2= 1.80, r3= 5.42, r4= 5.92,
 igr2= 746, 747,
 &end
#
# 598 GLU HA 598 GLU QG 3.55
 &rst
  ixpk= 0, nxpk= 0, iat= 729,  -1, r1= 1.30, r2= 1.80, r3= 3.98, r4= 4.48,
 igr2= 734, 735,
 &end
#
# 608 ILE HA 609 LEU H 3.54
 &rst
  ixpk= 0, nxpk= 0, iat= 893, 910, r1= 1.30, r2= 1.80, r3= 3.54, r4= 4.04,  &end
#
# 563 PHE QD 608 ILE HA 3.68
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 893, r1= 1.30, r2= 1.80, r3= 4.13, r4= 4.63,
 igr1= 173, 181,
 &end
#
# 563 PHE QE 608 ILE HA 4.16
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 893, r1= 1.30, r2= 1.80, r3= 4.67, r4= 5.17,
 igr1= 175, 179,
 &end
#
# 562 CYS HA 608 ILE HA 4.12
 &rst
  ixpk= 0, nxpk= 0, iat= 156, 893, r1= 1.30, r2= 1.80, r3= 4.12, r4= 4.62,  &end
#
# 608 ILE HA 608 ILE QG1 3.81
 &rst
  ixpk= 0, nxpk= 0, iat= 893,  -1, r1= 1.30, r2= 1.80, r3= 4.28, r4= 4.78,
 igr2= 901, 902,
 &end
#
# 608 ILE HA 608 ILE QG2 3.03
 &rst
  ixpk= 0, nxpk= 0, iat= 893,  -1, r1= 1.30, r2= 1.80, r3= 3.64, r4= 4.14,
 igr2= 897, 898, 899,
 &end
#
# 557 LYS H 580 LEU HG 4.45
 &rst
  ixpk= 0, nxpk= 0, iat=  84, 460, r1= 1.30, r2= 1.80, r3= 4.45, r4= 4.95,  &end
#
# 557 LYS HA 580 LEU HG 4.20
 &rst
  ixpk= 0, nxpk= 0, iat=  86, 460, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,  &end
#
# 577 VAL QG1 580 LEU HG 4.63
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 460, r1= 1.30, r2= 1.80, r3= 5.56, r4= 6.06,
 igr1= 418, 419, 420,
 &end
#
# 578 GLU QG 579 ALA HA 4.42
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 445, r1= 1.30, r2= 1.80, r3= 4.96, r4= 5.46,
 igr1= 435, 436,
 &end
#
# 578 GLU QG 588 VAL HB 3.77
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 563, r1= 1.30, r2= 1.80, r3= 4.23, r4= 4.73,
 igr1= 435, 436,
 &end
#
# 578 GLU QG 579 ALA QB 4.67
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.30, r4= 6.80,
 igr1= 435, 436,
 igr2= 447, 448, 449,
 &end
#
# 568 GLU HB2 570 ASN H 5.50
 &rst
  ixpk= 0, nxpk= 0, iat= 263, 286, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
# 578 GLU H 588 VAL QG1 4.80
 &rst
  ixpk= 0, nxpk= 0, iat= 428,  -1, r1= 1.30, r2= 1.80, r3= 5.76, r4= 6.26,
 igr2= 565, 566, 567,
 &end
#
# 588 VAL QG2 600 VAL H 4.76
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 757, r1= 1.30, r2= 1.80, r3= 5.72, r4= 6.22,
 igr1= 569, 570, 571,
 &end
#
# 588 VAL QG1 589 VAL H 3.11
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 575, r1= 1.30, r2= 1.80, r3= 3.73, r4= 4.23,
 igr1= 565, 566, 567,
 &end
#
# 588 VAL QG1 598 GLU H 3.78
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 727, r1= 1.30, r2= 1.80, r3= 4.54, r4= 5.04,
 igr1= 565, 566, 567,
 &end
#
# 588 VAL H 588 VAL QG2 3.07
 &rst
  ixpk= 0, nxpk= 0, iat= 559,  -1, r1= 1.30, r2= 1.80, r3= 3.69, r4= 4.19,
 igr2= 569, 570, 571,
 &end
#
# 588 VAL QG1 598 GLU HA 3.70
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 729, r1= 1.30, r2= 1.80, r3= 4.44, r4= 4.94,
 igr1= 565, 566, 567,
 &end
#
# 588 VAL HA 588 VAL QG1 2.92
 &rst
  ixpk= 0, nxpk= 0, iat= 561,  -1, r1= 1.30, r2= 1.80, r3= 3.51, r4= 4.01,
 igr2= 565, 566, 567,
 &end
#
# 588 VAL HA 588 VAL QG2 3.35
 &rst
  ixpk= 0, nxpk= 0, iat= 561,  -1, r1= 1.30, r2= 1.80, r3= 4.02, r4= 4.52,
 igr2= 569, 570, 571,
 &end
#
# 588 VAL QG1 590 LYS HA 4.96
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 593, r1= 1.30, r2= 1.80, r3= 5.96, r4= 6.46,
 igr1= 565, 566, 567,
 &end
#
# 588 VAL QG1 597 TYR HB2 3.61
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 710, r1= 1.30, r2= 1.80, r3= 4.34, r4= 4.84,
 igr1= 565, 566, 567,
 &end
#
# 578 GLU H 589 VAL QG1 3.46
 &rst
  ixpk= 0, nxpk= 0, iat= 428,  -1, r1= 1.30, r2= 1.80, r3= 4.16, r4= 4.66,
 igr2= 581, 582, 583,
 &end
#
# 589 VAL H 589 VAL QG1 3.40
 &rst
  ixpk= 0, nxpk= 0, iat= 575,  -1, r1= 1.30, r2= 1.80, r3= 4.08, r4= 4.58,
 igr2= 581, 582, 583,
 &end
#
# 577 VAL H 589 VAL QG1 4.08
 &rst
  ixpk= 0, nxpk= 0, iat= 412,  -1, r1= 1.30, r2= 1.80, r3= 4.90, r4= 5.40,
 igr2= 581, 582, 583,
 &end
#
# 589 VAL QG1 590 LYS H 4.04
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 591, r1= 1.30, r2= 1.80, r3= 4.85, r4= 5.35,
 igr1= 581, 582, 583,
 &end
#
# 576 GLU H 589 VAL QG1 5.50
 &rst
  ixpk= 0, nxpk= 0, iat= 397,  -1, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr2= 581, 582, 583,
 &end
#
# 579 ALA H 589 VAL QG1 4.59
 &rst
  ixpk= 0, nxpk= 0, iat= 443,  -1, r1= 1.30, r2= 1.80, r3= 5.51, r4= 6.01,
 igr2= 581, 582, 583,
 &end
#
# 589 VAL HA 589 VAL QG1 2.98
 &rst
  ixpk= 0, nxpk= 0, iat= 577,  -1, r1= 1.30, r2= 1.80, r3= 3.58, r4= 4.08,
 igr2= 581, 582, 583,
 &end
#
# 588 VAL HA 589 VAL QG1 4.18
 &rst
  ixpk= 0, nxpk= 0, iat= 561,  -1, r1= 1.30, r2= 1.80, r3= 5.02, r4= 5.52,
 igr2= 581, 582, 583,
 &end
#
# 577 VAL HA 589 VAL QG1 3.03
 &rst
  ixpk= 0, nxpk= 0, iat= 414,  -1, r1= 1.30, r2= 1.80, r3= 3.64, r4= 4.14,
 igr2= 581, 582, 583,
 &end
#
# 577 VAL HB 589 VAL QG1 4.31
 &rst
  ixpk= 0, nxpk= 0, iat= 416,  -1, r1= 1.30, r2= 1.80, r3= 5.18, r4= 5.68,
 igr2= 581, 582, 583,
 &end
#
# 589 VAL QG1 600 VAL HB 4.46
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 761, r1= 1.30, r2= 1.80, r3= 5.36, r4= 5.86,
 igr1= 581, 582, 583,
 &end
#
# 587 ALA QB 589 VAL QG1 2.93
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.23, r4= 4.73,
 igr1= 553, 554, 555,
 igr2= 581, 582, 583,
 &end
#
# 589 VAL QG1 605 ILE QG2 3.01
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.34, r4= 4.84,
 igr1= 581, 582, 583,
 igr2= 842, 843, 844,
 &end
#
# 589 VAL QG1 605 ILE QD1 3.18
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.59, r4= 5.09,
 igr1= 581, 582, 583,
 igr2= 849, 850, 851,
 &end
#
# 589 VAL QG2 598 GLU QB 4.94
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.66, r4= 7.16,
 igr1= 585, 586, 587,
 igr2= 731, 732,
 &end
#
# 590 LYS HB2 597 TYR QE 4.18
 &rst
  ixpk= 0, nxpk= 0, iat= 595,  -1, r1= 1.30, r2= 1.80, r3= 4.69, r4= 5.19,
 igr2= 716, 721,
 &end
#
# 576 GLU QB 590 LYS HB2 4.79
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 595, r1= 1.30, r2= 1.80, r3= 5.38, r4= 5.88,
 igr1= 401, 402,
 &end
#
# 576 GLU H 590 LYS HB3 4.62
 &rst
  ixpk= 0, nxpk= 0, iat= 397, 596, r1= 1.30, r2= 1.80, r3= 4.62, r4= 5.12,  &end
#
# 607 PRO HB3 608 ILE H 3.93
 &rst
  ixpk= 0, nxpk= 0, iat= 885, 891, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,  &end
#
# 556 TRP HZ2 562 CYS HB2 4.54
 &rst
  ixpk= 0, nxpk= 0, iat=  73, 158, r1= 1.30, r2= 1.80, r3= 4.54, r4= 5.04,  &end
#
# 574 ARG H 592 ILE HG13 5.26
 &rst
  ixpk= 0, nxpk= 0, iat= 363, 644, r1= 1.30, r2= 1.80, r3= 5.26, r4= 5.76,  &end
#
# 575 ALA HA 592 ILE HG13 3.66
 &rst
  ixpk= 0, nxpk= 0, iat= 389, 644, r1= 1.30, r2= 1.80, r3= 3.66, r4= 4.16,  &end
#
# 591 PHE HA 592 ILE HG13 4.20
 &rst
  ixpk= 0, nxpk= 0, iat= 615, 644, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,  &end
#
# 592 ILE QG2 592 ILE HG13 3.27
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 644, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1= 639, 640, 641,
 &end
#
# 592 ILE H 592 ILE HG12 3.85
 &rst
  ixpk= 0, nxpk= 0, iat= 633, 643, r1= 1.30, r2= 1.80, r3= 3.85, r4= 4.35,  &end
#
# 558 PRO HB2 559 GLY H 3.81
 &rst
  ixpk= 0, nxpk= 0, iat= 113, 120, r1= 1.30, r2= 1.80, r3= 3.81, r4= 4.31,  &end
#
# 559 GLY H 577 VAL HB 4.22
 &rst
  ixpk= 0, nxpk= 0, iat= 120, 416, r1= 1.30, r2= 1.80, r3= 4.22, r4= 4.72,  &end
#
# 576 GLU HA 577 VAL HB 4.54
 &rst
  ixpk= 0, nxpk= 0, iat= 399, 416, r1= 1.30, r2= 1.80, r3= 4.54, r4= 5.04,  &end
#
# 558 PRO HB2 578 GLU HA 4.89
 &rst
  ixpk= 0, nxpk= 0, iat= 113, 430, r1= 1.30, r2= 1.80, r3= 4.89, r4= 5.39,  &end
#
# 560 ASP QB 577 VAL HB 3.89
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 416, r1= 1.30, r2= 1.80, r3= 4.37, r4= 4.87,
 igr1= 131, 132,
 &end
#
# 561 GLU QB 608 ILE QG1 4.60
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.80, r4= 6.30,
 igr1= 143, 144,
 igr2= 901, 902,
 &end
#
# 561 GLU QB 592 ILE QD1 4.25
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.73, r4= 6.23,
 igr1= 143, 144,
 igr2= 646, 647, 648,
 &end
#
# 561 GLU QB 608 ILE QD1 3.79
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.11, r4= 5.61,
 igr1= 143, 144,
 igr2= 904, 905, 906,
 &end
#
# 566 TYR H 566 TYR HB2 4.02
 &rst
  ixpk= 0, nxpk= 0, iat= 214, 218, r1= 1.30, r2= 1.80, r3= 4.02, r4= 4.52,  &end
#
# 569 ASP H 570 ASN HB2 4.98
 &rst
  ixpk= 0, nxpk= 0, iat= 274, 290, r1= 1.30, r2= 1.80, r3= 4.98, r4= 5.48,  &end
#
# 605 ILE HB 606 LYS H 4.18
 &rst
  ixpk= 0, nxpk= 0, iat= 840, 855, r1= 1.30, r2= 1.80, r3= 4.18, r4= 4.68,  &end
#
# 605 ILE H 605 ILE HB 3.65
 &rst
  ixpk= 0, nxpk= 0, iat= 836, 840, r1= 1.30, r2= 1.80, r3= 3.65, r4= 4.15,  &end
#
# 564 ALA HA 605 ILE HB 4.76
 &rst
  ixpk= 0, nxpk= 0, iat= 187, 840, r1= 1.30, r2= 1.80, r3= 4.76, r4= 5.26,  &end
#
# 602 LEU HA 605 ILE HB 4.28
 &rst
  ixpk= 0, nxpk= 0, iat= 794, 840, r1= 1.30, r2= 1.80, r3= 4.28, r4= 4.78,  &end
#
# 562 CYS HB3 605 ILE HB 5.17
 &rst
  ixpk= 0, nxpk= 0, iat= 159, 840, r1= 1.30, r2= 1.80, r3= 5.17, r4= 5.67,  &end
#
# 602 LEU QB 605 ILE HB 5.34
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 840, r1= 1.30, r2= 1.80, r3= 5.99, r4= 6.49,
 igr1= 796, 797,
 &end
#
# 605 ILE HB 605 ILE QD1 3.41
 &rst
  ixpk= 0, nxpk= 0, iat= 840,  -1, r1= 1.30, r2= 1.80, r3= 4.10, r4= 4.60,
 igr2= 849, 850, 851,
 &end
#
# 568 GLU HA 568 GLU HB2 2.85
 &rst
  ixpk= 0, nxpk= 0, iat= 261, 263, r1= 1.30, r2= 1.80, r3= 2.85, r4= 3.35,  &end
#
# 561 GLU HA 561 GLU QG 3.77
 &rst
  ixpk= 0, nxpk= 0, iat= 141,  -1, r1= 1.30, r2= 1.80, r3= 4.23, r4= 4.73,
 igr2= 146, 147,
 &end
#
# 560 ASP HA 561 GLU QG 4.60
 &rst
  ixpk= 0, nxpk= 0, iat= 129,  -1, r1= 1.30, r2= 1.80, r3= 5.16, r4= 5.66,
 igr2= 146, 147,
 &end
#
# 561 GLU QB 561 GLU QG 3.00
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 3.78, r4= 4.28,
 igr1= 143, 144,
 igr2= 146, 147,
 &end
#
# 596 ASN QB 597 TYR H 3.77
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 706, r1= 1.30, r2= 1.80, r3= 4.23, r4= 4.73,
 igr1= 696, 697,
 &end
#
# 565 LEU H 604 ASN HB2 4.48
 &rst
  ixpk= 0, nxpk= 0, iat= 195, 826, r1= 1.30, r2= 1.80, r3= 4.48, r4= 4.98,  &end
#
# 604 ASN HB2 605 ILE H 4.09
 &rst
  ixpk= 0, nxpk= 0, iat= 826, 836, r1= 1.30, r2= 1.80, r3= 4.09, r4= 4.59,  &end
#
# 562 CYS HA 608 ILE HB 4.25
 &rst
  ixpk= 0, nxpk= 0, iat= 156, 895, r1= 1.30, r2= 1.80, r3= 4.25, r4= 4.75,  &end
#
# 592 ILE H 592 ILE HB 3.64
 &rst
  ixpk= 0, nxpk= 0, iat= 633, 637, r1= 1.30, r2= 1.80, r3= 3.64, r4= 4.14,  &end
#
# 575 ALA HA 592 ILE HB 4.53
 &rst
  ixpk= 0, nxpk= 0, iat= 389, 637, r1= 1.30, r2= 1.80, r3= 4.53, r4= 5.03,  &end
#
# 591 PHE HA 592 ILE HB 5.14
 &rst
  ixpk= 0, nxpk= 0, iat= 615, 637, r1= 1.30, r2= 1.80, r3= 5.14, r4= 5.64,  &end
#
# 565 LEU HB3 605 ILE H 5.38
 &rst
  ixpk= 0, nxpk= 0, iat= 200, 836, r1= 1.30, r2= 1.80, r3= 5.38, r4= 5.88,  &end
#
# 585 MET QE 586 THR HB 4.96
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 539, r1= 1.30, r2= 1.80, r3= 5.96, r4= 6.46,
 igr1= 529, 530, 531,
 &end
#
# 592 ILE H 592 ILE QD1 3.88
 &rst
  ixpk= 0, nxpk= 0, iat= 633,  -1, r1= 1.30, r2= 1.80, r3= 4.66, r4= 5.16,
 igr2= 646, 647, 648,
 &end
#
# 575 ALA HA 592 ILE QD1 3.67
 &rst
  ixpk= 0, nxpk= 0, iat= 389,  -1, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,
 igr2= 646, 647, 648,
 &end
#
# 561 GLU QG 592 ILE QD1 4.40
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.93, r4= 6.43,
 igr1= 146, 147,
 igr2= 646, 647, 648,
 &end
#
# 576 GLU QG 592 ILE QD1 3.48
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.69, r4= 5.19,
 igr1= 404, 405,
 igr2= 646, 647, 648,
 &end
#
# 576 GLU QB 592 ILE QD1 3.53
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.76, r4= 5.26,
 igr1= 401, 402,
 igr2= 646, 647, 648,
 &end
#
# 562 CYS H 608 ILE QD1 4.35
 &rst
  ixpk= 0, nxpk= 0, iat= 154,  -1, r1= 1.30, r2= 1.80, r3= 5.22, r4= 5.72,
 igr2= 904, 905, 906,
 &end
#
# 562 CYS HA 608 ILE QD1 3.45
 &rst
  ixpk= 0, nxpk= 0, iat= 156,  -1, r1= 1.30, r2= 1.80, r3= 4.14, r4= 4.64,
 igr2= 904, 905, 906,
 &end
#
# 574 ARG HA 608 ILE QD1 4.48
 &rst
  ixpk= 0, nxpk= 0, iat= 365,  -1, r1= 1.30, r2= 1.80, r3= 5.38, r4= 5.88,
 igr2= 904, 905, 906,
 &end
#
# 608 ILE HA 608 ILE QD1 3.77
 &rst
  ixpk= 0, nxpk= 0, iat= 893,  -1, r1= 1.30, r2= 1.80, r3= 4.53, r4= 5.03,
 igr2= 904, 905, 906,
 &end
#
# 561 GLU QG 608 ILE QD1 4.05
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.46, r4= 5.96,
 igr1= 146, 147,
 igr2= 904, 905, 906,
 &end
#
# 608 ILE HB 608 ILE QD1 3.19
 &rst
  ixpk= 0, nxpk= 0, iat= 895,  -1, r1= 1.30, r2= 1.80, r3= 3.83, r4= 4.33,
 igr2= 904, 905, 906,
 &end
#
# 608 ILE QG2 608 ILE QD1 2.57
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 3.71, r4= 4.21,
 igr1= 897, 898, 899,
 igr2= 904, 905, 906,
 &end
#
# 562 CYS H 608 ILE QG2 5.50
 &rst
  ixpk= 0, nxpk= 0, iat= 154,  -1, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr2= 897, 898, 899,
 &end
#
# 608 ILE H 608 ILE QG2 3.48
 &rst
  ixpk= 0, nxpk= 0, iat= 891,  -1, r1= 1.30, r2= 1.80, r3= 4.18, r4= 4.68,
 igr2= 897, 898, 899,
 &end
#
# 608 ILE QG2 609 LEU H 3.83
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 910, r1= 1.30, r2= 1.80, r3= 4.60, r4= 5.10,
 igr1= 897, 898, 899,
 &end
#
# 563 PHE QE 608 ILE QG2 4.23
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.70, r4= 6.20,
 igr1= 175, 179,
 igr2= 897, 898, 899,
 &end
#
# 562 CYS HA 608 ILE QG2 4.03
 &rst
  ixpk= 0, nxpk= 0, iat= 156,  -1, r1= 1.30, r2= 1.80, r3= 4.84, r4= 5.34,
 igr2= 897, 898, 899,
 &end
#
# 608 ILE QG2 609 LEU HA 4.10
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 912, r1= 1.30, r2= 1.80, r3= 4.92, r4= 5.42,
 igr1= 897, 898, 899,
 &end
#
# 561 GLU QG 608 ILE QG2 4.67
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.30, r4= 6.80,
 igr1= 146, 147,
 igr2= 897, 898, 899,
 &end
#
# 608 ILE QG2 609 LEU QB 3.64
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.91, r4= 5.41,
 igr1= 897, 898, 899,
 igr2= 914, 915,
 &end
#
# 592 ILE QG2 593 ASP H 4.53
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 652, r1= 1.30, r2= 1.80, r3= 5.44, r4= 5.94,
 igr1= 639, 640, 641,
 &end
#
# 576 GLU H 592 ILE QG2 4.01
 &rst
  ixpk= 0, nxpk= 0, iat= 397,  -1, r1= 1.30, r2= 1.80, r3= 4.82, r4= 5.32,
 igr2= 639, 640, 641,
 &end
#
# 592 ILE H 592 ILE QG2 3.82
 &rst
  ixpk= 0, nxpk= 0, iat= 633,  -1, r1= 1.30, r2= 1.80, r3= 4.59, r4= 5.09,
 igr2= 639, 640, 641,
 &end
#
# 592 ILE HA 592 ILE QG2 2.97
 &rst
  ixpk= 0, nxpk= 0, iat= 635,  -1, r1= 1.30, r2= 1.80, r3= 3.57, r4= 4.07,
 igr2= 639, 640, 641,
 &end
#
# 605 ILE QG2 606 LYS H 3.29
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 855, r1= 1.30, r2= 1.80, r3= 3.95, r4= 4.45,
 igr1= 842, 843, 844,
 &end
#
# 589 VAL QG2 598 GLU H 3.67
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 727, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,
 igr1= 585, 586, 587,
 &end
#
# 589 VAL QG2 590 LYS H 4.19
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 591, r1= 1.30, r2= 1.80, r3= 5.03, r4= 5.53,
 igr1= 585, 586, 587,
 &end
#
# 605 ILE H 605 ILE QG2 3.80
 &rst
  ixpk= 0, nxpk= 0, iat= 836,  -1, r1= 1.30, r2= 1.80, r3= 4.56, r4= 5.06,
 igr2= 842, 843, 844,
 &end
#
# 556 TRP HZ2 605 ILE QG2 3.56
 &rst
  ixpk= 0, nxpk= 0, iat=  73,  -1, r1= 1.30, r2= 1.80, r3= 4.28, r4= 4.78,
 igr2= 842, 843, 844,
 &end
#
# 556 TRP HH2 605 ILE QG2 4.82
 &rst
  ixpk= 0, nxpk= 0, iat=  75,  -1, r1= 1.30, r2= 1.80, r3= 5.79, r4= 6.29,
 igr2= 842, 843, 844,
 &end
#
# 564 ALA HA 605 ILE QG2 3.40
 &rst
  ixpk= 0, nxpk= 0, iat= 187,  -1, r1= 1.30, r2= 1.80, r3= 4.08, r4= 4.58,
 igr2= 842, 843, 844,
 &end
#
# 605 ILE HA 605 ILE QG2 3.01
 &rst
  ixpk= 0, nxpk= 0, iat= 838,  -1, r1= 1.30, r2= 1.80, r3= 3.61, r4= 4.11,
 igr2= 842, 843, 844,
 &end
#
# 588 VAL HA 589 VAL QG2 3.77
 &rst
  ixpk= 0, nxpk= 0, iat= 561,  -1, r1= 1.30, r2= 1.80, r3= 4.53, r4= 5.03,
 igr2= 585, 586, 587,
 &end
#
# 562 CYS HB2 605 ILE QG2 3.58
 &rst
  ixpk= 0, nxpk= 0, iat= 158,  -1, r1= 1.30, r2= 1.80, r3= 4.30, r4= 4.80,
 igr2= 842, 843, 844,
 &end
#
# 562 CYS HB3 605 ILE QG2 3.58
 &rst
  ixpk= 0, nxpk= 0, iat= 159,  -1, r1= 1.30, r2= 1.80, r3= 4.30, r4= 4.80,
 igr2= 842, 843, 844,
 &end
#
# 589 VAL QG2 600 VAL HB 4.14
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 761, r1= 1.30, r2= 1.80, r3= 4.97, r4= 5.47,
 igr1= 585, 586, 587,
 &end
#
# 589 VAL QG2 598 GLU QG 4.31
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.81, r4= 6.31,
 igr1= 585, 586, 587,
 igr2= 734, 735,
 &end
#
# 564 ALA QB 589 VAL QG2 2.81
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.05, r4= 4.55,
 igr1= 189, 190, 191,
 igr2= 585, 586, 587,
 &end
#
# 605 ILE QG2 605 ILE QD1 2.77
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.00, r4= 4.50,
 igr1= 842, 843, 844,
 igr2= 849, 850, 851,
 &end
#
# 605 ILE H 605 ILE QG1 4.03
 &rst
  ixpk= 0, nxpk= 0, iat= 836,  -1, r1= 1.30, r2= 1.80, r3= 4.52, r4= 5.02,
 igr2= 846, 847,
 &end
#
# 556 TRP HZ2 605 ILE QG1 5.09
 &rst
  ixpk= 0, nxpk= 0, iat=  73,  -1, r1= 1.30, r2= 1.80, r3= 5.71, r4= 6.21,
 igr2= 846, 847,
 &end
#
# 602 LEU HA 605 ILE QG1 4.11
 &rst
  ixpk= 0, nxpk= 0, iat= 794,  -1, r1= 1.30, r2= 1.80, r3= 4.61, r4= 5.11,
 igr2= 846, 847,
 &end
#
# 605 ILE QG2 605 ILE QG1 3.73
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.03, r4= 5.53,
 igr1= 842, 843, 844,
 igr2= 846, 847,
 &end
#
# 562 CYS HA 608 ILE QG1 3.89
 &rst
  ixpk= 0, nxpk= 0, iat= 156,  -1, r1= 1.30, r2= 1.80, r3= 4.37, r4= 4.87,
 igr2= 901, 902,
 &end
#
# 571 LYS QD 572 PHE HA 4.76
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 324, r1= 1.30, r2= 1.80, r3= 5.34, r4= 5.84,
 igr1= 310, 311,
 &end
#
# 574 ARG QB 592 ILE HG12 4.06
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 643, r1= 1.30, r2= 1.80, r3= 4.56, r4= 5.06,
 igr1= 367, 368,
 &end
#
# 574 ARG QB 592 ILE QD1 3.65
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.92, r4= 5.42,
 igr1= 367, 368,
 igr2= 646, 647, 648,
 &end
#
# 574 ARG QB 608 ILE QD1 4.23
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.70, r4= 6.20,
 igr1= 367, 368,
 igr2= 904, 905, 906,
 &end
#
# 578 GLU QB 597 TYR QE 4.75
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.98, r4= 6.48,
 igr1= 432, 433,
 igr2= 716, 721,
 &end
#
# 588 VAL HA 599 GLU QB 4.75
 &rst
  ixpk= 0, nxpk= 0, iat= 561,  -1, r1= 1.30, r2= 1.80, r3= 5.33, r4= 5.83,
 igr2= 746, 747,
 &end
#
# 574 ARG QB 574 ARG QD 3.48
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.38, r4= 4.88,
 igr1= 367, 368,
 igr2= 373, 374,
 &end
#
# 574 ARG QB 574 ARG QG 2.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 3.15, r4= 3.65,
 igr1= 367, 368,
 igr2= 370, 371,
 &end
#
# 578 GLU QB 579 ALA QB 4.08
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,
 igr1= 432, 433,
 igr2= 447, 448, 449,
 &end
#
# 578 GLU QB 588 VAL QG1 3.37
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.54, r4= 5.04,
 igr1= 432, 433,
 igr2= 565, 566, 567,
 &end
#
# 578 GLU H 589 VAL HB 4.96
 &rst
  ixpk= 0, nxpk= 0, iat= 428, 579, r1= 1.30, r2= 1.80, r3= 4.96, r4= 5.46,  &end
#
# 575 ALA QB 589 VAL HB 3.23
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 579, r1= 1.30, r2= 1.80, r3= 3.88, r4= 4.38,
 igr1= 391, 392, 393,
 &end
#
# 576 GLU QB 577 VAL H 3.73
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 412, r1= 1.30, r2= 1.80, r3= 4.19, r4= 4.69,
 igr1= 401, 402,
 &end
#
# 576 GLU QB 592 ILE HG12 3.76
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 643, r1= 1.30, r2= 1.80, r3= 4.22, r4= 4.72,
 igr1= 401, 402,
 &end
#
# 576 GLU QB 590 LYS HG2 4.56
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 598, r1= 1.30, r2= 1.80, r3= 5.12, r4= 5.62,
 igr1= 401, 402,
 &end
#
# 600 VAL H 600 VAL HB 3.62
 &rst
  ixpk= 0, nxpk= 0, iat= 757, 761, r1= 1.30, r2= 1.80, r3= 3.62, r4= 4.12,  &end
#
# 576 GLU QG 577 VAL H 4.46
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 412, r1= 1.30, r2= 1.80, r3= 5.01, r4= 5.51,
 igr1= 404, 405,
 &end
#
# 562 CYS H 576 GLU QG 4.76
 &rst
  ixpk= 0, nxpk= 0, iat= 154,  -1, r1= 1.30, r2= 1.80, r3= 5.34, r4= 5.84,
 igr2= 404, 405,
 &end
#
# 576 GLU H 576 GLU QG 3.94
 &rst
  ixpk= 0, nxpk= 0, iat= 397,  -1, r1= 1.30, r2= 1.80, r3= 4.42, r4= 4.92,
 igr2= 404, 405,
 &end
#
# 576 GLU HA 576 GLU QG 3.24
 &rst
  ixpk= 0, nxpk= 0, iat= 399,  -1, r1= 1.30, r2= 1.80, r3= 3.64, r4= 4.14,
 igr2= 404, 405,
 &end
#
# 576 GLU QB 576 GLU QG 2.47
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 3.11, r4= 3.61,
 igr1= 401, 402,
 igr2= 404, 405,
 &end
#
# 576 GLU QG 592 ILE HG13 4.58
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 644, r1= 1.30, r2= 1.80, r3= 5.14, r4= 5.64,
 igr1= 404, 405,
 &end
#
# 576 GLU QG 592 ILE QG2 3.07
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.14, r4= 4.64,
 igr1= 404, 405,
 igr2= 639, 640, 641,
 &end
#
# 600 VAL HB 605 ILE QD1 4.11
 &rst
  ixpk= 0, nxpk= 0, iat= 761,  -1, r1= 1.30, r2= 1.80, r3= 4.94, r4= 5.44,
 igr2= 849, 850, 851,
 &end
#
# 607 PRO HB2 608 ILE HA 4.62
 &rst
  ixpk= 0, nxpk= 0, iat= 884, 893, r1= 1.30, r2= 1.80, r3= 4.62, r4= 5.12,  &end
#
# 585 MET H 585 MET QG 4.49
 &rst
  ixpk= 0, nxpk= 0, iat= 518,  -1, r1= 1.30, r2= 1.80, r3= 5.04, r4= 5.54,
 igr2= 525, 526,
 &end
#
# 585 MET HA 585 MET QG 3.69
 &rst
  ixpk= 0, nxpk= 0, iat= 520,  -1, r1= 1.30, r2= 1.80, r3= 4.14, r4= 4.64,
 igr2= 525, 526,
 &end
#
# 585 MET QG 586 THR HB 5.30
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 539, r1= 1.30, r2= 1.80, r3= 5.95, r4= 6.45,
 igr1= 525, 526,
 &end
#
# 585 MET QG 585 MET QE 3.35
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.52, r4= 5.02,
 igr1= 525, 526,
 igr2= 529, 530, 531,
 &end
#
# 556 TRP HB2 602 LEU QQD 3.93
 &rst
  ixpk= 0, nxpk= 0, iat=  64, 798, r1= 1.30, r2= 1.80, r3= 6.13, r4= 6.63,  &end
#
# 559 GLY HA2 560 ASP QB 4.81
 &rst
  ixpk= 0, nxpk= 0, iat= 122,  -1, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr2= 131, 132,
 &end
#
# 556 TRP HD1 580 LEU QB 4.60
 &rst
  ixpk= 0, nxpk= 0, iat=  68,  -1, r1= 1.30, r2= 1.80, r3= 5.16, r4= 5.66,
 igr2= 457, 458,
 &end
#
# 565 LEU HB2 605 ILE H 5.22
 &rst
  ixpk= 0, nxpk= 0, iat= 199, 836, r1= 1.30, r2= 1.80, r3= 5.22, r4= 5.72,  &end
#
# 608 ILE QG1 609 LEU QB 5.29
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.66, r4= 7.16,
 igr1= 901, 902,
 igr2= 914, 915,
 &end
#
# 595 GLY HA2 596 ASN HA 4.54
 &rst
  ixpk= 0, nxpk= 0, iat= 687, 694, r1= 1.30, r2= 1.80, r3= 4.54, r4= 5.04,  &end
#
# 595 GLY HA3 596 ASN HA 4.63
 &rst
  ixpk= 0, nxpk= 0, iat= 688, 694, r1= 1.30, r2= 1.80, r3= 4.63, r4= 5.13,  &end
#
# 590 LYS HG2 595 GLY HA3 5.50
 &rst
  ixpk= 0, nxpk= 0, iat= 598, 688, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
# 559 GLY HA2 576 GLU QB 5.10
 &rst
  ixpk= 0, nxpk= 0, iat= 122,  -1, r1= 1.30, r2= 1.80, r3= 5.72, r4= 6.22,
 igr2= 401, 402,
 &end
#
# 558 PRO HB2 559 GLY HA2 5.08
 &rst
  ixpk= 0, nxpk= 0, iat= 113, 122, r1= 1.30, r2= 1.80, r3= 5.08, r4= 5.58,  &end
#
# 559 GLY HA2 577 VAL HB 5.31
 &rst
  ixpk= 0, nxpk= 0, iat= 122, 416, r1= 1.30, r2= 1.80, r3= 5.31, r4= 5.81,  &end
#
# 556 TRP HD1 602 LEU HA 4.16
 &rst
  ixpk= 0, nxpk= 0, iat=  68, 794, r1= 1.30, r2= 1.80, r3= 4.16, r4= 4.66,  &end
#
# 601 LEU HA 602 LEU HA 4.40
 &rst
  ixpk= 0, nxpk= 0, iat= 775, 794, r1= 1.30, r2= 1.80, r3= 4.40, r4= 4.90,  &end
#
# 602 LEU HA 602 LEU QB 2.95
 &rst
  ixpk= 0, nxpk= 0, iat= 794,  -1, r1= 1.30, r2= 1.80, r3= 3.31, r4= 3.81,
 igr2= 796, 797,
 &end
#
# 602 LEU HA 602 LEU HG 3.52
 &rst
  ixpk= 0, nxpk= 0, iat= 794, 799, r1= 1.30, r2= 1.80, r3= 3.52, r4= 4.02,  &end
#
# 587 ALA QB 602 LEU HA 4.13
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 794, r1= 1.30, r2= 1.80, r3= 4.96, r4= 5.46,
 igr1= 553, 554, 555,
 &end
#
# 602 LEU HA 605 ILE QG2 4.85
 &rst
  ixpk= 0, nxpk= 0, iat= 794,  -1, r1= 1.30, r2= 1.80, r3= 5.82, r4= 6.32,
 igr2= 842, 843, 844,
 &end
#
# 602 LEU HA 605 ILE QD1 3.35
 &rst
  ixpk= 0, nxpk= 0, iat= 794,  -1, r1= 1.30, r2= 1.80, r3= 4.02, r4= 4.52,
 igr2= 849, 850, 851,
 &end
#
# 567 TRP HA 570 ASN H 4.12
 &rst
  ixpk= 0, nxpk= 0, iat= 237, 286, r1= 1.30, r2= 1.80, r3= 4.12, r4= 4.62,  &end
#
# 566 TYR HA 567 TRP HA 5.11
 &rst
  ixpk= 0, nxpk= 0, iat= 216, 237, r1= 1.30, r2= 1.80, r3= 5.11, r4= 5.61,  &end
#
# 586 THR HA 587 ALA HA 5.47
 &rst
  ixpk= 0, nxpk= 0, iat= 537, 551, r1= 1.30, r2= 1.80, r3= 5.47, r4= 5.97,  &end
#
# 567 TRP HA 567 TRP HB2 2.88
 &rst
  ixpk= 0, nxpk= 0, iat= 237, 239, r1= 1.30, r2= 1.80, r3= 2.88, r4= 3.38,  &end
#
# 567 TRP HA 567 TRP HB3 2.94
 &rst
  ixpk= 0, nxpk= 0, iat= 237, 240, r1= 1.30, r2= 1.80, r3= 2.94, r4= 3.44,  &end
#
# 567 TRP HA 568 GLU HA 5.00
 &rst
  ixpk= 0, nxpk= 0, iat= 237, 261, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50,  &end
#
# 586 THR HA 601 LEU QQD 4.25
 &rst
  ixpk= 0, nxpk= 0, iat= 537, 779, r1= 1.30, r2= 1.80, r3= 6.45, r4= 6.95,  &end
#
# 565 LEU HG 567 TRP HA 4.90
 &rst
  ixpk= 0, nxpk= 0, iat= 202, 237, r1= 1.30, r2= 1.80, r3= 4.90, r4= 5.40,  &end
#
# 562 CYS H 574 ARG HA 5.27
 &rst
  ixpk= 0, nxpk= 0, iat= 154, 365, r1= 1.30, r2= 1.80, r3= 5.27, r4= 5.77,  &end
#
# 565 LEU HB2 605 ILE HA 4.51
 &rst
  ixpk= 0, nxpk= 0, iat= 199, 838, r1= 1.30, r2= 1.80, r3= 4.51, r4= 5.01,  &end
#
# 607 PRO HA 608 ILE HA 4.53
 &rst
  ixpk= 0, nxpk= 0, iat= 887, 893, r1= 1.30, r2= 1.80, r3= 4.53, r4= 5.03,  &end
#
# 607 PRO HA 608 ILE HB 4.54
 &rst
  ixpk= 0, nxpk= 0, iat= 887, 895, r1= 1.30, r2= 1.80, r3= 4.54, r4= 5.04,  &end
#
# 597 TYR HA 598 GLU H 3.03
 &rst
  ixpk= 0, nxpk= 0, iat= 708, 727, r1= 1.30, r2= 1.80, r3= 3.03, r4= 3.53,  &end
#
# 596 ASN HA 597 TYR HA 4.59
 &rst
  ixpk= 0, nxpk= 0, iat= 694, 708, r1= 1.30, r2= 1.80, r3= 4.59, r4= 5.09,  &end
#
# 590 LYS HA 597 TYR HA 3.31
 &rst
  ixpk= 0, nxpk= 0, iat= 593, 708, r1= 1.30, r2= 1.80, r3= 3.31, r4= 3.81,  &end
#
# 588 VAL QG1 597 TYR HA 4.22
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 708, r1= 1.30, r2= 1.80, r3= 5.07, r4= 5.57,
 igr1= 565, 566, 567,
 &end
#
# 563 PHE HA 573 TYR H 4.75
 &rst
  ixpk= 0, nxpk= 0, iat= 167, 342, r1= 1.30, r2= 1.80, r3= 4.75, r4= 5.25,  &end
#
# 563 PHE HA 564 ALA QB 4.22
 &rst
  ixpk= 0, nxpk= 0, iat= 167,  -1, r1= 1.30, r2= 1.80, r3= 5.07, r4= 5.57,
 igr2= 189, 190, 191,
 &end
#
# 563 PHE HA 575 ALA QB 4.46
 &rst
  ixpk= 0, nxpk= 0, iat= 167,  -1, r1= 1.30, r2= 1.80, r3= 5.36, r4= 5.86,
 igr2= 391, 392, 393,
 &end
#
# 578 GLU H 589 VAL HA 3.32
 &rst
  ixpk= 0, nxpk= 0, iat= 428, 577, r1= 1.30, r2= 1.80, r3= 3.32, r4= 3.82,  &end
#
# 588 VAL HB 589 VAL HA 4.52
 &rst
  ixpk= 0, nxpk= 0, iat= 563, 577, r1= 1.30, r2= 1.80, r3= 4.52, r4= 5.02,  &end
#
# 577 VAL QG2 589 VAL HA 3.86
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 577, r1= 1.30, r2= 1.80, r3= 4.64, r4= 5.14,
 igr1= 422, 423, 424,
 &end
#
# 589 VAL HA 589 VAL QG2 3.94
 &rst
  ixpk= 0, nxpk= 0, iat= 577,  -1, r1= 1.30, r2= 1.80, r3= 4.73, r4= 5.23,
 igr2= 585, 586, 587,
 &end
#
# 573 TYR HA 574 ARG H 3.12
 &rst
  ixpk= 0, nxpk= 0, iat= 344, 363, r1= 1.30, r2= 1.80, r3= 3.12, r4= 3.62,  &end
#
# 563 PHE QD 573 TYR HA 4.28
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 344, r1= 1.30, r2= 1.80, r3= 4.80, r4= 5.30,
 igr1= 173, 181,
 &end
#
# 563 PHE QE 573 TYR HA 4.72
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 344, r1= 1.30, r2= 1.80, r3= 5.30, r4= 5.80,
 igr1= 175, 179,
 &end
#
# 573 TYR HA 574 ARG HA 4.54
 &rst
  ixpk= 0, nxpk= 0, iat= 344, 365, r1= 1.30, r2= 1.80, r3= 4.54, r4= 5.04,  &end
#
# 573 TYR HA 574 ARG QB 4.64
 &rst
  ixpk= 0, nxpk= 0, iat= 344,  -1, r1= 1.30, r2= 1.80, r3= 5.21, r4= 5.71,
 igr2= 367, 368,
 &end
#
# 586 THR HB 587 ALA H 3.18
 &rst
  ixpk= 0, nxpk= 0, iat= 539, 549, r1= 1.30, r2= 1.80, r3= 3.18, r4= 3.68,  &end
#
# 586 THR HB 599 GLU HA 3.62
 &rst
  ixpk= 0, nxpk= 0, iat= 539, 744, r1= 1.30, r2= 1.80, r3= 3.62, r4= 4.12,  &end
#
# 586 THR HB 599 GLU QG 3.68
 &rst
  ixpk= 0, nxpk= 0, iat= 539,  -1, r1= 1.30, r2= 1.80, r3= 4.13, r4= 4.63,
 igr2= 749, 750,
 &end
#
# 586 THR HB 599 GLU QB 3.40
 &rst
  ixpk= 0, nxpk= 0, iat= 539,  -1, r1= 1.30, r2= 1.80, r3= 3.82, r4= 4.32,
 igr2= 746, 747,
 &end
#
# 592 ILE HA 592 ILE HG13 3.75
 &rst
  ixpk= 0, nxpk= 0, iat= 635, 644, r1= 1.30, r2= 1.80, r3= 3.75, r4= 4.25,  &end
#
# 592 ILE HA 592 ILE HG12 3.77
 &rst
  ixpk= 0, nxpk= 0, iat= 635, 643, r1= 1.30, r2= 1.80, r3= 3.77, r4= 4.27,  &end
#
# 590 LYS HG2 592 ILE HA 4.42
 &rst
  ixpk= 0, nxpk= 0, iat= 598, 635, r1= 1.30, r2= 1.80, r3= 4.42, r4= 4.92,  &end
#
# 577 VAL HA 578 GLU H 3.07
 &rst
  ixpk= 0, nxpk= 0, iat= 414, 428, r1= 1.30, r2= 1.80, r3= 3.07, r4= 3.57,  &end
#
# 577 VAL HA 579 ALA H 4.26
 &rst
  ixpk= 0, nxpk= 0, iat= 414, 443, r1= 1.30, r2= 1.80, r3= 4.26, r4= 4.76,  &end
#
# 577 VAL HA 589 VAL HA 3.36
 &rst
  ixpk= 0, nxpk= 0, iat= 414, 577, r1= 1.30, r2= 1.80, r3= 3.36, r4= 3.86,  &end
#
# 577 VAL HA 578 GLU HA 4.47
 &rst
  ixpk= 0, nxpk= 0, iat= 414, 430, r1= 1.30, r2= 1.80, r3= 4.47, r4= 4.97,  &end
#
# 577 VAL HA 589 VAL HB 4.31
 &rst
  ixpk= 0, nxpk= 0, iat= 414, 579, r1= 1.30, r2= 1.80, r3= 4.31, r4= 4.81,  &end
#
# 577 VAL HA 587 ALA QB 5.18
 &rst
  ixpk= 0, nxpk= 0, iat= 414,  -1, r1= 1.30, r2= 1.80, r3= 6.22, r4= 6.72,
 igr2= 553, 554, 555,
 &end
#
# 558 PRO HA 559 GLY H 2.91
 &rst
  ixpk= 0, nxpk= 0, iat= 116, 120, r1= 1.30, r2= 1.80, r3= 2.91, r4= 3.41,  &end
#
# 558 PRO HA 560 ASP H 4.14
 &rst
  ixpk= 0, nxpk= 0, iat= 116, 127, r1= 1.30, r2= 1.80, r3= 4.14, r4= 4.64,  &end
#
# 558 PRO HA 578 GLU HA 4.19
 &rst
  ixpk= 0, nxpk= 0, iat= 116, 430, r1= 1.30, r2= 1.80, r3= 4.19, r4= 4.69,  &end
#
# 558 PRO HA 580 LEU HG 3.65
 &rst
  ixpk= 0, nxpk= 0, iat= 116, 460, r1= 1.30, r2= 1.80, r3= 3.65, r4= 4.15,  &end
#
# 594 TYR HA 594 TYR QD 4.52
 &rst
  ixpk= 0, nxpk= 0, iat= 666,  -1, r1= 1.30, r2= 1.80, r3= 5.07, r4= 5.57,
 igr2= 672, 681,
 &end
#
# 591 PHE HA 594 TYR QD 4.45
 &rst
  ixpk= 0, nxpk= 0, iat= 615,  -1, r1= 1.30, r2= 1.80, r3= 4.99, r4= 5.49,
 igr2= 672, 681,
 &end
#
# 567 TRP HH2 568 GLU HB3 5.50
 &rst
  ixpk= 0, nxpk= 0, iat= 250, 264, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
# 565 LEU H 565 LEU QD2 4.77
 &rst
  ixpk= 0, nxpk= 0, iat= 195,  -1, r1= 1.30, r2= 1.80, r3= 5.73, r4= 6.23,
 igr2= 208, 209, 210,
 &end
#
# 565 LEU HB2 565 LEU QD1 4.03
 &rst
  ixpk= 0, nxpk= 0, iat= 199,  -1, r1= 1.30, r2= 1.80, r3= 4.84, r4= 5.34,
 igr2= 204, 205, 206,
 &end
#
# 565 LEU HB2 565 LEU QD2 4.03
 &rst
  ixpk= 0, nxpk= 0, iat= 199,  -1, r1= 1.30, r2= 1.80, r3= 4.84, r4= 5.34,
 igr2= 208, 209, 210,
 &end
#
# 565 LEU QD1 600 VAL QQG 5.48
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 760, r1= 1.30, r2= 1.80, r3= 8.78, r4= 9.28,
 igr1= 204, 205, 206,
 &end
#
# 565 LEU QD2 600 VAL QQG 5.48
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 760, r1= 1.30, r2= 1.80, r3= 8.78, r4= 9.28,
 igr1= 208, 209, 210,
 &end
#
# 556 TRP HZ2 605 ILE QD1 4.78
 &rst
  ixpk= 0, nxpk= 0, iat=  73,  -1, r1= 1.30, r2= 1.80, r3= 5.74, r4= 6.24,
 igr2= 849, 850, 851,
 &end
#
# 605 ILE HA 605 ILE QD1 4.04
 &rst
  ixpk= 0, nxpk= 0, iat= 838,  -1, r1= 1.30, r2= 1.80, r3= 4.85, r4= 5.35,
 igr2= 849, 850, 851,
 &end
#
# 602 LEU QB 605 ILE QD1 4.12
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.55, r4= 6.05,
 igr1= 796, 797,
 igr2= 849, 850, 851,
 &end
#
# 587 ALA QB 605 ILE QD1 2.97
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.28, r4= 4.78,
 igr1= 553, 554, 555,
 igr2= 849, 850, 851,
 &end
#
# 578 GLU H 579 ALA QB 4.49
 &rst
  ixpk= 0, nxpk= 0, iat= 428,  -1, r1= 1.30, r2= 1.80, r3= 5.39, r4= 5.89,
 igr2= 447, 448, 449,
 &end
#
# 579 ALA QB 580 LEU H 3.41
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 453, r1= 1.30, r2= 1.80, r3= 4.10, r4= 4.60,
 igr1= 447, 448, 449,
 &end
#
# 579 ALA QB 588 VAL H 3.74
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 559, r1= 1.30, r2= 1.80, r3= 4.49, r4= 4.99,
 igr1= 447, 448, 449,
 &end
#
# 579 ALA QB 581 HIS H 5.11
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 472, r1= 1.30, r2= 1.80, r3= 6.14, r4= 6.64,
 igr1= 447, 448, 449,
 &end
#
# 579 ALA H 579 ALA QB 3.08
 &rst
  ixpk= 0, nxpk= 0, iat= 443,  -1, r1= 1.30, r2= 1.80, r3= 3.70, r4= 4.20,
 igr2= 447, 448, 449,
 &end
#
# 579 ALA QB 587 ALA HA 5.23
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 551, r1= 1.30, r2= 1.80, r3= 6.28, r4= 6.78,
 igr1= 447, 448, 449,
 &end
#
# 579 ALA QB 588 VAL HB 2.74
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 563, r1= 1.30, r2= 1.80, r3= 3.29, r4= 3.79,
 igr1= 447, 448, 449,
 &end
#
# 579 ALA QB 588 VAL QG2 2.79
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.02, r4= 4.52,
 igr1= 447, 448, 449,
 igr2= 569, 570, 571,
 &end
#
# 587 ALA QB 600 VAL H 3.96
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 757, r1= 1.30, r2= 1.80, r3= 4.76, r4= 5.26,
 igr1= 553, 554, 555,
 &end
#
# 600 VAL H 600 VAL QQG 3.66
 &rst
  ixpk= 0, nxpk= 0, iat= 757, 760, r1= 1.30, r2= 1.80, r3= 5.86, r4= 6.36,  &end
#
# 587 ALA H 587 ALA QB 3.15
 &rst
  ixpk= 0, nxpk= 0, iat= 549,  -1, r1= 1.30, r2= 1.80, r3= 3.78, r4= 4.28,
 igr2= 553, 554, 555,
 &end
#
# 587 ALA QB 588 VAL H 2.98
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 559, r1= 1.30, r2= 1.80, r3= 3.58, r4= 4.08,
 igr1= 553, 554, 555,
 &end
#
# 600 VAL QQG 604 ASN H 4.16
 &rst
  ixpk= 0, nxpk= 0, iat= 760, 822, r1= 1.30, r2= 1.80, r3= 6.36, r4= 6.86,  &end
#
# 581 HIS H 587 ALA QB 4.29
 &rst
  ixpk= 0, nxpk= 0, iat= 472,  -1, r1= 1.30, r2= 1.80, r3= 5.15, r4= 5.65,
 igr2= 553, 554, 555,
 &end
#
# 565 LEU H 600 VAL QQG 3.61
 &rst
  ixpk= 0, nxpk= 0, iat= 195, 760, r1= 1.30, r2= 1.80, r3= 5.81, r4= 6.31,  &end
#
# 599 GLU HA 600 VAL QQG 3.86
 &rst
  ixpk= 0, nxpk= 0, iat= 744, 760, r1= 1.30, r2= 1.80, r3= 6.06, r4= 6.56,  &end
#
# 600 VAL QQG 605 ILE HA 4.25
 &rst
  ixpk= 0, nxpk= 0, iat= 760, 838, r1= 1.30, r2= 1.80, r3= 6.45, r4= 6.95,  &end
#
# 600 VAL HA 600 VAL QQG 3.07
 &rst
  ixpk= 0, nxpk= 0, iat= 759, 760, r1= 1.30, r2= 1.80, r3= 5.27, r4= 5.77,  &end
#
# 600 VAL QQG 601 LEU HA 4.60
 &rst
  ixpk= 0, nxpk= 0, iat= 760, 775, r1= 1.30, r2= 1.80, r3= 6.80, r4= 7.30,  &end
#
# 600 VAL QQG 604 ASN HB2 3.75
 &rst
  ixpk= 0, nxpk= 0, iat= 760, 826, r1= 1.30, r2= 1.80, r3= 5.95, r4= 6.45,  &end
#
# 600 VAL QQG 604 ASN HB3 3.75
 &rst
  ixpk= 0, nxpk= 0, iat= 760, 827, r1= 1.30, r2= 1.80, r3= 5.95, r4= 6.45,  &end
#
# 598 GLU QB 600 VAL QQG 4.37
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 760, r1= 1.30, r2= 1.80, r3= 7.11, r4= 7.61,
 igr1= 731, 732,
 &end
#
# 580 LEU QB 587 ALA QB 3.38
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.56, r4= 5.06,
 igr1= 457, 458,
 igr2= 553, 554, 555,
 &end
#
# 600 VAL QQG 605 ILE QG1 2.88
 &rst
  ixpk= 0, nxpk= 0, iat= 760,  -1, r1= 1.30, r2= 1.80, r3= 5.43, r4= 5.93,
 igr2= 846, 847,
 &end
#
# 587 ALA QB 605 ILE QG1 3.51
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.73, r4= 5.23,
 igr1= 553, 554, 555,
 igr2= 846, 847,
 &end
#
# 589 VAL QG2 600 VAL QQG 2.98
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 760, r1= 1.30, r2= 1.80, r3= 5.78, r4= 6.28,
 igr1= 585, 586, 587,
 &end
#
# 564 ALA H 564 ALA QB 3.10
 &rst
  ixpk= 0, nxpk= 0, iat= 185,  -1, r1= 1.30, r2= 1.80, r3= 3.72, r4= 4.22,
 igr2= 189, 190, 191,
 &end
#
# 563 PHE H 564 ALA QB 5.36
 &rst
  ixpk= 0, nxpk= 0, iat= 165,  -1, r1= 1.30, r2= 1.80, r3= 6.44, r4= 6.94,
 igr2= 189, 190, 191,
 &end
#
# 564 ALA QB 605 ILE HA 3.51
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 838, r1= 1.30, r2= 1.80, r3= 4.22, r4= 4.72,
 igr1= 189, 190, 191,
 &end
#
# 564 ALA QB 605 ILE QG2 3.15
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.54, r4= 5.04,
 igr1= 189, 190, 191,
 igr2= 842, 843, 844,
 &end
#
# 585 MET HA 601 LEU QQD 3.58
 &rst
  ixpk= 0, nxpk= 0, iat= 520, 779, r1= 1.30, r2= 1.80, r3= 5.78, r4= 6.28,  &end
#
# 585 MET QB 601 LEU QQD 4.08
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 779, r1= 1.30, r2= 1.80, r3= 6.78, r4= 7.28,
 igr1= 522, 523,
 &end
#
# 601 LEU QQD 602 LEU HG 3.55
 &rst
  ixpk= 0, nxpk= 0, iat= 779, 799, r1= 1.30, r2= 1.80, r3= 5.75, r4= 6.25,  &end
#
# 565 LEU H 565 LEU HG 4.73
 &rst
  ixpk= 0, nxpk= 0, iat= 195, 202, r1= 1.30, r2= 1.80, r3= 4.73, r4= 5.23,  &end
#
# 565 LEU HG 604 ASN HA 5.11
 &rst
  ixpk= 0, nxpk= 0, iat= 202, 824, r1= 1.30, r2= 1.80, r3= 5.11, r4= 5.61,  &end
#
# 565 LEU HG 570 ASN HA 3.70
 &rst
  ixpk= 0, nxpk= 0, iat= 202, 288, r1= 1.30, r2= 1.80, r3= 3.70, r4= 4.20,  &end
#
# 556 TRP HE1 602 LEU QQD 4.62
 &rst
  ixpk= 0, nxpk= 0, iat=  70, 798, r1= 1.30, r2= 1.80, r3= 6.82, r4= 7.32,  &end
#
# 587 ALA H 602 LEU QQD 4.16
 &rst
  ixpk= 0, nxpk= 0, iat= 549, 798, r1= 1.30, r2= 1.80, r3= 6.36, r4= 6.86,  &end
#
# 588 VAL H 602 LEU QQD 4.88
 &rst
  ixpk= 0, nxpk= 0, iat= 559, 798, r1= 1.30, r2= 1.80, r3= 7.08, r4= 7.58,  &end
#
# 602 LEU H 602 LEU QQD 3.75
 &rst
  ixpk= 0, nxpk= 0, iat= 792, 798, r1= 1.30, r2= 1.80, r3= 5.95, r4= 6.45,  &end
#
# 556 TRP H 602 LEU QQD 4.61
 &rst
  ixpk= 0, nxpk= 0, iat=  60, 798, r1= 1.30, r2= 1.80, r3= 6.81, r4= 7.31,  &end
#
# 556 TRP HD1 602 LEU QQD 3.23
 &rst
  ixpk= 0, nxpk= 0, iat=  68, 798, r1= 1.30, r2= 1.80, r3= 5.43, r4= 5.93,  &end
#
# 602 LEU HA 602 LEU QQD 2.87
 &rst
  ixpk= 0, nxpk= 0, iat= 794, 798, r1= 1.30, r2= 1.80, r3= 5.07, r4= 5.57,  &end
#
# 602 LEU QB 602 LEU QQD 2.83
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 798, r1= 1.30, r2= 1.80, r3= 5.38, r4= 5.88,
 igr1= 796, 797,
 &end
#
# 602 LEU QQD 605 ILE QD1 2.90
 &rst
  ixpk= 0, nxpk= 0, iat= 798,  -1, r1= 1.30, r2= 1.80, r3= 5.68, r4= 6.18,
 igr2= 849, 850, 851,
 &end
#
# 577 VAL QG2 578 GLU H 3.86
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 428, r1= 1.30, r2= 1.80, r3= 4.64, r4= 5.14,
 igr1= 422, 423, 424,
 &end
#
# 577 VAL H 577 VAL QG2 2.95
 &rst
  ixpk= 0, nxpk= 0, iat= 412,  -1, r1= 1.30, r2= 1.80, r3= 3.54, r4= 4.04,
 igr2= 422, 423, 424,
 &end
#
# 562 CYS H 577 VAL QG2 4.49
 &rst
  ixpk= 0, nxpk= 0, iat= 154,  -1, r1= 1.30, r2= 1.80, r3= 5.39, r4= 5.89,
 igr2= 422, 423, 424,
 &end
#
# 560 ASP H 577 VAL QG2 3.70
 &rst
  ixpk= 0, nxpk= 0, iat= 127,  -1, r1= 1.30, r2= 1.80, r3= 4.44, r4= 4.94,
 igr2= 422, 423, 424,
 &end
#
# 556 TRP HZ2 577 VAL QG2 5.01
 &rst
  ixpk= 0, nxpk= 0, iat=  73,  -1, r1= 1.30, r2= 1.80, r3= 6.02, r4= 6.52,
 igr2= 422, 423, 424,
 &end
#
# 576 GLU HA 577 VAL QG2 4.16
 &rst
  ixpk= 0, nxpk= 0, iat= 399,  -1, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50,
 igr2= 422, 423, 424,
 &end
#
# 560 ASP HA 577 VAL QG2 4.85
 &rst
  ixpk= 0, nxpk= 0, iat= 129,  -1, r1= 1.30, r2= 1.80, r3= 5.82, r4= 6.32,
 igr2= 422, 423, 424,
 &end
#
# 558 PRO HA 577 VAL QG2 4.45
 &rst
  ixpk= 0, nxpk= 0, iat= 116,  -1, r1= 1.30, r2= 1.80, r3= 5.34, r4= 5.84,
 igr2= 422, 423, 424,
 &end
#
# 577 VAL HA 577 VAL QG2 3.11
 &rst
  ixpk= 0, nxpk= 0, iat= 414,  -1, r1= 1.30, r2= 1.80, r3= 3.73, r4= 4.23,
 igr2= 422, 423, 424,
 &end
#
# 577 VAL QG2 587 ALA QB 4.03
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.81, r4= 6.31,
 igr1= 422, 423, 424,
 igr2= 553, 554, 555,
 &end
#
# 577 VAL QG2 605 ILE QG2 3.72
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.37, r4= 5.87,
 igr1= 422, 423, 424,
 igr2= 842, 843, 844,
 &end
#
# 577 VAL QG2 605 ILE QD1 3.37
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.86, r4= 5.36,
 igr1= 422, 423, 424,
 igr2= 849, 850, 851,
 &end
#
# 559 GLY H 577 VAL QG1 3.28
 &rst
  ixpk= 0, nxpk= 0, iat= 120,  -1, r1= 1.30, r2= 1.80, r3= 3.94, r4= 4.44,
 igr2= 418, 419, 420,
 &end
#
# 577 VAL QG1 578 GLU H 3.66
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 428, r1= 1.30, r2= 1.80, r3= 4.40, r4= 4.90,
 igr1= 418, 419, 420,
 &end
#
# 577 VAL QG1 580 LEU H 3.63
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 453, r1= 1.30, r2= 1.80, r3= 4.36, r4= 4.86,
 igr1= 418, 419, 420,
 &end
#
# 560 ASP H 577 VAL QG1 3.81
 &rst
  ixpk= 0, nxpk= 0, iat= 127,  -1, r1= 1.30, r2= 1.80, r3= 4.58, r4= 5.08,
 igr2= 418, 419, 420,
 &end
#
# 577 VAL QG1 579 ALA H 3.36
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 443, r1= 1.30, r2= 1.80, r3= 4.04, r4= 4.54,
 igr1= 418, 419, 420,
 &end
#
# 577 VAL QG1 589 VAL HA 4.20
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 577, r1= 1.30, r2= 1.80, r3= 5.04, r4= 5.54,
 igr1= 418, 419, 420,
 &end
#
# 560 ASP HA 577 VAL QG1 5.14
 &rst
  ixpk= 0, nxpk= 0, iat= 129,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2= 418, 419, 420,
 &end
#
# 577 VAL QG1 580 LEU HA 5.43
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 455, r1= 1.30, r2= 1.80, r3= 6.52, r4= 7.02,
 igr1= 418, 419, 420,
 &end
#
# 559 GLY HA3 577 VAL QG1 4.87
 &rst
  ixpk= 0, nxpk= 0, iat= 123,  -1, r1= 1.30, r2= 1.80, r3= 5.85, r4= 6.35,
 igr2= 418, 419, 420,
 &end
#
# 558 PRO HA 577 VAL QG1 3.23
 &rst
  ixpk= 0, nxpk= 0, iat= 116,  -1, r1= 1.30, r2= 1.80, r3= 3.88, r4= 4.38,
 igr2= 418, 419, 420,
 &end
#
# 577 VAL HA 577 VAL QG1 3.14
 &rst
  ixpk= 0, nxpk= 0, iat= 414,  -1, r1= 1.30, r2= 1.80, r3= 3.77, r4= 4.27,
 igr2= 418, 419, 420,
 &end
#
# 556 TRP HB3 577 VAL QG1 4.21
 &rst
  ixpk= 0, nxpk= 0, iat=  65,  -1, r1= 1.30, r2= 1.80, r3= 5.06, r4= 5.56,
 igr2= 418, 419, 420,
 &end
#
# 558 PRO HB3 577 VAL QG1 3.92
 &rst
  ixpk= 0, nxpk= 0, iat= 114,  -1, r1= 1.30, r2= 1.80, r3= 4.71, r4= 5.21,
 igr2= 418, 419, 420,
 &end
#
# 577 VAL QG1 579 ALA QB 4.58
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr1= 418, 419, 420,
 igr2= 447, 448, 449,
 &end
#
# 577 VAL QG1 605 ILE QD1 4.59
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.62, r4= 7.12,
 igr1= 418, 419, 420,
 igr2= 849, 850, 851,
 &end
#
# 575 ALA QB 590 LYS H 3.67
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 591, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,
 igr1= 391, 392, 393,
 &end
#
# 597 TYR HB3 598 GLU H 4.22
 &rst
  ixpk= 0, nxpk= 0, iat= 711, 727, r1= 1.30, r2= 1.80, r3= 4.22, r4= 4.72,  &end
#
# 597 TYR H 597 TYR HB3 4.06
 &rst
  ixpk= 0, nxpk= 0, iat= 706, 711, r1= 1.30, r2= 1.80, r3= 4.06, r4= 4.56,  &end
#
# 571 LYS QG 571 LYS QE 3.94
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.96, r4= 5.46,
 igr1= 307, 308,
 igr2= 313, 314,
 &end
#
# 575 ALA HA 592 ILE QG2 4.60
 &rst
  ixpk= 0, nxpk= 0, iat= 389,  -1, r1= 1.30, r2= 1.80, r3= 5.52, r4= 6.02,
 igr2= 639, 640, 641,
 &end
#
# 608 ILE HA 609 LEU HA 4.67
 &rst
  ixpk= 0, nxpk= 0, iat= 893, 912, r1= 1.30, r2= 1.80, r3= 4.67, r4= 5.17,  &end
#
# 560 ASP HA 561 GLU QB 4.72
 &rst
  ixpk= 0, nxpk= 0, iat= 129,  -1, r1= 1.30, r2= 1.80, r3= 5.30, r4= 5.80,
 igr2= 143, 144,
 &end
#
# 592 ILE H 592 ILE HG13 3.86
 &rst
  ixpk= 0, nxpk= 0, iat= 633, 644, r1= 1.30, r2= 1.80, r3= 3.86, r4= 4.36,  &end
#
# 596 ASN H 596 ASN QB 4.09
 &rst
  ixpk= 0, nxpk= 0, iat= 692,  -1, r1= 1.30, r2= 1.80, r3= 4.59, r4= 5.09,
 igr2= 696, 697,
 &end
#
# 563 PHE HA 608 ILE QD1 4.62
 &rst
  ixpk= 0, nxpk= 0, iat= 167,  -1, r1= 1.30, r2= 1.80, r3= 5.55, r4= 6.05,
 igr2= 904, 905, 906,
 &end
#
# 561 GLU QG 608 ILE QG1 5.34
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.73, r4= 7.23,
 igr1= 146, 147,
 igr2= 901, 902,
 &end
#
# 574 ARG QB 592 ILE H 4.44
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 633, r1= 1.30, r2= 1.80, r3= 4.98, r4= 5.48,
 igr1= 367, 368,
 &end
#
# 574 ARG QB 575 ALA H 3.74
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 387, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
 igr1= 367, 368,
 &end
#
# 607 PRO HB2 609 LEU QB 5.50
 &rst
  ixpk= 0, nxpk= 0, iat= 884,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2= 914, 915,
 &end
#
# 607 PRO HB2 608 ILE QG1 5.50
 &rst
  ixpk= 0, nxpk= 0, iat= 884,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2= 901, 902,
 &end
#
# 585 MET QG 586 THR H 4.91
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 535, r1= 1.30, r2= 1.80, r3= 5.51, r4= 6.01,
 igr1= 525, 526,
 &end
#
# 558 PRO HA 580 LEU QB 5.00
 &rst
  ixpk= 0, nxpk= 0, iat= 116,  -1, r1= 1.30, r2= 1.80, r3= 5.61, r4= 6.11,
 igr2= 457, 458,
 &end
#
# 601 LEU QB 602 LEU HA 5.47
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 794, r1= 1.30, r2= 1.80, r3= 6.14, r4= 6.64,
 igr1= 777, 778,
 &end
#
# 590 LYS HE3 595 GLY HA2 5.31
 &rst
  ixpk= 0, nxpk= 0, iat= 605, 687, r1= 1.30, r2= 1.80, r3= 5.31, r4= 5.81,  &end
#
# 590 LYS HD2 595 GLY HA3 5.50
 &rst
  ixpk= 0, nxpk= 0, iat= 601, 688, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
# 586 THR HA 602 LEU HA 4.72
 &rst
  ixpk= 0, nxpk= 0, iat= 537, 794, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,  &end
#
# 567 TRP HA 569 ASP H 4.73
 &rst
  ixpk= 0, nxpk= 0, iat= 237, 274, r1= 1.30, r2= 1.80, r3= 4.73, r4= 5.23,  &end
#
# 566 TYR QD 567 TRP HA 5.24
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 237, r1= 1.30, r2= 1.80, r3= 5.88, r4= 6.38,
 igr1= 222, 231,
 &end
#
# 578 GLU QB 578 GLU QG 2.63
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 3.31, r4= 3.81,
 igr1= 432, 433,
 igr2= 435, 436,
 &end
#
# 601 LEU QB 601 LEU QQD 2.49
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 779, r1= 1.30, r2= 1.80, r3= 4.99, r4= 5.49,
 igr1= 777, 778,
 &end
#
# 588 VAL QG1 597 TYR HB3 3.61
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 711, r1= 1.30, r2= 1.80, r3= 4.34, r4= 4.84,
 igr1= 565, 566, 567,
 &end
#
# 586 THR QG2 601 LEU HA 2.89
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 775, r1= 1.30, r2= 1.80, r3= 3.47, r4= 3.97,
 igr1= 541, 542, 543,
 &end
#
# 586 THR H 586 THR QG2 3.71
 &rst
  ixpk= 0, nxpk= 0, iat= 535,  -1, r1= 1.30, r2= 1.80, r3= 4.46, r4= 4.96,
 igr2= 541, 542, 543,
 &end
#
# 586 THR QG2 602 LEU H 4.42
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 792, r1= 1.30, r2= 1.80, r3= 5.31, r4= 5.81,
 igr1= 541, 542, 543,
 &end
#
# 586 THR QG2 587 ALA H 3.72
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 549, r1= 1.30, r2= 1.80, r3= 4.47, r4= 4.97,
 igr1= 541, 542, 543,
 &end
#
# 586 THR QG2 600 VAL H 4.06
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 757, r1= 1.30, r2= 1.80, r3= 4.88, r4= 5.38,
 igr1= 541, 542, 543,
 &end
#
# 585 MET QE 586 THR QG2 2.98
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.30, r4= 4.80,
 igr1= 529, 530, 531,
 igr2= 541, 542, 543,
 &end
#
# 577 VAL QG1 588 VAL HB 5.38
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 563, r1= 1.30, r2= 1.80, r3= 6.46, r4= 6.96,
 igr1= 418, 419, 420,
 &end
#
# 574 ARG H 574 ARG QB 3.34
 &rst
  ixpk= 0, nxpk= 0, iat= 363,  -1, r1= 1.30, r2= 1.80, r3= 3.75, r4= 4.25,
 igr2= 367, 368,
 &end
#
# 586 THR QG2 599 GLU QB 3.78
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.10, r4= 5.60,
 igr1= 541, 542, 543,
 igr2= 746, 747,
 &end
#
# 599 GLU QB 600 VAL QQG 4.65
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 760, r1= 1.30, r2= 1.80, r3= 7.42, r4= 7.92,
 igr1= 746, 747,
 &end
#
# 586 THR HA 599 GLU QB 4.78
 &rst
  ixpk= 0, nxpk= 0, iat= 537,  -1, r1= 1.30, r2= 1.80, r3= 5.37, r4= 5.87,
 igr2= 746, 747,
 &end
#
# 599 GLU QB 599 GLU QG 2.65
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 3.34, r4= 3.84,
 igr1= 746, 747,
 igr2= 749, 750,
 &end
#
# 565 LEU HB3 566 TYR HA 5.30
 &rst
  ixpk= 0, nxpk= 0, iat= 200, 216, r1= 1.30, r2= 1.80, r3= 5.30, r4= 5.80,  &end
#
# 565 LEU HB2 604 ASN HA 4.88
 &rst
  ixpk= 0, nxpk= 0, iat= 199, 824, r1= 1.30, r2= 1.80, r3= 4.88, r4= 5.38,  &end
#
# 585 MET HA 585 MET QB 3.01
 &rst
  ixpk= 0, nxpk= 0, iat= 520,  -1, r1= 1.30, r2= 1.80, r3= 3.38, r4= 3.88,
 igr2= 522, 523,
 &end
#
# 602 LEU QB 602 LEU HG 2.97
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 799, r1= 1.30, r2= 1.80, r3= 3.33, r4= 3.83,
 igr1= 796, 797,
 &end
#
# 587 ALA H 600 VAL HB 4.97
 &rst
  ixpk= 0, nxpk= 0, iat= 549, 761, r1= 1.30, r2= 1.80, r3= 4.97, r4= 5.47,  &end
#
# 578 GLU QB 579 ALA H 3.78
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 443, r1= 1.30, r2= 1.80, r3= 4.24, r4= 4.74,
 igr1= 432, 433,
 &end
#
# 569 ASP HB3 571 LYS HB2 4.85
 &rst
  ixpk= 0, nxpk= 0, iat= 279, 304, r1= 1.30, r2= 1.80, r3= 4.85, r4= 5.35,  &end
#
# 571 LYS H 571 LYS HB2 4.04
 &rst
  ixpk= 0, nxpk= 0, iat= 300, 304, r1= 1.30, r2= 1.80, r3= 4.04, r4= 4.54,  &end
#
# 571 LYS HB2 572 PHE H 4.52
 &rst
  ixpk= 0, nxpk= 0, iat= 304, 322, r1= 1.30, r2= 1.80, r3= 4.52, r4= 5.02,  &end
#
# 598 GLU QG 599 GLU H 4.51
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 742, r1= 1.30, r2= 1.80, r3= 5.06, r4= 5.56,
 igr1= 734, 735,
 &end
#
# 585 MET QB 586 THR QG2 4.17
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.62, r4= 6.12,
 igr1= 522, 523,
 igr2= 541, 542, 543,
 &end
#
# 592 ILE HB 592 ILE QD1 3.36
 &rst
  ixpk= 0, nxpk= 0, iat= 637,  -1, r1= 1.30, r2= 1.80, r3= 4.04, r4= 4.54,
 igr2= 646, 647, 648,
 &end
#
# 592 ILE HA 592 ILE QD1 3.82
 &rst
  ixpk= 0, nxpk= 0, iat= 635,  -1, r1= 1.30, r2= 1.80, r3= 4.59, r4= 5.09,
 igr2= 646, 647, 648,
 &end
#
# 592 ILE QG2 592 ILE QD1 2.40
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 3.46, r4= 3.96,
 igr1= 639, 640, 641,
 igr2= 646, 647, 648,
 &end
#
# 587 ALA QB 602 LEU QQD 2.54
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 798, r1= 1.30, r2= 1.80, r3= 5.25, r4= 5.75,
 igr1= 553, 554, 555,
 &end
#
# 565 LEU HG 566 TYR H 4.73
 &rst
  ixpk= 0, nxpk= 0, iat= 202, 214, r1= 1.30, r2= 1.80, r3= 4.73, r4= 5.23,  &end
#
# 565 LEU HA 565 LEU HG 3.99
 &rst
  ixpk= 0, nxpk= 0, iat= 197, 202, r1= 1.30, r2= 1.80, r3= 3.99, r4= 4.49,  &end
#
# 565 LEU HG 600 VAL QQG 5.03
 &rst
  ixpk= 0, nxpk= 0, iat= 202, 760, r1= 1.30, r2= 1.80, r3= 7.23, r4= 7.73,  &end
#
# 564 ALA QB 565 LEU HA 5.04
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 197, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55,
 igr1= 189, 190, 191,
 &end
#
# 565 LEU HA 600 VAL QQG 5.42
 &rst
  ixpk= 0, nxpk= 0, iat= 197, 760, r1= 1.30, r2= 1.80, r3= 7.62, r4= 8.12,  &end
#
# 565 LEU HB2 600 VAL QQG 4.28
 &rst
  ixpk= 0, nxpk= 0, iat= 199, 760, r1= 1.30, r2= 1.80, r3= 6.48, r4= 6.98,  &end
#
# 565 LEU HB3 600 VAL QQG 4.75
 &rst
  ixpk= 0, nxpk= 0, iat= 200, 760, r1= 1.30, r2= 1.80, r3= 6.95, r4= 7.45,  &end
#
# 591 PHE QB 594 TYR HA 4.85
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 666, r1= 1.30, r2= 1.80, r3= 5.44, r4= 5.94,
 igr1= 617, 618,
 &end
#
# 575 ALA HA 591 PHE QB 4.92
 &rst
  ixpk= 0, nxpk= 0, iat= 389,  -1, r1= 1.30, r2= 1.80, r3= 5.52, r4= 6.02,
 igr2= 617, 618,
 &end
#
# 573 TYR HB3 591 PHE QB 4.92
 &rst
  ixpk= 0, nxpk= 0, iat= 347,  -1, r1= 1.30, r2= 1.80, r3= 5.52, r4= 6.02,
 igr2= 617, 618,
 &end
#
# 569 ASP HB2 570 ASN HB3 5.33
 &rst
  ixpk= 0, nxpk= 0, iat= 278, 291, r1= 1.30, r2= 1.80, r3= 5.33, r4= 5.83,  &end
#
# 565 LEU HG 570 ASN HB2 5.50
 &rst
  ixpk= 0, nxpk= 0, iat= 202, 290, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
# 565 LEU HG 572 PHE QD 5.46
 &rst
  ixpk= 0, nxpk= 0, iat= 202,  -1, r1= 1.30, r2= 1.80, r3= 6.13, r4= 6.63,
 igr2= 330, 338,
 &end
#
# 565 LEU HG 572 PHE QE 5.50
 &rst
  ixpk= 0, nxpk= 0, iat= 202,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2= 332, 336,
 &end
#
# 565 LEU HG 571 LYS H 5.31
 &rst
  ixpk= 0, nxpk= 0, iat= 202, 300, r1= 1.30, r2= 1.80, r3= 5.31, r4= 5.81,  &end
#
# 590 LYS HA 590 LYS HD3 4.87
 &rst
  ixpk= 0, nxpk= 0, iat= 593, 602, r1= 1.30, r2= 1.80, r3= 4.87, r4= 5.37,  &end
#
# 590 LYS HA 590 LYS HD2 4.54
 &rst
  ixpk= 0, nxpk= 0, iat= 593, 601, r1= 1.30, r2= 1.80, r3= 4.54, r4= 5.04,  &end
#
# 590 LYS H 590 LYS HD3 5.05
 &rst
  ixpk= 0, nxpk= 0, iat= 591, 602, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,  &end
#
# 590 LYS HD2 596 ASN H 5.11
 &rst
  ixpk= 0, nxpk= 0, iat= 601, 692, r1= 1.30, r2= 1.80, r3= 5.11, r4= 5.61,  &end
#
# 575 ALA QB 590 LYS HB3 4.79
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 596, r1= 1.30, r2= 1.80, r3= 5.75, r4= 6.25,
 igr1= 391, 392, 393,
 &end
#
# 571 LYS HB3 572 PHE QD 5.37
 &rst
  ixpk= 0, nxpk= 0, iat= 305,  -1, r1= 1.30, r2= 1.80, r3= 6.03, r4= 6.53,
 igr2= 330, 338,
 &end
#
# 590 LYS HB2 597 TYR HA 5.04
 &rst
  ixpk= 0, nxpk= 0, iat= 595, 708, r1= 1.30, r2= 1.80, r3= 5.04, r4= 5.54,  &end
#
# 576 GLU H 590 LYS HB2 5.31
 &rst
  ixpk= 0, nxpk= 0, iat= 397, 595, r1= 1.30, r2= 1.80, r3= 5.31, r4= 5.81,  &end
#
# 592 ILE HG12 608 ILE QD1 5.50
 &rst
  ixpk= 0, nxpk= 0, iat= 643,  -1, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr2= 904, 905, 906,
 &end
#
# 576 GLU QG 592 ILE HG12 5.41
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 643, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr1= 404, 405,
 &end
#
# 570 ASN HB3 571 LYS QG 5.50
 &rst
  ixpk= 0, nxpk= 0, iat= 291,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2= 307, 308,
 &end
#
# 590 LYS HD3 596 ASN HA 5.04
 &rst
  ixpk= 0, nxpk= 0, iat= 602, 694, r1= 1.30, r2= 1.80, r3= 5.04, r4= 5.54,  &end
#
# 571 LYS HB3 571 LYS QG 2.86
 &rst
  ixpk= 0, nxpk= 0, iat= 305,  -1, r1= 1.30, r2= 1.80, r3= 3.21, r4= 3.71,
 igr2= 307, 308,
 &end
#
# 569 ASP HB2 571 LYS HB2 4.34
 &rst
  ixpk= 0, nxpk= 0, iat= 278, 304, r1= 1.30, r2= 1.80, r3= 4.34, r4= 4.84,  &end
#
# 590 LYS H 590 LYS HB3 3.82
 &rst
  ixpk= 0, nxpk= 0, iat= 591, 596, r1= 1.30, r2= 1.80, r3= 3.82, r4= 4.32,  &end
#
# 590 LYS HA 596 ASN HA 4.63
 &rst
  ixpk= 0, nxpk= 0, iat= 593, 694, r1= 1.30, r2= 1.80, r3= 4.63, r4= 5.13,  &end
#
# 590 LYS HB2 590 LYS HE3 4.69
 &rst
  ixpk= 0, nxpk= 0, iat= 595, 605, r1= 1.30, r2= 1.80, r3= 4.69, r4= 5.19,  &end
#
# 563 PHE HA 574 ARG HA 3.36
 &rst
  ixpk= 0, nxpk= 0, iat= 167, 365, r1= 1.30, r2= 1.80, r3= 3.36, r4= 3.86,  &end
#
# 574 ARG HA 575 ALA H 2.92
 &rst
  ixpk= 0, nxpk= 0, iat= 365, 387, r1= 1.30, r2= 1.80, r3= 2.92, r4= 3.42,  &end
#
# 574 ARG HA 575 ALA QB 4.45
 &rst
  ixpk= 0, nxpk= 0, iat= 365,  -1, r1= 1.30, r2= 1.80, r3= 5.34, r4= 5.84,
 igr2= 391, 392, 393,
 &end
#
# 574 ARG HA 592 ILE QD1 4.80
 &rst
  ixpk= 0, nxpk= 0, iat= 365,  -1, r1= 1.30, r2= 1.80, r3= 5.76, r4= 6.26,
 igr2= 646, 647, 648,
 &end
#
# 559 GLY H 578 GLU HA 3.74
 &rst
  ixpk= 0, nxpk= 0, iat= 120, 430, r1= 1.30, r2= 1.80, r3= 3.74, r4= 4.24,  &end
#
# 578 GLU HA 589 VAL HA 5.10
 &rst
  ixpk= 0, nxpk= 0, iat= 430, 577, r1= 1.30, r2= 1.80, r3= 5.10, r4= 5.60,  &end
#
# 578 GLU HA 579 ALA QB 4.62
 &rst
  ixpk= 0, nxpk= 0, iat= 430,  -1, r1= 1.30, r2= 1.80, r3= 5.55, r4= 6.05,
 igr2= 447, 448, 449,
 &end
#
# 577 VAL QG1 578 GLU HA 4.30
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 430, r1= 1.30, r2= 1.80, r3= 5.16, r4= 5.66,
 igr1= 418, 419, 420,
 &end
#
# 556 TRP HB3 577 VAL QG2 4.49
 &rst
  ixpk= 0, nxpk= 0, iat=  65,  -1, r1= 1.30, r2= 1.80, r3= 5.39, r4= 5.89,
 igr2= 422, 423, 424,
 &end
#
# 562 CYS HA 575 ALA H 4.83
 &rst
  ixpk= 0, nxpk= 0, iat= 156, 387, r1= 1.30, r2= 1.80, r3= 4.83, r4= 5.33,  &end
#
# 561 GLU HA 577 VAL HB 4.38
 &rst
  ixpk= 0, nxpk= 0, iat= 141, 416, r1= 1.30, r2= 1.80, r3= 4.38, r4= 4.88,  &end
#
# 561 GLU HA 576 GLU QB 4.25
 &rst
  ixpk= 0, nxpk= 0, iat= 141,  -1, r1= 1.30, r2= 1.80, r3= 4.77, r4= 5.27,
 igr2= 401, 402,
 &end
#
# 571 LYS HA 572 PHE H 2.93
 &rst
  ixpk= 0, nxpk= 0, iat= 302, 322, r1= 1.30, r2= 1.80, r3= 2.93, r4= 3.43,  &end
#
# 601 LEU HA 602 LEU H 2.99
 &rst
  ixpk= 0, nxpk= 0, iat= 775, 792, r1= 1.30, r2= 1.80, r3= 2.99, r4= 3.49,  &end
#
# 572 PHE HA 572 PHE QD 3.52
 &rst
  ixpk= 0, nxpk= 0, iat= 324,  -1, r1= 1.30, r2= 1.80, r3= 3.95, r4= 4.45,
 igr2= 330, 338,
 &end
#
# 572 PHE HA 573 TYR H 3.04
 &rst
  ixpk= 0, nxpk= 0, iat= 324, 342, r1= 1.30, r2= 1.80, r3= 3.04, r4= 3.54,  &end
#
# 558 PRO HB3 579 ALA HA 3.88
 &rst
  ixpk= 0, nxpk= 0, iat= 114, 445, r1= 1.30, r2= 1.80, r3= 3.88, r4= 4.38,  &end
#
# 580 LEU HA 587 ALA HA 3.21
 &rst
  ixpk= 0, nxpk= 0, iat= 455, 551, r1= 1.30, r2= 1.80, r3= 3.21, r4= 3.71,  &end
#
# 581 HIS H 587 ALA HA 4.08
 &rst
  ixpk= 0, nxpk= 0, iat= 472, 551, r1= 1.30, r2= 1.80, r3= 4.08, r4= 4.58,  &end
#
# 587 ALA HA 588 VAL H 3.04
 &rst
  ixpk= 0, nxpk= 0, iat= 551, 559, r1= 1.30, r2= 1.80, r3= 3.04, r4= 3.54,  &end
#
# 590 LYS HD2 595 GLY HA2 5.00
 &rst
  ixpk= 0, nxpk= 0, iat= 601, 687, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50,  &end
#
# 590 LYS HG2 595 GLY HA2 4.78
 &rst
  ixpk= 0, nxpk= 0, iat= 598, 687, r1= 1.30, r2= 1.80, r3= 4.78, r4= 5.28,  &end
#
# 590 LYS HG3 595 GLY HA2 5.26
 &rst
  ixpk= 0, nxpk= 0, iat= 599, 687, r1= 1.30, r2= 1.80, r3= 5.26, r4= 5.76,  &end
#
# 590 LYS HG3 595 GLY HA3 5.07
 &rst
  ixpk= 0, nxpk= 0, iat= 599, 688, r1= 1.30, r2= 1.80, r3= 5.07, r4= 5.57,  &end
#
# 591 PHE QB 595 GLY HA3 5.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 688, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 617, 618,
 &end
#
# 589 VAL QG1 599 GLU HA 5.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 744, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr1= 581, 582, 583,
 &end
#
# 556 TRP HE1 602 LEU HA 5.23
 &rst
  ixpk= 0, nxpk= 0, iat=  70, 794, r1= 1.30, r2= 1.80, r3= 5.23, r4= 5.73,  &end
#
# 565 LEU HB3 604 ASN HA 4.23
 &rst
  ixpk= 0, nxpk= 0, iat= 200, 824, r1= 1.30, r2= 1.80, r3= 4.23, r4= 4.73,  &end
#
# 565 LEU H 604 ASN HA 4.84
 &rst
  ixpk= 0, nxpk= 0, iat= 195, 824, r1= 1.30, r2= 1.80, r3= 4.84, r4= 5.34,  &end
#
# 604 ASN HA 605 ILE H 3.51
 &rst
  ixpk= 0, nxpk= 0, iat= 824, 836, r1= 1.30, r2= 1.80, r3= 3.51, r4= 4.01,  &end
#
# 563 PHE H 608 ILE HA 5.17
 &rst
  ixpk= 0, nxpk= 0, iat= 165, 893, r1= 1.30, r2= 1.80, r3= 5.17, r4= 5.67,  &end
#
# 556 TRP HH2 562 CYS HB3 4.43
 &rst
  ixpk= 0, nxpk= 0, iat=  75, 159, r1= 1.30, r2= 1.80, r3= 4.43, r4= 4.93,  &end
#
# 556 TRP HZ2 562 CYS HB3 4.54
 &rst
  ixpk= 0, nxpk= 0, iat=  73, 159, r1= 1.30, r2= 1.80, r3= 4.54, r4= 5.04,  &end
#
# 558 PRO HB2 579 ALA QB 5.45
 &rst
  ixpk= 0, nxpk= 0, iat= 113,  -1, r1= 1.30, r2= 1.80, r3= 6.55, r4= 7.05,
 igr2= 447, 448, 449,
 &end
#
# 558 PRO HB2 579 ALA H 5.38
 &rst
  ixpk= 0, nxpk= 0, iat= 113, 443, r1= 1.30, r2= 1.80, r3= 5.38, r4= 5.88,  &end
#
# 563 PHE HB3 574 ARG HA 5.50
 &rst
  ixpk= 0, nxpk= 0, iat= 170, 365, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
# 563 PHE HB3 572 PHE H 5.50
 &rst
  ixpk= 0, nxpk= 0, iat= 170, 322, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
# 590 LYS HE2 595 GLY HA2 5.31
 &rst
  ixpk= 0, nxpk= 0, iat= 604, 687, r1= 1.30, r2= 1.80, r3= 5.31, r4= 5.81,  &end
#
# 564 ALA QB 605 ILE QD1 4.02
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.80, r4= 6.30,
 igr1= 189, 190, 191,
 igr2= 849, 850, 851,
 &end
#
# 564 ALA QB 589 VAL QG1 3.27
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,
 igr1= 189, 190, 191,
 igr2= 581, 582, 583,
 &end
#
# 564 ALA QB 565 LEU H 3.11
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 195, r1= 1.30, r2= 1.80, r3= 3.73, r4= 4.23,
 igr1= 189, 190, 191,
 &end
#
# 564 ALA QB 573 TYR H 4.49
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 342, r1= 1.30, r2= 1.80, r3= 5.39, r4= 5.89,
 igr1= 189, 190, 191,
 &end
#
# 565 LEU HB2 572 PHE HA 5.46
 &rst
  ixpk= 0, nxpk= 0, iat= 199, 324, r1= 1.30, r2= 1.80, r3= 5.46, r4= 5.96,  &end
#
# 569 ASP HB3 571 LYS H 5.50
 &rst
  ixpk= 0, nxpk= 0, iat= 279, 300, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
# 569 ASP HB3 570 ASN H 4.89
 &rst
  ixpk= 0, nxpk= 0, iat= 279, 286, r1= 1.30, r2= 1.80, r3= 4.89, r4= 5.39,  &end
#
# 569 ASP HB2 571 LYS H 5.20
 &rst
  ixpk= 0, nxpk= 0, iat= 278, 300, r1= 1.30, r2= 1.80, r3= 5.20, r4= 5.70,  &end
#
# 569 ASP HB2 570 ASN H 5.06
 &rst
  ixpk= 0, nxpk= 0, iat= 278, 286, r1= 1.30, r2= 1.80, r3= 5.06, r4= 5.56,  &end
#
# 565 LEU HG 570 ASN HB3 5.34
 &rst
  ixpk= 0, nxpk= 0, iat= 202, 291, r1= 1.30, r2= 1.80, r3= 5.34, r4= 5.84,  &end
#
# 569 ASP H 570 ASN HB3 5.50
 &rst
  ixpk= 0, nxpk= 0, iat= 274, 291, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
# 570 ASN HB3 571 LYS H 4.78
 &rst
  ixpk= 0, nxpk= 0, iat= 291, 300, r1= 1.30, r2= 1.80, r3= 4.78, r4= 5.28,  &end
#
# 590 LYS HB3 597 TYR QE 5.50
 &rst
  ixpk= 0, nxpk= 0, iat= 596,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2= 716, 721,
 &end
#
# 563 PHE HA 572 PHE HB2 5.50
 &rst
  ixpk= 0, nxpk= 0, iat= 167, 326, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
# 564 ALA QB 572 PHE HB3 5.38
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 327, r1= 1.30, r2= 1.80, r3= 6.46, r4= 6.96,
 igr1= 189, 190, 191,
 &end
#
# 565 LEU HA 572 PHE HB3 5.04
 &rst
  ixpk= 0, nxpk= 0, iat= 197, 327, r1= 1.30, r2= 1.80, r3= 5.04, r4= 5.54,  &end
#
# 563 PHE HA 572 PHE HB3 4.95
 &rst
  ixpk= 0, nxpk= 0, iat= 167, 327, r1= 1.30, r2= 1.80, r3= 4.95, r4= 5.45,  &end
#
# 564 ALA H 572 PHE HB3 5.16
 &rst
  ixpk= 0, nxpk= 0, iat= 185, 327, r1= 1.30, r2= 1.80, r3= 5.16, r4= 5.66,  &end
#
# 573 TYR HB3 574 ARG QB 4.95
 &rst
  ixpk= 0, nxpk= 0, iat= 347,  -1, r1= 1.30, r2= 1.80, r3= 5.56, r4= 6.06,
 igr2= 367, 368,
 &end
#
# 573 TYR HB3 594 TYR QE 5.00
 &rst
  ixpk= 0, nxpk= 0, iat= 347,  -1, r1= 1.30, r2= 1.80, r3= 5.61, r4= 6.11,
 igr2= 674, 679,
 &end
#
# 576 GLU QB 578 GLU H 5.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 428, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 401, 402,
 &end
#
# 577 VAL QG1 578 GLU QB 4.81
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.48, r4= 6.98,
 igr1= 418, 419, 420,
 igr2= 432, 433,
 &end
#
# 579 ALA QB 597 TYR QE 5.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1= 447, 448, 449,
 igr2= 716, 721,
 &end
#
# 579 ALA QB 597 TYR QD 5.05
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.81, r4= 7.31,
 igr1= 447, 448, 449,
 igr2= 714, 723,
 &end
#
# 586 THR HB 600 VAL H 4.27
 &rst
  ixpk= 0, nxpk= 0, iat= 539, 757, r1= 1.30, r2= 1.80, r3= 4.27, r4= 4.77,  &end
#
# 590 LYS HB3 597 TYR HA 5.50
 &rst
  ixpk= 0, nxpk= 0, iat= 596, 708, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
# 590 LYS HB2 598 GLU H 5.49
 &rst
  ixpk= 0, nxpk= 0, iat= 595, 727, r1= 1.30, r2= 1.80, r3= 5.49, r4= 5.99,  &end
#
# 591 PHE QB 593 ASP H 5.40
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 652, r1= 1.30, r2= 1.80, r3= 6.06, r4= 6.56,
 igr1= 617, 618,
 &end
#
# 598 GLU QB 599 GLU QB 4.57
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.76, r4= 6.26,
 igr1= 731, 732,
 igr2= 746, 747,
 &end
#
# 601 LEU QQD 603 SER HB2 4.78
 &rst
  ixpk= 0, nxpk= 0, iat= 779, 815, r1= 1.30, r2= 1.80, r3= 6.98, r4= 7.48,  &end
#
# 601 LEU QQD 603 SER HB3 4.78
 &rst
  ixpk= 0, nxpk= 0, iat= 779, 816, r1= 1.30, r2= 1.80, r3= 6.98, r4= 7.48,  &end
#
# 600 VAL HB 604 ASN HB2 5.50
 &rst
  ixpk= 0, nxpk= 0, iat= 761, 826, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
# 600 VAL HB 604 ASN HB3 5.50
 &rst
  ixpk= 0, nxpk= 0, iat= 761, 827, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
# 589 VAL QG1 605 ILE HB 5.36
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 840, r1= 1.30, r2= 1.80, r3= 6.44, r4= 6.94,
 igr1= 581, 582, 583,
 &end
#
# 562 CYS HB2 605 ILE HB 5.17
 &rst
  ixpk= 0, nxpk= 0, iat= 158, 840, r1= 1.30, r2= 1.80, r3= 5.17, r4= 5.67,  &end
#
# 556 TRP HZ2 605 ILE HB 4.94
 &rst
  ixpk= 0, nxpk= 0, iat=  73, 840, r1= 1.30, r2= 1.80, r3= 4.94, r4= 5.44,  &end
#
# 604 ASN H 605 ILE HB 5.31
 &rst
  ixpk= 0, nxpk= 0, iat= 822, 840, r1= 1.30, r2= 1.80, r3= 5.31, r4= 5.81,  &end
#
# 565 LEU H 605 ILE HB 5.50
 &rst
  ixpk= 0, nxpk= 0, iat= 195, 840, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
# 563 PHE H 605 ILE HB 5.50
 &rst
  ixpk= 0, nxpk= 0, iat= 165, 840, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
# 556 TRP HE1 605 ILE HB 4.72
 &rst
  ixpk= 0, nxpk= 0, iat=  70, 840, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,  &end
#
# 564 ALA QB 605 ILE HB 4.91
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 840, r1= 1.30, r2= 1.80, r3= 5.90, r4= 6.40,
 igr1= 189, 190, 191,
 &end
#
# 556 TRP HZ2 607 PRO HB3 4.97
 &rst
  ixpk= 0, nxpk= 0, iat=  73, 885, r1= 1.30, r2= 1.80, r3= 4.97, r4= 5.47,  &end
#
# 608 ILE HA 609 LEU QB 5.02
 &rst
  ixpk= 0, nxpk= 0, iat= 893,  -1, r1= 1.30, r2= 1.80, r3= 5.63, r4= 6.13,
 igr2= 914, 915,
 &end
#
# 566 TYR HA 567 TRP HB3 5.02
 &rst
  ixpk= 0, nxpk= 0, iat= 216, 240, r1= 1.30, r2= 1.80, r3= 5.02, r4= 5.52,  &end
#
# 600 VAL HA 601 LEU HA 4.54
 &rst
  ixpk= 0, nxpk= 0, iat= 759, 775, r1= 1.30, r2= 1.80, r3= 4.54, r4= 5.04,  &end
#
# 564 ALA HA 565 LEU HA 5.10
 &rst
  ixpk= 0, nxpk= 0, iat= 187, 197, r1= 1.30, r2= 1.80, r3= 5.10, r4= 5.60,  &end
#
# 563 PHE HB3 564 ALA HA 4.94
 &rst
  ixpk= 0, nxpk= 0, iat= 170, 187, r1= 1.30, r2= 1.80, r3= 4.94, r4= 5.44,  &end
#
# 565 LEU HA 572 PHE H 4.92
 &rst
  ixpk= 0, nxpk= 0, iat= 197, 322, r1= 1.30, r2= 1.80, r3= 4.92, r4= 5.42,  &end
#
# 565 LEU HA 571 LYS HA 5.49
 &rst
  ixpk= 0, nxpk= 0, iat= 197, 302, r1= 1.30, r2= 1.80, r3= 5.49, r4= 5.99,  &end
#
# 565 LEU HA 570 ASN HA 5.25
 &rst
  ixpk= 0, nxpk= 0, iat= 197, 288, r1= 1.30, r2= 1.80, r3= 5.25, r4= 5.75,  &end
#
# 576 GLU QB 577 VAL HB 5.24
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 416, r1= 1.30, r2= 1.80, r3= 5.88, r4= 6.38,
 igr1= 401, 402,
 &end
#
# 592 ILE HA 595 GLY H 5.16
 &rst
  ixpk= 0, nxpk= 0, iat= 635, 685, r1= 1.30, r2= 1.80, r3= 5.16, r4= 5.66,  &end
#
# 591 PHE H 592 ILE HA 5.50
 &rst
  ixpk= 0, nxpk= 0, iat= 613, 635, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
# 592 ILE HA 595 GLY HA2 5.03
 &rst
  ixpk= 0, nxpk= 0, iat= 635, 687, r1= 1.30, r2= 1.80, r3= 5.03, r4= 5.53,  &end
#
# 575 ALA H 592 ILE HG13 5.50
 &rst
  ixpk= 0, nxpk= 0, iat= 387, 644, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
# 592 ILE QG2 595 GLY HA2 5.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 687, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr1= 639, 640, 641,
 &end
#
# 563 PHE H 608 ILE QD1 4.73
 &rst
  ixpk= 0, nxpk= 0, iat= 165,  -1, r1= 1.30, r2= 1.80, r3= 5.68, r4= 6.18,
 igr2= 904, 905, 906,
 &end
#
# 575 ALA H 608 ILE QD1 4.83
 &rst
  ixpk= 0, nxpk= 0, iat= 387,  -1, r1= 1.30, r2= 1.80, r3= 5.80, r4= 6.30,
 igr2= 904, 905, 906,
 &end
#
# 562 CYS HB3 605 ILE QD1 5.50
 &rst
  ixpk= 0, nxpk= 0, iat= 159,  -1, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr2= 849, 850, 851,
 &end
#
# 564 ALA HA 605 ILE QD1 4.95
 &rst
  ixpk= 0, nxpk= 0, iat= 187,  -1, r1= 1.30, r2= 1.80, r3= 5.94, r4= 6.44,
 igr2= 849, 850, 851,
 &end
#
# 604 ASN H 605 ILE QD1 5.14
 &rst
  ixpk= 0, nxpk= 0, iat= 822,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2= 849, 850, 851,
 &end
#
# 562 CYS HB2 605 ILE QD1 5.50
 &rst
  ixpk= 0, nxpk= 0, iat= 158,  -1, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr2= 849, 850, 851,
 &end
#
# 580 LEU HA 605 ILE QD1 5.17
 &rst
  ixpk= 0, nxpk= 0, iat= 455,  -1, r1= 1.30, r2= 1.80, r3= 6.21, r4= 6.71,
 igr2= 849, 850, 851,
 &end
#
# 589 VAL HA 605 ILE QD1 5.50
 &rst
  ixpk= 0, nxpk= 0, iat= 577,  -1, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr2= 849, 850, 851,
 &end
#
# 556 TRP HB3 605 ILE QD1 5.44
 &rst
  ixpk= 0, nxpk= 0, iat=  65,  -1, r1= 1.30, r2= 1.80, r3= 6.53, r4= 7.03,
 igr2= 849, 850, 851,
 &end
#
# 608 ILE QG2 608 ILE QG1 3.11
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.19, r4= 4.69,
 igr1= 897, 898, 899,
 igr2= 901, 902,
 &end
#
# 608 ILE QG1 609 LEU H 5.43
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 910, r1= 1.30, r2= 1.80, r3= 6.09, r4= 6.59,
 igr1= 901, 902,
 &end
#
# 563 PHE QD 608 ILE QG1 5.49
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.92, r4= 7.42,
 igr1= 173, 181,
 igr2= 901, 902,
 &end
#
# 563 PHE QE 608 ILE QG1 5.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1= 175, 179,
 igr2= 901, 902,
 &end
#
# 605 ILE HA 605 ILE QG1 4.18
 &rst
  ixpk= 0, nxpk= 0, iat= 838,  -1, r1= 1.30, r2= 1.80, r3= 4.69, r4= 5.19,
 igr2= 846, 847,
 &end
#
# 564 ALA HA 605 ILE QG1 5.22
 &rst
  ixpk= 0, nxpk= 0, iat= 187,  -1, r1= 1.30, r2= 1.80, r3= 5.86, r4= 6.36,
 igr2= 846, 847,
 &end
#
# 604 ASN H 605 ILE QG1 5.31
 &rst
  ixpk= 0, nxpk= 0, iat= 822,  -1, r1= 1.30, r2= 1.80, r3= 5.96, r4= 6.46,
 igr2= 846, 847,
 &end
#
# 605 ILE QG1 606 LYS H 5.04
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 855, r1= 1.30, r2= 1.80, r3= 5.66, r4= 6.16,
 igr1= 846, 847,
 &end
#
# 556 TRP HE1 605 ILE QG1 4.80
 &rst
  ixpk= 0, nxpk= 0, iat=  70,  -1, r1= 1.30, r2= 1.80, r3= 5.39, r4= 5.89,
 igr2= 846, 847,
 &end
#
# 556 TRP HB3 589 VAL QG1 5.50
 &rst
  ixpk= 0, nxpk= 0, iat=  65,  -1, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr2= 581, 582, 583,
 &end
#
# 578 GLU HA 589 VAL QG1 5.50
 &rst
  ixpk= 0, nxpk= 0, iat= 430,  -1, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr2= 581, 582, 583,
 &end
#
# 564 ALA HA 589 VAL QG1 5.24
 &rst
  ixpk= 0, nxpk= 0, iat= 187,  -1, r1= 1.30, r2= 1.80, r3= 6.29, r4= 6.79,
 igr2= 581, 582, 583,
 &end
#
# 575 ALA QB 589 VAL QG2 2.85
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.11, r4= 4.61,
 igr1= 391, 392, 393,
 igr2= 585, 586, 587,
 &end
#
# 556 TRP HA 557 LYS H 2.76
 &rst
  ixpk= 0, nxpk= 0, iat=  62,  84, r1= 1.30, r2= 1.80, r3= 2.76, r4= 3.26,  &end
#
# 556 TRP HB3 557 LYS H 3.11
 &rst
  ixpk= 0, nxpk= 0, iat=  65,  84, r1= 1.30, r2= 1.80, r3= 3.11, r4= 3.61,  &end
#
# 557 LYS H 577 VAL QG2 4.10
 &rst
  ixpk= 0, nxpk= 0, iat=  84,  -1, r1= 1.30, r2= 1.80, r3= 4.92, r4= 5.42,
 igr2= 422, 423, 424,
 &end
#
# 559 GLY H 560 ASP H 3.01
 &rst
  ixpk= 0, nxpk= 0, iat= 120, 127, r1= 1.30, r2= 1.80, r3= 3.01, r4= 3.51,  &end
#
# 560 ASP H 577 VAL H 3.78
 &rst
  ixpk= 0, nxpk= 0, iat= 127, 412, r1= 1.30, r2= 1.80, r3= 3.78, r4= 4.28,  &end
#
# 560 ASP H 577 VAL HB 2.99
 &rst
  ixpk= 0, nxpk= 0, iat= 127, 416, r1= 1.30, r2= 1.80, r3= 2.99, r4= 3.49,  &end
#
# 560 ASP H 576 GLU QB 4.71
 &rst
  ixpk= 0, nxpk= 0, iat= 127,  -1, r1= 1.30, r2= 1.80, r3= 5.29, r4= 5.79,
 igr2= 401, 402,
 &end
#
# 578 GLU H 590 LYS H 3.84
 &rst
  ixpk= 0, nxpk= 0, iat= 428, 591, r1= 1.30, r2= 1.80, r3= 3.84, r4= 4.34,  &end
#
# 589 VAL H 590 LYS H 4.38
 &rst
  ixpk= 0, nxpk= 0, iat= 575, 591, r1= 1.30, r2= 1.80, r3= 4.38, r4= 4.88,  &end
#
# 561 GLU H 577 VAL H 4.63
 &rst
  ixpk= 0, nxpk= 0, iat= 139, 412, r1= 1.30, r2= 1.80, r3= 4.63, r4= 5.13,  &end
#
# 590 LYS H 598 GLU H 5.20
 &rst
  ixpk= 0, nxpk= 0, iat= 591, 727, r1= 1.30, r2= 1.80, r3= 5.20, r4= 5.70,  &end
#
# 576 GLU H 590 LYS H 3.83
 &rst
  ixpk= 0, nxpk= 0, iat= 397, 591, r1= 1.30, r2= 1.80, r3= 3.83, r4= 4.33,  &end
#
# 560 ASP H 561 GLU H 3.92
 &rst
  ixpk= 0, nxpk= 0, iat= 127, 139, r1= 1.30, r2= 1.80, r3= 3.92, r4= 4.42,  &end
#
# 589 VAL HA 590 LYS H 2.87
 &rst
  ixpk= 0, nxpk= 0, iat= 577, 591, r1= 1.30, r2= 1.80, r3= 2.87, r4= 3.37,  &end
#
# 560 ASP HA 561 GLU H 2.65
 &rst
  ixpk= 0, nxpk= 0, iat= 129, 139, r1= 1.30, r2= 1.80, r3= 2.65, r4= 3.15,  &end
#
# 577 VAL HA 590 LYS H 3.96
 &rst
  ixpk= 0, nxpk= 0, iat= 414, 591, r1= 1.30, r2= 1.80, r3= 3.96, r4= 4.46,  &end
#
# 560 ASP QB 561 GLU H 3.93
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 139, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,
 igr1= 131, 132,
 &end
#
# 561 GLU H 561 GLU QG 3.53
 &rst
  ixpk= 0, nxpk= 0, iat= 139,  -1, r1= 1.30, r2= 1.80, r3= 3.96, r4= 4.46,
 igr2= 146, 147,
 &end
#
# 561 GLU H 561 GLU QB 2.95
 &rst
  ixpk= 0, nxpk= 0, iat= 139,  -1, r1= 1.30, r2= 1.80, r3= 3.31, r4= 3.81,
 igr2= 143, 144,
 &end
#
# 561 GLU H 576 GLU QB 5.05
 &rst
  ixpk= 0, nxpk= 0, iat= 139,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr2= 401, 402,
 &end
#
# 576 GLU QB 590 LYS H 4.02
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 591, r1= 1.30, r2= 1.80, r3= 4.51, r4= 5.01,
 igr1= 401, 402,
 &end
#
# 589 VAL HB 590 LYS H 3.34
 &rst
  ixpk= 0, nxpk= 0, iat= 579, 591, r1= 1.30, r2= 1.80, r3= 3.34, r4= 3.84,  &end
#
# 590 LYS H 590 LYS HB2 3.78
 &rst
  ixpk= 0, nxpk= 0, iat= 591, 595, r1= 1.30, r2= 1.80, r3= 3.78, r4= 4.28,  &end
#
# 590 LYS H 590 LYS HG2 4.37
 &rst
  ixpk= 0, nxpk= 0, iat= 591, 598, r1= 1.30, r2= 1.80, r3= 4.37, r4= 4.87,  &end
#
# 562 CYS H 575 ALA H 3.64
 &rst
  ixpk= 0, nxpk= 0, iat= 154, 387, r1= 1.30, r2= 1.80, r3= 3.64, r4= 4.14,  &end
#
# 561 GLU HA 562 CYS H 2.82
 &rst
  ixpk= 0, nxpk= 0, iat= 141, 154, r1= 1.30, r2= 1.80, r3= 2.82, r4= 3.32,  &end
#
# 561 GLU QG 562 CYS H 4.95
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 154, r1= 1.30, r2= 1.80, r3= 5.56, r4= 6.06,
 igr1= 146, 147,
 &end
#
# 561 GLU QB 562 CYS H 3.44
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 154, r1= 1.30, r2= 1.80, r3= 3.86, r4= 4.36,
 igr1= 143, 144,
 &end
#
# 562 CYS H 592 ILE QD1 3.72
 &rst
  ixpk= 0, nxpk= 0, iat= 154,  -1, r1= 1.30, r2= 1.80, r3= 4.47, r4= 4.97,
 igr2= 646, 647, 648,
 &end
#
# 563 PHE H 606 LYS H 3.96
 &rst
  ixpk= 0, nxpk= 0, iat= 165, 855, r1= 1.30, r2= 1.80, r3= 3.96, r4= 4.46,  &end
#
# 556 TRP HZ2 563 PHE H 4.99
 &rst
  ixpk= 0, nxpk= 0, iat=  73, 165, r1= 1.30, r2= 1.80, r3= 4.99, r4= 5.49,  &end
#
# 563 PHE H 563 PHE QD 4.06
 &rst
  ixpk= 0, nxpk= 0, iat= 165,  -1, r1= 1.30, r2= 1.80, r3= 4.56, r4= 5.06,
 igr2= 173, 181,
 &end
#
# 562 CYS HA 563 PHE H 2.99
 &rst
  ixpk= 0, nxpk= 0, iat= 156, 165, r1= 1.30, r2= 1.80, r3= 2.99, r4= 3.49,  &end
#
# 562 CYS HB2 563 PHE H 3.60
 &rst
  ixpk= 0, nxpk= 0, iat= 158, 165, r1= 1.30, r2= 1.80, r3= 3.60, r4= 4.10,  &end
#
# 563 PHE H 563 PHE HB3 4.05
 &rst
  ixpk= 0, nxpk= 0, iat= 165, 170, r1= 1.30, r2= 1.80, r3= 4.05, r4= 4.55,  &end
#
# 562 CYS HB3 563 PHE H 3.60
 &rst
  ixpk= 0, nxpk= 0, iat= 159, 165, r1= 1.30, r2= 1.80, r3= 3.60, r4= 4.10,  &end
#
# 563 PHE H 605 ILE QG2 4.13
 &rst
  ixpk= 0, nxpk= 0, iat= 165,  -1, r1= 1.30, r2= 1.80, r3= 4.96, r4= 5.46,
 igr2= 842, 843, 844,
 &end
#
# 564 ALA H 573 TYR H 3.64
 &rst
  ixpk= 0, nxpk= 0, iat= 185, 342, r1= 1.30, r2= 1.80, r3= 3.64, r4= 4.14,  &end
#
# 564 ALA H 573 TYR QD 5.25
 &rst
  ixpk= 0, nxpk= 0, iat= 185,  -1, r1= 1.30, r2= 1.80, r3= 5.89, r4= 6.39,
 igr2= 350, 359,
 &end
#
# 563 PHE QD 564 ALA H 3.97
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 185, r1= 1.30, r2= 1.80, r3= 4.46, r4= 4.96,
 igr1= 173, 181,
 &end
#
# 563 PHE HA 564 ALA H 2.91
 &rst
  ixpk= 0, nxpk= 0, iat= 167, 185, r1= 1.30, r2= 1.80, r3= 2.91, r4= 3.41,  &end
#
# 564 ALA H 574 ARG HA 4.32
 &rst
  ixpk= 0, nxpk= 0, iat= 185, 365, r1= 1.30, r2= 1.80, r3= 4.32, r4= 4.82,  &end
#
# 563 PHE HB3 564 ALA H 3.80
 &rst
  ixpk= 0, nxpk= 0, iat= 170, 185, r1= 1.30, r2= 1.80, r3= 3.80, r4= 4.30,  &end
#
# 564 ALA H 575 ALA QB 4.06
 &rst
  ixpk= 0, nxpk= 0, iat= 185,  -1, r1= 1.30, r2= 1.80, r3= 4.88, r4= 5.38,
 igr2= 391, 392, 393,
 &end
#
# 564 ALA H 589 VAL QG2 5.16
 &rst
  ixpk= 0, nxpk= 0, iat= 185,  -1, r1= 1.30, r2= 1.80, r3= 6.20, r4= 6.70,
 igr2= 585, 586, 587,
 &end
#
# 564 ALA H 605 ILE QG2 5.33
 &rst
  ixpk= 0, nxpk= 0, iat= 185,  -1, r1= 1.30, r2= 1.80, r3= 6.40, r4= 6.90,
 igr2= 842, 843, 844,
 &end
#
# 565 LEU H 606 LYS H 4.28
 &rst
  ixpk= 0, nxpk= 0, iat= 195, 855, r1= 1.30, r2= 1.80, r3= 4.28, r4= 4.78,  &end
#
# 565 LEU H 572 PHE QD 3.74
 &rst
  ixpk= 0, nxpk= 0, iat= 195,  -1, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
 igr2= 330, 338,
 &end
#
# 564 ALA HA 565 LEU H 2.82
 &rst
  ixpk= 0, nxpk= 0, iat= 187, 195, r1= 1.30, r2= 1.80, r3= 2.82, r4= 3.32,  &end
#
# 565 LEU H 605 ILE HA 3.68
 &rst
  ixpk= 0, nxpk= 0, iat= 195, 838, r1= 1.30, r2= 1.80, r3= 3.68, r4= 4.18,  &end
#
# 565 LEU H 604 ASN HB3 4.48
 &rst
  ixpk= 0, nxpk= 0, iat= 195, 827, r1= 1.30, r2= 1.80, r3= 4.48, r4= 4.98,  &end
#
# 565 LEU H 565 LEU HB2 3.08
 &rst
  ixpk= 0, nxpk= 0, iat= 195, 199, r1= 1.30, r2= 1.80, r3= 3.08, r4= 3.58,  &end
#
# 565 LEU H 565 LEU HB3 3.11
 &rst
  ixpk= 0, nxpk= 0, iat= 195, 200, r1= 1.30, r2= 1.80, r3= 3.11, r4= 3.61,  &end
#
# 565 LEU H 605 ILE QG2 4.22
 &rst
  ixpk= 0, nxpk= 0, iat= 195,  -1, r1= 1.30, r2= 1.80, r3= 5.07, r4= 5.57,
 igr2= 842, 843, 844,
 &end
#
# 565 LEU H 565 LEU QD1 4.77
 &rst
  ixpk= 0, nxpk= 0, iat= 195,  -1, r1= 1.30, r2= 1.80, r3= 5.73, r4= 6.23,
 igr2= 204, 205, 206,
 &end
#
# 566 TYR H 566 TYR HB3 4.02
 &rst
  ixpk= 0, nxpk= 0, iat= 214, 219, r1= 1.30, r2= 1.80, r3= 4.02, r4= 4.52,  &end
#
# 566 TYR HA 567 TRP H 3.19
 &rst
  ixpk= 0, nxpk= 0, iat= 216, 235, r1= 1.30, r2= 1.80, r3= 3.19, r4= 3.69,  &end
#
# 567 TRP H 568 GLU H 4.12
 &rst
  ixpk= 0, nxpk= 0, iat= 235, 259, r1= 1.30, r2= 1.80, r3= 4.12, r4= 4.62,  &end
#
# 567 TRP H 567 TRP HB2 3.86
 &rst
  ixpk= 0, nxpk= 0, iat= 235, 239, r1= 1.30, r2= 1.80, r3= 3.86, r4= 4.36,  &end
#
# 567 TRP H 567 TRP HB3 3.45
 &rst
  ixpk= 0, nxpk= 0, iat= 235, 240, r1= 1.30, r2= 1.80, r3= 3.45, r4= 3.95,  &end
#
# 569 ASP H 570 ASN H 2.90
 &rst
  ixpk= 0, nxpk= 0, iat= 274, 286, r1= 1.30, r2= 1.80, r3= 2.90, r4= 3.40,  &end
#
# 569 ASP H 571 LYS H 3.83
 &rst
  ixpk= 0, nxpk= 0, iat= 274, 300, r1= 1.30, r2= 1.80, r3= 3.83, r4= 4.33,  &end
#
# 568 GLU QG 569 ASP H 3.59
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 274, r1= 1.30, r2= 1.80, r3= 4.03, r4= 4.53,
 igr1= 266, 267,
 &end
#
# 569 ASP H 569 ASP HB2 4.00
 &rst
  ixpk= 0, nxpk= 0, iat= 274, 278, r1= 1.30, r2= 1.80, r3= 4.00, r4= 4.50,  &end
#
# 568 GLU HB2 569 ASP H 3.98
 &rst
  ixpk= 0, nxpk= 0, iat= 263, 274, r1= 1.30, r2= 1.80, r3= 3.98, r4= 4.48,  &end
#
# 568 GLU HB3 569 ASP H 4.04
 &rst
  ixpk= 0, nxpk= 0, iat= 264, 274, r1= 1.30, r2= 1.80, r3= 4.04, r4= 4.54,  &end
#
# 570 ASN H 571 LYS H 3.28
 &rst
  ixpk= 0, nxpk= 0, iat= 286, 300, r1= 1.30, r2= 1.80, r3= 3.28, r4= 3.78,  &end
#
# 570 ASN H 573 TYR QE 4.77
 &rst
  ixpk= 0, nxpk= 0, iat= 286,  -1, r1= 1.30, r2= 1.80, r3= 5.35, r4= 5.85,
 igr2= 352, 357,
 &end
#
# 570 ASN H 570 ASN HB3 3.91
 &rst
  ixpk= 0, nxpk= 0, iat= 286, 291, r1= 1.30, r2= 1.80, r3= 3.91, r4= 4.41,  &end
#
# 568 GLU QG 570 ASN H 4.92
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 286, r1= 1.30, r2= 1.80, r3= 5.52, r4= 6.02,
 igr1= 266, 267,
 &end
#
# 568 GLU HA 570 ASN H 5.09
 &rst
  ixpk= 0, nxpk= 0, iat= 261, 286, r1= 1.30, r2= 1.80, r3= 5.09, r4= 5.59,  &end
#
# 570 ASN H 570 ASN HB2 3.78
 &rst
  ixpk= 0, nxpk= 0, iat= 286, 290, r1= 1.30, r2= 1.80, r3= 3.78, r4= 4.28,  &end
#
# 566 TYR H 571 LYS H 4.12
 &rst
  ixpk= 0, nxpk= 0, iat= 214, 300, r1= 1.30, r2= 1.80, r3= 4.12, r4= 4.62,  &end
#
# 571 LYS H 573 TYR QE 3.70
 &rst
  ixpk= 0, nxpk= 0, iat= 300,  -1, r1= 1.30, r2= 1.80, r3= 4.15, r4= 4.65,
 igr2= 352, 357,
 &end
#
# 566 TYR HB2 571 LYS H 4.56
 &rst
  ixpk= 0, nxpk= 0, iat= 218, 300, r1= 1.30, r2= 1.80, r3= 4.56, r4= 5.06,  &end
#
# 566 TYR HB3 571 LYS H 4.56
 &rst
  ixpk= 0, nxpk= 0, iat= 219, 300, r1= 1.30, r2= 1.80, r3= 4.56, r4= 5.06,  &end
#
# 573 TYR H 573 TYR QD 4.16
 &rst
  ixpk= 0, nxpk= 0, iat= 342,  -1, r1= 1.30, r2= 1.80, r3= 4.67, r4= 5.17,
 igr2= 350, 359,
 &end
#
# 563 PHE QD 573 TYR H 4.58
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 342, r1= 1.30, r2= 1.80, r3= 5.14, r4= 5.64,
 igr1= 173, 181,
 &end
#
# 573 TYR H 573 TYR HB2 4.08
 &rst
  ixpk= 0, nxpk= 0, iat= 342, 346, r1= 1.30, r2= 1.80, r3= 4.08, r4= 4.58,  &end
#
# 572 PHE HB2 573 TYR H 4.34
 &rst
  ixpk= 0, nxpk= 0, iat= 326, 342, r1= 1.30, r2= 1.80, r3= 4.34, r4= 4.84,  &end
#
# 572 PHE HB3 573 TYR H 4.19
 &rst
  ixpk= 0, nxpk= 0, iat= 327, 342, r1= 1.30, r2= 1.80, r3= 4.19, r4= 4.69,  &end
#
# 587 ALA H 602 LEU H 5.01
 &rst
  ixpk= 0, nxpk= 0, iat= 549, 792, r1= 1.30, r2= 1.80, r3= 5.01, r4= 5.51,  &end
#
# 573 TYR QD 574 ARG H 4.24
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 363, r1= 1.30, r2= 1.80, r3= 4.76, r4= 5.26,
 igr1= 350, 359,
 &end
#
# 586 THR H 587 ALA H 5.14
 &rst
  ixpk= 0, nxpk= 0, iat= 535, 549, r1= 1.30, r2= 1.80, r3= 5.14, r4= 5.64,  &end
#
# 563 PHE QD 574 ARG H 5.21
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 363, r1= 1.30, r2= 1.80, r3= 5.85, r4= 6.35,
 igr1= 173, 181,
 &end
#
# 563 PHE QE 574 ARG H 5.40
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 363, r1= 1.30, r2= 1.80, r3= 6.06, r4= 6.56,
 igr1= 175, 179,
 &end
#
# 587 ALA H 601 LEU HA 4.34
 &rst
  ixpk= 0, nxpk= 0, iat= 549, 775, r1= 1.30, r2= 1.80, r3= 4.34, r4= 4.84,  &end
#
# 573 TYR HB3 574 ARG H 3.32
 &rst
  ixpk= 0, nxpk= 0, iat= 347, 363, r1= 1.30, r2= 1.80, r3= 3.32, r4= 3.82,  &end
#
# 573 TYR HB2 574 ARG H 4.09
 &rst
  ixpk= 0, nxpk= 0, iat= 346, 363, r1= 1.30, r2= 1.80, r3= 4.09, r4= 4.59,  &end
#
# 563 PHE HA 575 ALA H 3.97
 &rst
  ixpk= 0, nxpk= 0, iat= 167, 387, r1= 1.30, r2= 1.80, r3= 3.97, r4= 4.47,  &end
#
# 575 ALA H 575 ALA QB 3.85
 &rst
  ixpk= 0, nxpk= 0, iat= 387,  -1, r1= 1.30, r2= 1.80, r3= 4.62, r4= 5.12,
 igr2= 391, 392, 393,
 &end
#
# 575 ALA H 592 ILE QD1 4.22
 &rst
  ixpk= 0, nxpk= 0, iat= 387,  -1, r1= 1.30, r2= 1.80, r3= 5.07, r4= 5.57,
 igr2= 646, 647, 648,
 &end
#
# 576 GLU H 592 ILE H 4.34
 &rst
  ixpk= 0, nxpk= 0, iat= 397, 633, r1= 1.30, r2= 1.80, r3= 4.34, r4= 4.84,  &end
#
# 572 PHE H 573 TYR QE 5.15
 &rst
  ixpk= 0, nxpk= 0, iat= 322,  -1, r1= 1.30, r2= 1.80, r3= 5.78, r4= 6.28,
 igr2= 352, 357,
 &end
#
# 575 ALA HA 576 GLU H 3.08
 &rst
  ixpk= 0, nxpk= 0, iat= 389, 397, r1= 1.30, r2= 1.80, r3= 3.08, r4= 3.58,  &end
#
# 572 PHE H 572 PHE HB2 3.29
 &rst
  ixpk= 0, nxpk= 0, iat= 322, 326, r1= 1.30, r2= 1.80, r3= 3.29, r4= 3.79,  &end
#
# 572 PHE H 572 PHE HB3 3.69
 &rst
  ixpk= 0, nxpk= 0, iat= 322, 327, r1= 1.30, r2= 1.80, r3= 3.69, r4= 4.19,  &end
#
# 571 LYS QD 572 PHE H 4.26
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 322, r1= 1.30, r2= 1.80, r3= 4.78, r4= 5.28,
 igr1= 310, 311,
 &end
#
# 576 GLU H 576 GLU QB 3.23
 &rst
  ixpk= 0, nxpk= 0, iat= 397,  -1, r1= 1.30, r2= 1.80, r3= 3.63, r4= 4.13,
 igr2= 401, 402,
 &end
#
# 571 LYS HB3 572 PHE H 3.50
 &rst
  ixpk= 0, nxpk= 0, iat= 305, 322, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
# 576 GLU H 592 ILE HG13 3.94
 &rst
  ixpk= 0, nxpk= 0, iat= 397, 644, r1= 1.30, r2= 1.80, r3= 3.94, r4= 4.44,  &end
#
# 576 GLU H 592 ILE HG12 3.83
 &rst
  ixpk= 0, nxpk= 0, iat= 397, 643, r1= 1.30, r2= 1.80, r3= 3.83, r4= 4.33,  &end
#
# 575 ALA QB 576 GLU H 3.49
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 397, r1= 1.30, r2= 1.80, r3= 4.19, r4= 4.69,
 igr1= 391, 392, 393,
 &end
#
# 576 GLU H 592 ILE QD1 3.70
 &rst
  ixpk= 0, nxpk= 0, iat= 397,  -1, r1= 1.30, r2= 1.80, r3= 4.44, r4= 4.94,
 igr2= 646, 647, 648,
 &end
#
# 577 VAL H 578 GLU H 4.78
 &rst
  ixpk= 0, nxpk= 0, iat= 412, 428, r1= 1.30, r2= 1.80, r3= 4.78, r4= 5.28,  &end
#
# 562 CYS H 577 VAL H 4.24
 &rst
  ixpk= 0, nxpk= 0, iat= 154, 412, r1= 1.30, r2= 1.80, r3= 4.24, r4= 4.74,  &end
#
# 576 GLU H 577 VAL H 4.45
 &rst
  ixpk= 0, nxpk= 0, iat= 397, 412, r1= 1.30, r2= 1.80, r3= 4.45, r4= 4.95,  &end
#
# 576 GLU HA 577 VAL H 2.89
 &rst
  ixpk= 0, nxpk= 0, iat= 399, 412, r1= 1.30, r2= 1.80, r3= 2.89, r4= 3.39,  &end
#
# 559 GLY HA2 577 VAL H 5.43
 &rst
  ixpk= 0, nxpk= 0, iat= 122, 412, r1= 1.30, r2= 1.80, r3= 5.43, r4= 5.93,  &end
#
# 577 VAL H 577 VAL HB 3.22
 &rst
  ixpk= 0, nxpk= 0, iat= 412, 416, r1= 1.30, r2= 1.80, r3= 3.22, r4= 3.72,  &end
#
# 561 GLU QB 577 VAL H 4.70
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 412, r1= 1.30, r2= 1.80, r3= 5.28, r4= 5.78,
 igr1= 143, 144,
 &end
#
# 578 GLU H 578 GLU QG 4.41
 &rst
  ixpk= 0, nxpk= 0, iat= 428,  -1, r1= 1.30, r2= 1.80, r3= 4.95, r4= 5.45,
 igr2= 435, 436,
 &end
#
# 578 GLU H 588 VAL HB 3.89
 &rst
  ixpk= 0, nxpk= 0, iat= 428, 563, r1= 1.30, r2= 1.80, r3= 3.89, r4= 4.39,  &end
#
# 578 GLU H 579 ALA H 3.08
 &rst
  ixpk= 0, nxpk= 0, iat= 428, 443, r1= 1.30, r2= 1.80, r3= 3.08, r4= 3.58,  &end
#
# 579 ALA H 588 VAL H 3.53
 &rst
  ixpk= 0, nxpk= 0, iat= 443, 559, r1= 1.30, r2= 1.80, r3= 3.53, r4= 4.03,  &end
#
# 579 ALA H 589 VAL HA 4.18
 &rst
  ixpk= 0, nxpk= 0, iat= 443, 577, r1= 1.30, r2= 1.80, r3= 4.18, r4= 4.68,  &end
#
# 579 ALA H 588 VAL HB 2.92
 &rst
  ixpk= 0, nxpk= 0, iat= 443, 563, r1= 1.30, r2= 1.80, r3= 2.92, r4= 3.42,  &end
#
# 579 ALA H 588 VAL QG1 4.32
 &rst
  ixpk= 0, nxpk= 0, iat= 443,  -1, r1= 1.30, r2= 1.80, r3= 5.19, r4= 5.69,
 igr2= 565, 566, 567,
 &end
#
# 579 ALA H 588 VAL QG2 4.51
 &rst
  ixpk= 0, nxpk= 0, iat= 443,  -1, r1= 1.30, r2= 1.80, r3= 5.42, r4= 5.92,
 igr2= 569, 570, 571,
 &end
#
# 557 LYS HA 580 LEU H 4.19
 &rst
  ixpk= 0, nxpk= 0, iat=  86, 453, r1= 1.30, r2= 1.80, r3= 4.19, r4= 4.69,  &end
#
# 580 LEU H 580 LEU QB 3.49
 &rst
  ixpk= 0, nxpk= 0, iat= 453,  -1, r1= 1.30, r2= 1.80, r3= 3.92, r4= 4.42,
 igr2= 457, 458,
 &end
#
# 580 LEU H 580 LEU HG 3.68
 &rst
  ixpk= 0, nxpk= 0, iat= 453, 460, r1= 1.30, r2= 1.80, r3= 3.68, r4= 4.18,  &end
#
# 580 LEU H 580 LEU QD1 4.63
 &rst
  ixpk= 0, nxpk= 0, iat= 453,  -1, r1= 1.30, r2= 1.80, r3= 5.56, r4= 6.06,
 igr2= 462, 463, 464,
 &end
#
# 580 LEU H 580 LEU QD2 4.63
 &rst
  ixpk= 0, nxpk= 0, iat= 453,  -1, r1= 1.30, r2= 1.80, r3= 5.56, r4= 6.06,
 igr2= 466, 467, 468,
 &end
#
# 580 LEU HA 581 HIS H 2.82
 &rst
  ixpk= 0, nxpk= 0, iat= 455, 472, r1= 1.30, r2= 1.80, r3= 2.82, r4= 3.32,  &end
#
# 580 LEU QB 581 HIS H 3.90
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 472, r1= 1.30, r2= 1.80, r3= 4.38, r4= 4.88,
 igr1= 457, 458,
 &end
#
# 602 LEU H 603 SER H 3.86
 &rst
  ixpk= 0, nxpk= 0, iat= 792, 811, r1= 1.30, r2= 1.80, r3= 3.86, r4= 4.36,  &end
#
# 603 SER H 605 ILE H 4.51
 &rst
  ixpk= 0, nxpk= 0, iat= 811, 836, r1= 1.30, r2= 1.80, r3= 4.51, r4= 5.01,  &end
#
# 601 LEU HG 603 SER H 3.54
 &rst
  ixpk= 0, nxpk= 0, iat= 780, 811, r1= 1.30, r2= 1.80, r3= 3.54, r4= 4.04,  &end
#
# 602 LEU QB 603 SER H 3.43
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 811, r1= 1.30, r2= 1.80, r3= 3.85, r4= 4.35,
 igr1= 796, 797,
 &end
#
# 602 LEU HG 603 SER H 4.48
 &rst
  ixpk= 0, nxpk= 0, iat= 799, 811, r1= 1.30, r2= 1.80, r3= 4.48, r4= 4.98,  &end
#
# 601 LEU QQD 603 SER H 3.98
 &rst
  ixpk= 0, nxpk= 0, iat= 779, 811, r1= 1.30, r2= 1.80, r3= 6.18, r4= 6.68,  &end
#
# 585 MET H 585 MET QB 3.92
 &rst
  ixpk= 0, nxpk= 0, iat= 518,  -1, r1= 1.30, r2= 1.80, r3= 4.40, r4= 4.90,
 igr2= 522, 523,
 &end
#
# 585 MET H 586 THR H 3.83
 &rst
  ixpk= 0, nxpk= 0, iat= 518, 535, r1= 1.30, r2= 1.80, r3= 3.83, r4= 4.33,  &end
#
# 585 MET QB 586 THR H 4.23
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 535, r1= 1.30, r2= 1.80, r3= 4.75, r4= 5.25,
 igr1= 522, 523,
 &end
#
# 585 MET QE 586 THR H 4.78
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 535, r1= 1.30, r2= 1.80, r3= 5.74, r4= 6.24,
 igr1= 529, 530, 531,
 &end
#
# 578 GLU H 588 VAL H 4.78
 &rst
  ixpk= 0, nxpk= 0, iat= 428, 559, r1= 1.30, r2= 1.80, r3= 4.78, r4= 5.28,  &end
#
# 587 ALA H 588 VAL H 4.92
 &rst
  ixpk= 0, nxpk= 0, iat= 549, 559, r1= 1.30, r2= 1.80, r3= 4.92, r4= 5.42,  &end
#
# 588 VAL H 589 VAL H 5.29
 &rst
  ixpk= 0, nxpk= 0, iat= 559, 575, r1= 1.30, r2= 1.80, r3= 5.29, r4= 5.79,  &end
#
# 581 HIS H 588 VAL H 4.55
 &rst
  ixpk= 0, nxpk= 0, iat= 472, 559, r1= 1.30, r2= 1.80, r3= 4.55, r4= 5.05,  &end
#
# 596 ASN HA 597 TYR H 2.95
 &rst
  ixpk= 0, nxpk= 0, iat= 694, 706, r1= 1.30, r2= 1.80, r3= 2.95, r4= 3.45,  &end
#
# 597 TYR H 597 TYR HB2 4.06
 &rst
  ixpk= 0, nxpk= 0, iat= 706, 710, r1= 1.30, r2= 1.80, r3= 4.06, r4= 4.56,  &end
#
# 588 VAL H 588 VAL HB 3.38
 &rst
  ixpk= 0, nxpk= 0, iat= 559, 563, r1= 1.30, r2= 1.80, r3= 3.38, r4= 3.88,  &end
#
# 577 VAL QG1 588 VAL H 4.87
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 559, r1= 1.30, r2= 1.80, r3= 5.85, r4= 6.35,
 igr1= 418, 419, 420,
 &end
#
# 589 VAL H 598 GLU H 3.69
 &rst
  ixpk= 0, nxpk= 0, iat= 575, 727, r1= 1.30, r2= 1.80, r3= 3.69, r4= 4.19,  &end
#
# 589 VAL H 597 TYR HA 4.49
 &rst
  ixpk= 0, nxpk= 0, iat= 575, 708, r1= 1.30, r2= 1.80, r3= 4.49, r4= 4.99,  &end
#
# 588 VAL HA 589 VAL H 2.79
 &rst
  ixpk= 0, nxpk= 0, iat= 561, 575, r1= 1.30, r2= 1.80, r3= 2.79, r4= 3.29,  &end
#
# 589 VAL H 590 LYS HA 4.86
 &rst
  ixpk= 0, nxpk= 0, iat= 575, 593, r1= 1.30, r2= 1.80, r3= 4.86, r4= 5.36,  &end
#
# 578 GLU QB 589 VAL H 4.93
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 575, r1= 1.30, r2= 1.80, r3= 5.53, r4= 6.03,
 igr1= 432, 433,
 &end
#
# 589 VAL H 600 VAL QQG 4.57
 &rst
  ixpk= 0, nxpk= 0, iat= 575, 760, r1= 1.30, r2= 1.80, r3= 6.77, r4= 7.27,  &end
#
# 589 VAL H 589 VAL QG2 3.03
 &rst
  ixpk= 0, nxpk= 0, iat= 575,  -1, r1= 1.30, r2= 1.80, r3= 3.64, r4= 4.14,
 igr2= 585, 586, 587,
 &end
#
# 591 PHE H 591 PHE QD 3.81
 &rst
  ixpk= 0, nxpk= 0, iat= 613,  -1, r1= 1.30, r2= 1.80, r3= 4.28, r4= 4.78,
 igr2= 621, 629,
 &end
#
# 591 PHE H 597 TYR HA 3.73
 &rst
  ixpk= 0, nxpk= 0, iat= 613, 708, r1= 1.30, r2= 1.80, r3= 3.73, r4= 4.23,  &end
#
# 590 LYS HA 591 PHE H 2.95
 &rst
  ixpk= 0, nxpk= 0, iat= 593, 613, r1= 1.30, r2= 1.80, r3= 2.95, r4= 3.45,  &end
#
# 591 PHE H 591 PHE QB 3.07
 &rst
  ixpk= 0, nxpk= 0, iat= 613,  -1, r1= 1.30, r2= 1.80, r3= 3.45, r4= 3.95,
 igr2= 617, 618,
 &end
#
# 590 LYS HG2 591 PHE H 4.32
 &rst
  ixpk= 0, nxpk= 0, iat= 598, 613, r1= 1.30, r2= 1.80, r3= 4.32, r4= 4.82,  &end
#
# 590 LYS HG3 591 PHE H 4.01
 &rst
  ixpk= 0, nxpk= 0, iat= 599, 613, r1= 1.30, r2= 1.80, r3= 4.01, r4= 4.51,  &end
#
# 556 TRP H 556 TRP HD1 4.16
 &rst
  ixpk= 0, nxpk= 0, iat=  60,  68, r1= 1.30, r2= 1.80, r3= 4.16, r4= 4.66,  &end
#
# 591 PHE HA 592 ILE H 2.78
 &rst
  ixpk= 0, nxpk= 0, iat= 615, 633, r1= 1.30, r2= 1.80, r3= 2.78, r4= 3.28,  &end
#
# 556 TRP H 556 TRP HB2 3.16
 &rst
  ixpk= 0, nxpk= 0, iat=  60,  64, r1= 1.30, r2= 1.80, r3= 3.16, r4= 3.66,  &end
#
# 592 ILE HB 593 ASP H 4.04
 &rst
  ixpk= 0, nxpk= 0, iat= 637, 652, r1= 1.30, r2= 1.80, r3= 4.04, r4= 4.54,  &end
#
# 591 PHE QB 595 GLY H 4.39
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 685, r1= 1.30, r2= 1.80, r3= 4.93, r4= 5.43,
 igr1= 617, 618,
 &end
#
# 595 GLY H 596 ASN H 3.47
 &rst
  ixpk= 0, nxpk= 0, iat= 685, 692, r1= 1.30, r2= 1.80, r3= 3.47, r4= 3.97,  &end
#
# 591 PHE QD 596 ASN H 4.58
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 692, r1= 1.30, r2= 1.80, r3= 5.14, r4= 5.64,
 igr1= 621, 629,
 &end
#
# 591 PHE QB 596 ASN H 3.40
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 692, r1= 1.30, r2= 1.80, r3= 3.82, r4= 4.32,
 igr1= 617, 618,
 &end
#
# 597 TYR H 598 GLU H 4.57
 &rst
  ixpk= 0, nxpk= 0, iat= 706, 727, r1= 1.30, r2= 1.80, r3= 4.57, r4= 5.07,  &end
#
# 588 VAL HA 598 GLU H 4.50
 &rst
  ixpk= 0, nxpk= 0, iat= 561, 727, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
# 590 LYS HA 598 GLU H 4.18
 &rst
  ixpk= 0, nxpk= 0, iat= 593, 727, r1= 1.30, r2= 1.80, r3= 4.18, r4= 4.68,  &end
#
# 597 TYR HB2 598 GLU H 4.22
 &rst
  ixpk= 0, nxpk= 0, iat= 710, 727, r1= 1.30, r2= 1.80, r3= 4.22, r4= 4.72,  &end
#
# 598 GLU H 598 GLU QG 4.22
 &rst
  ixpk= 0, nxpk= 0, iat= 727,  -1, r1= 1.30, r2= 1.80, r3= 4.74, r4= 5.24,
 igr2= 734, 735,
 &end
#
# 598 GLU HA 599 GLU H 2.81
 &rst
  ixpk= 0, nxpk= 0, iat= 729, 742, r1= 1.30, r2= 1.80, r3= 2.81, r4= 3.31,  &end
#
# 598 GLU QB 599 GLU H 3.39
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 742, r1= 1.30, r2= 1.80, r3= 3.81, r4= 4.31,
 igr1= 731, 732,
 &end
#
# 599 GLU H 599 GLU QB 2.88
 &rst
  ixpk= 0, nxpk= 0, iat= 742,  -1, r1= 1.30, r2= 1.80, r3= 3.23, r4= 3.73,
 igr2= 746, 747,
 &end
#
# 588 VAL QG1 599 GLU H 4.37
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 742, r1= 1.30, r2= 1.80, r3= 5.25, r4= 5.75,
 igr1= 565, 566, 567,
 &end
#
# 599 GLU QB 600 VAL H 3.33
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 757, r1= 1.30, r2= 1.80, r3= 3.74, r4= 4.24,
 igr1= 746, 747,
 &end
#
# 600 VAL H 601 LEU H 4.34
 &rst
  ixpk= 0, nxpk= 0, iat= 757, 773, r1= 1.30, r2= 1.80, r3= 4.34, r4= 4.84,  &end
#
# 601 LEU H 602 LEU H 4.77
 &rst
  ixpk= 0, nxpk= 0, iat= 773, 792, r1= 1.30, r2= 1.80, r3= 4.77, r4= 5.27,  &end
#
# 601 LEU H 604 ASN HB2 4.73
 &rst
  ixpk= 0, nxpk= 0, iat= 773, 826, r1= 1.30, r2= 1.80, r3= 4.73, r4= 5.23,  &end
#
# 601 LEU H 604 ASN HB3 4.73
 &rst
  ixpk= 0, nxpk= 0, iat= 773, 827, r1= 1.30, r2= 1.80, r3= 4.73, r4= 5.23,  &end
#
# 600 VAL HB 601 LEU H 4.26
 &rst
  ixpk= 0, nxpk= 0, iat= 761, 773, r1= 1.30, r2= 1.80, r3= 4.26, r4= 4.76,  &end
#
# 601 LEU H 601 LEU QB 2.89
 &rst
  ixpk= 0, nxpk= 0, iat= 773,  -1, r1= 1.30, r2= 1.80, r3= 3.24, r4= 3.74,
 igr2= 777, 778,
 &end
#
# 600 VAL QQG 601 LEU H 3.73
 &rst
  ixpk= 0, nxpk= 0, iat= 760, 773, r1= 1.30, r2= 1.80, r3= 5.93, r4= 6.43,  &end
#
# 601 LEU H 601 LEU QQD 3.69
 &rst
  ixpk= 0, nxpk= 0, iat= 773, 779, r1= 1.30, r2= 1.80, r3= 5.89, r4= 6.39,  &end
#
# 602 LEU H 604 ASN H 4.43
 &rst
  ixpk= 0, nxpk= 0, iat= 792, 822, r1= 1.30, r2= 1.80, r3= 4.43, r4= 4.93,  &end
#
# 602 LEU H 602 LEU QB 3.06
 &rst
  ixpk= 0, nxpk= 0, iat= 792,  -1, r1= 1.30, r2= 1.80, r3= 3.43, r4= 3.93,
 igr2= 796, 797,
 &end
#
# 602 LEU H 602 LEU HG 3.47
 &rst
  ixpk= 0, nxpk= 0, iat= 792, 799, r1= 1.30, r2= 1.80, r3= 3.47, r4= 3.97,  &end
#
# 601 LEU QQD 602 LEU H 3.47
 &rst
  ixpk= 0, nxpk= 0, iat= 779, 792, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,  &end
#
# 601 LEU H 604 ASN H 5.29
 &rst
  ixpk= 0, nxpk= 0, iat= 773, 822, r1= 1.30, r2= 1.80, r3= 5.29, r4= 5.79,  &end
#
# 603 SER H 604 ASN H 3.46
 &rst
  ixpk= 0, nxpk= 0, iat= 811, 822, r1= 1.30, r2= 1.80, r3= 3.46, r4= 3.96,  &end
#
# 604 ASN H 605 ILE H 3.12
 &rst
  ixpk= 0, nxpk= 0, iat= 822, 836, r1= 1.30, r2= 1.80, r3= 3.12, r4= 3.62,  &end
#
# 602 LEU HA 604 ASN H 4.10
 &rst
  ixpk= 0, nxpk= 0, iat= 794, 822, r1= 1.30, r2= 1.80, r3= 4.10, r4= 4.60,  &end
#
# 604 ASN H 604 ASN HB2 3.63
 &rst
  ixpk= 0, nxpk= 0, iat= 822, 826, r1= 1.30, r2= 1.80, r3= 3.63, r4= 4.13,  &end
#
# 604 ASN H 604 ASN HB3 3.63
 &rst
  ixpk= 0, nxpk= 0, iat= 822, 827, r1= 1.30, r2= 1.80, r3= 3.63, r4= 4.13,  &end
#
# 601 LEU QB 604 ASN H 3.31
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 822, r1= 1.30, r2= 1.80, r3= 3.72, r4= 4.22,
 igr1= 777, 778,
 &end
#
# 601 LEU QQD 604 ASN H 4.11
 &rst
  ixpk= 0, nxpk= 0, iat= 779, 822, r1= 1.30, r2= 1.80, r3= 6.31, r4= 6.81,  &end
#
# 605 ILE H 606 LYS H 4.51
 &rst
  ixpk= 0, nxpk= 0, iat= 836, 855, r1= 1.30, r2= 1.80, r3= 4.51, r4= 5.01,  &end
#
# 603 SER HA 605 ILE H 4.34
 &rst
  ixpk= 0, nxpk= 0, iat= 813, 836, r1= 1.30, r2= 1.80, r3= 4.34, r4= 4.84,  &end
#
# 602 LEU HA 605 ILE H 4.45
 &rst
  ixpk= 0, nxpk= 0, iat= 794, 836, r1= 1.30, r2= 1.80, r3= 4.45, r4= 4.95,  &end
#
# 604 ASN HB3 605 ILE H 4.09
 &rst
  ixpk= 0, nxpk= 0, iat= 827, 836, r1= 1.30, r2= 1.80, r3= 4.09, r4= 4.59,  &end
#
# 601 LEU QB 605 ILE H 5.11
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 836, r1= 1.30, r2= 1.80, r3= 5.74, r4= 6.24,
 igr1= 777, 778,
 &end
#
# 602 LEU QB 605 ILE H 5.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 836, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 796, 797,
 &end
#
# 605 ILE H 605 ILE QD1 3.87
 &rst
  ixpk= 0, nxpk= 0, iat= 836,  -1, r1= 1.30, r2= 1.80, r3= 4.65, r4= 5.15,
 igr2= 849, 850, 851,
 &end
#
# 564 ALA HA 606 LYS H 4.02
 &rst
  ixpk= 0, nxpk= 0, iat= 187, 855, r1= 1.30, r2= 1.80, r3= 4.02, r4= 4.52,  &end
#
# 605 ILE HA 606 LYS H 2.99
 &rst
  ixpk= 0, nxpk= 0, iat= 838, 855, r1= 1.30, r2= 1.80, r3= 2.99, r4= 3.49,  &end
#
# 563 PHE HB3 606 LYS H 4.41
 &rst
  ixpk= 0, nxpk= 0, iat= 170, 855, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,  &end
#
# 565 LEU HB2 606 LYS H 5.10
 &rst
  ixpk= 0, nxpk= 0, iat= 199, 855, r1= 1.30, r2= 1.80, r3= 5.10, r4= 5.60,  &end
#
# 564 ALA QB 606 LYS H 4.65
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 855, r1= 1.30, r2= 1.80, r3= 5.58, r4= 6.08,
 igr1= 189, 190, 191,
 &end
#
# 563 PHE H 608 ILE H 4.73
 &rst
  ixpk= 0, nxpk= 0, iat= 165, 891, r1= 1.30, r2= 1.80, r3= 4.73, r4= 5.23,  &end
#
# 556 TRP HH2 608 ILE H 4.86
 &rst
  ixpk= 0, nxpk= 0, iat=  75, 891, r1= 1.30, r2= 1.80, r3= 4.86, r4= 5.36,  &end
#
# 607 PRO HA 608 ILE H 2.75
 &rst
  ixpk= 0, nxpk= 0, iat= 887, 891, r1= 1.30, r2= 1.80, r3= 2.75, r4= 3.25,  &end
#
# 607 PRO HB2 608 ILE H 3.46
 &rst
  ixpk= 0, nxpk= 0, iat= 884, 891, r1= 1.30, r2= 1.80, r3= 3.46, r4= 3.96,  &end
#
# 608 ILE H 608 ILE HB 3.04
 &rst
  ixpk= 0, nxpk= 0, iat= 891, 895, r1= 1.30, r2= 1.80, r3= 3.04, r4= 3.54,  &end
#
# 608 ILE H 608 ILE QG1 3.66
 &rst
  ixpk= 0, nxpk= 0, iat= 891,  -1, r1= 1.30, r2= 1.80, r3= 4.11, r4= 4.61,
 igr2= 901, 902,
 &end
#
# 608 ILE H 608 ILE QD1 4.48
 &rst
  ixpk= 0, nxpk= 0, iat= 891,  -1, r1= 1.30, r2= 1.80, r3= 5.38, r4= 5.88,
 igr2= 904, 905, 906,
 &end
#
# 566 TYR QD 567 TRP HE1 4.44
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 245, r1= 1.30, r2= 1.80, r3= 4.98, r4= 5.48,
 igr1= 222, 231,
 &end
#
# 556 TRP HB2 556 TRP HE1 4.80
 &rst
  ixpk= 0, nxpk= 0, iat=  64,  70, r1= 1.30, r2= 1.80, r3= 4.80, r4= 5.30,  &end
#
# 556 TRP HE1 602 LEU QB 4.23
 &rst
  ixpk= 0, nxpk= 0, iat=  70,  -1, r1= 1.30, r2= 1.80, r3= 4.75, r4= 5.25,
 igr2= 796, 797,
 &end
#
# 556 TRP HE1 605 ILE QG2 3.67
 &rst
  ixpk= 0, nxpk= 0, iat=  70,  -1, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,
 igr2= 842, 843, 844,
 &end
#
# 556 TRP HE1 605 ILE QD1 3.64
 &rst
  ixpk= 0, nxpk= 0, iat=  70,  -1, r1= 1.30, r2= 1.80, r3= 4.37, r4= 4.87,
 igr2= 849, 850, 851,
 &end
#
# 608 ILE H 609 LEU H 4.27
 &rst
  ixpk= 0, nxpk= 0, iat= 891, 910, r1= 1.30, r2= 1.80, r3= 4.27, r4= 4.77,  &end
#
# 607 PRO HB3 609 LEU H 4.52
 &rst
  ixpk= 0, nxpk= 0, iat= 885, 910, r1= 1.30, r2= 1.80, r3= 4.52, r4= 5.02,  &end
#
# 608 ILE HB 609 LEU H 4.00
 &rst
  ixpk= 0, nxpk= 0, iat= 895, 910, r1= 1.30, r2= 1.80, r3= 4.00, r4= 4.50,  &end
#
# 609 LEU H 609 LEU QB 3.28
 &rst
  ixpk= 0, nxpk= 0, iat= 910,  -1, r1= 1.30, r2= 1.80, r3= 3.68, r4= 4.18,
 igr2= 914, 915,
 &end
#
# 558 PRO HB3 559 GLY H 4.50
 &rst
  ixpk= 0, nxpk= 0, iat= 114, 120, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
# 599 GLU H 599 GLU QG 4.47
 &rst
  ixpk= 0, nxpk= 0, iat= 742,  -1, r1= 1.30, r2= 1.80, r3= 5.02, r4= 5.52,
 igr2= 749, 750,
 &end
#
# 556 TRP H 557 LYS H 4.63
 &rst
  ixpk= 0, nxpk= 0, iat=  60,  84, r1= 1.30, r2= 1.80, r3= 4.63, r4= 5.13,  &end
#
# 556 TRP HB2 557 LYS H 4.17
 &rst
  ixpk= 0, nxpk= 0, iat=  64,  84, r1= 1.30, r2= 1.80, r3= 4.17, r4= 4.67,  &end
#
# 559 GLY H 580 LEU HG 5.21
 &rst
  ixpk= 0, nxpk= 0, iat= 120, 460, r1= 1.30, r2= 1.80, r3= 5.21, r4= 5.71,  &end
#
# 561 GLU H 577 VAL HB 4.80
 &rst
  ixpk= 0, nxpk= 0, iat= 139, 416, r1= 1.30, r2= 1.80, r3= 4.80, r4= 5.30,  &end
#
# 562 CYS H 577 VAL HB 5.03
 &rst
  ixpk= 0, nxpk= 0, iat= 154, 416, r1= 1.30, r2= 1.80, r3= 5.03, r4= 5.53,  &end
#
# 565 LEU HB2 566 TYR H 4.73
 &rst
  ixpk= 0, nxpk= 0, iat= 199, 214, r1= 1.30, r2= 1.80, r3= 4.73, r4= 5.23,  &end
#
# 566 TYR H 567 TRP H 4.61
 &rst
  ixpk= 0, nxpk= 0, iat= 214, 235, r1= 1.30, r2= 1.80, r3= 4.61, r4= 5.11,  &end
#
# 561 GLU HA 576 GLU H 4.55
 &rst
  ixpk= 0, nxpk= 0, iat= 141, 397, r1= 1.30, r2= 1.80, r3= 4.55, r4= 5.05,  &end
#
# 587 ALA H 600 VAL H 3.10
 &rst
  ixpk= 0, nxpk= 0, iat= 549, 757, r1= 1.30, r2= 1.80, r3= 3.10, r4= 3.60,  &end
#
# 556 TRP H 556 TRP HB3 3.77
 &rst
  ixpk= 0, nxpk= 0, iat=  60,  65, r1= 1.30, r2= 1.80, r3= 3.77, r4= 4.27,  &end
#
# 591 PHE QB 592 ILE H 3.94
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 633, r1= 1.30, r2= 1.80, r3= 4.42, r4= 4.92,
 igr1= 617, 618,
 &end
#
# 580 LEU HA 588 VAL H 3.41
 &rst
  ixpk= 0, nxpk= 0, iat= 455, 559, r1= 1.30, r2= 1.80, r3= 3.41, r4= 3.91,  &end
#
# 588 VAL HA 599 GLU H 4.69
 &rst
  ixpk= 0, nxpk= 0, iat= 561, 742, r1= 1.30, r2= 1.80, r3= 4.69, r4= 5.19,  &end
#
# 600 VAL QQG 605 ILE H 4.06
 &rst
  ixpk= 0, nxpk= 0, iat= 760, 836, r1= 1.30, r2= 1.80, r3= 6.26, r4= 6.76,  &end
#
# 568 GLU H 568 GLU HB2 3.34
 &rst
  ixpk= 0, nxpk= 0, iat= 259, 263, r1= 1.30, r2= 1.80, r3= 3.34, r4= 3.84,  &end
#
# 568 GLU H 568 GLU HB3 3.21
 &rst
  ixpk= 0, nxpk= 0, iat= 259, 264, r1= 1.30, r2= 1.80, r3= 3.21, r4= 3.71,  &end
#
# 568 GLU H 569 ASP H 3.65
 &rst
  ixpk= 0, nxpk= 0, iat= 259, 274, r1= 1.30, r2= 1.80, r3= 3.65, r4= 4.15,  &end
#
# 556 TRP HA 556 TRP HD1 4.57
 &rst
  ixpk= 0, nxpk= 0, iat=  62,  68, r1= 1.30, r2= 1.80, r3= 4.57, r4= 5.07,  &end
#
# 556 TRP HD1 602 LEU QB 3.80
 &rst
  ixpk= 0, nxpk= 0, iat=  68,  -1, r1= 1.30, r2= 1.80, r3= 4.27, r4= 4.77,
 igr2= 796, 797,
 &end
#
# 556 TRP HD1 605 ILE HB 4.03
 &rst
  ixpk= 0, nxpk= 0, iat=  68, 840, r1= 1.30, r2= 1.80, r3= 4.03, r4= 4.53,  &end
#
# 556 TRP HD1 605 ILE QD1 4.06
 &rst
  ixpk= 0, nxpk= 0, iat=  68,  -1, r1= 1.30, r2= 1.80, r3= 4.88, r4= 5.38,
 igr2= 849, 850, 851,
 &end
#
# 556 TRP HD1 604 ASN H 5.50
 &rst
  ixpk= 0, nxpk= 0, iat=  68, 822, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
# 556 TRP HZ2 607 PRO HA 3.89
 &rst
  ixpk= 0, nxpk= 0, iat=  73, 887, r1= 1.30, r2= 1.80, r3= 3.89, r4= 4.39,  &end
#
# 556 TRP HH2 607 PRO HA 2.98
 &rst
  ixpk= 0, nxpk= 0, iat=  75, 887, r1= 1.30, r2= 1.80, r3= 2.98, r4= 3.48,  &end
#
# 556 TRP HH2 560 ASP QB 4.86
 &rst
  ixpk= 0, nxpk= 0, iat=  75,  -1, r1= 1.30, r2= 1.80, r3= 5.46, r4= 5.96,
 igr2= 131, 132,
 &end
#
# 556 TRP HH2 562 CYS HB2 4.43
 &rst
  ixpk= 0, nxpk= 0, iat=  75, 158, r1= 1.30, r2= 1.80, r3= 4.43, r4= 4.93,  &end
#
# 567 TRP HB3 567 TRP HD1 3.31
 &rst
  ixpk= 0, nxpk= 0, iat= 240, 243, r1= 1.30, r2= 1.80, r3= 3.31, r4= 3.81,  &end
#
# 567 TRP H 567 TRP HD1 3.04
 &rst
  ixpk= 0, nxpk= 0, iat= 235, 243, r1= 1.30, r2= 1.80, r3= 3.04, r4= 3.54,  &end
#
# 567 TRP HA 567 TRP HD1 4.59
 &rst
  ixpk= 0, nxpk= 0, iat= 237, 243, r1= 1.30, r2= 1.80, r3= 4.59, r4= 5.09,  &end
#
# 567 TRP HB2 567 TRP HD1 3.88
 &rst
  ixpk= 0, nxpk= 0, iat= 239, 243, r1= 1.30, r2= 1.80, r3= 3.88, r4= 4.38,  &end
#
# 567 TRP HD1 568 GLU HB3 5.50
 &rst
  ixpk= 0, nxpk= 0, iat= 243, 264, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
# 566 TYR QD 567 TRP H 3.51
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 235, r1= 1.30, r2= 1.80, r3= 3.94, r4= 4.44,
 igr1= 222, 231,
 &end
#
# 566 TYR HA 566 TYR QD 3.11
 &rst
  ixpk= 0, nxpk= 0, iat= 216,  -1, r1= 1.30, r2= 1.80, r3= 3.49, r4= 3.99,
 igr2= 222, 231,
 &end
#
# 566 TYR QD 568 GLU H 4.34
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 259, r1= 1.30, r2= 1.80, r3= 4.87, r4= 5.37,
 igr1= 222, 231,
 &end
#
# 566 TYR QD 568 GLU QG 3.71
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.67, r4= 5.17,
 igr1= 222, 231,
 igr2= 266, 267,
 &end
#
# 566 TYR QD 567 TRP HD1 3.55
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 243, r1= 1.30, r2= 1.80, r3= 3.98, r4= 4.48,
 igr1= 222, 231,
 &end
#
# 566 TYR H 566 TYR QD 4.13
 &rst
  ixpk= 0, nxpk= 0, iat= 214,  -1, r1= 1.30, r2= 1.80, r3= 4.64, r4= 5.14,
 igr2= 222, 231,
 &end
#
# 597 TYR HA 597 TYR QD 3.76
 &rst
  ixpk= 0, nxpk= 0, iat= 708,  -1, r1= 1.30, r2= 1.80, r3= 4.22, r4= 4.72,
 igr2= 714, 723,
 &end
#
# 596 ASN HA 597 TYR QD 3.66
 &rst
  ixpk= 0, nxpk= 0, iat= 694,  -1, r1= 1.30, r2= 1.80, r3= 4.11, r4= 4.61,
 igr2= 714, 723,
 &end
#
# 588 VAL HB 597 TYR QD 4.14
 &rst
  ixpk= 0, nxpk= 0, iat= 563,  -1, r1= 1.30, r2= 1.80, r3= 4.65, r4= 5.15,
 igr2= 714, 723,
 &end
#
# 590 LYS HB3 597 TYR QD 4.02
 &rst
  ixpk= 0, nxpk= 0, iat= 596,  -1, r1= 1.30, r2= 1.80, r3= 4.51, r4= 5.01,
 igr2= 714, 723,
 &end
#
# 590 LYS HD3 597 TYR QD 4.13
 &rst
  ixpk= 0, nxpk= 0, iat= 602,  -1, r1= 1.30, r2= 1.80, r3= 4.64, r4= 5.14,
 igr2= 714, 723,
 &end
#
# 590 LYS HB2 597 TYR QD 3.80
 &rst
  ixpk= 0, nxpk= 0, iat= 595,  -1, r1= 1.30, r2= 1.80, r3= 4.27, r4= 4.77,
 igr2= 714, 723,
 &end
#
# 588 VAL QG1 597 TYR QD 3.07
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.14, r4= 4.64,
 igr1= 565, 566, 567,
 igr2= 714, 723,
 &end
#
# 590 LYS HG3 597 TYR QD 4.85
 &rst
  ixpk= 0, nxpk= 0, iat= 599,  -1, r1= 1.30, r2= 1.80, r3= 5.44, r4= 5.94,
 igr2= 714, 723,
 &end
#
# 597 TYR H 597 TYR QD 3.30
 &rst
  ixpk= 0, nxpk= 0, iat= 706,  -1, r1= 1.30, r2= 1.80, r3= 3.70, r4= 4.20,
 igr2= 714, 723,
 &end
#
# 597 TYR HA 597 TYR QE 5.50
 &rst
  ixpk= 0, nxpk= 0, iat= 708,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2= 716, 721,
 &end
#
# 596 ASN QB 597 TYR QE 4.77
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.01, r4= 6.51,
 igr1= 696, 697,
 igr2= 716, 721,
 &end
#
# 590 LYS HD2 597 TYR QE 3.32
 &rst
  ixpk= 0, nxpk= 0, iat= 601,  -1, r1= 1.30, r2= 1.80, r3= 3.73, r4= 4.23,
 igr2= 716, 721,
 &end
#
# 588 VAL QG1 597 TYR QE 3.70
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.99, r4= 5.49,
 igr1= 565, 566, 567,
 igr2= 716, 721,
 &end
#
# 597 TYR H 597 TYR QE 3.83
 &rst
  ixpk= 0, nxpk= 0, iat= 706,  -1, r1= 1.30, r2= 1.80, r3= 4.30, r4= 4.80,
 igr2= 716, 721,
 &end
#
# 566 TYR QD 573 TYR QD 4.10
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.17, r4= 5.67,
 igr1= 222, 231,
 igr2= 350, 359,
 &end
#
# 571 LYS H 573 TYR QD 4.50
 &rst
  ixpk= 0, nxpk= 0, iat= 300,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2= 350, 359,
 &end
#
# 572 PHE H 573 TYR QD 4.96
 &rst
  ixpk= 0, nxpk= 0, iat= 322,  -1, r1= 1.30, r2= 1.80, r3= 5.57, r4= 6.07,
 igr2= 350, 359,
 &end
#
# 566 TYR H 573 TYR QD 3.74
 &rst
  ixpk= 0, nxpk= 0, iat= 214,  -1, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
 igr2= 350, 359,
 &end
#
# 573 TYR HA 573 TYR QD 3.29
 &rst
  ixpk= 0, nxpk= 0, iat= 344,  -1, r1= 1.30, r2= 1.80, r3= 3.69, r4= 4.19,
 igr2= 350, 359,
 &end
#
# 571 LYS HA 573 TYR QD 5.50
 &rst
  ixpk= 0, nxpk= 0, iat= 302,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2= 350, 359,
 &end
#
# 571 LYS HB2 573 TYR QD 4.76
 &rst
  ixpk= 0, nxpk= 0, iat= 304,  -1, r1= 1.30, r2= 1.80, r3= 5.34, r4= 5.84,
 igr2= 350, 359,
 &end
#
# 571 LYS HB3 573 TYR QD 4.21
 &rst
  ixpk= 0, nxpk= 0, iat= 305,  -1, r1= 1.30, r2= 1.80, r3= 4.73, r4= 5.23,
 igr2= 350, 359,
 &end
#
# 566 TYR QD 573 TYR QE 3.30
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.16, r4= 4.66,
 igr1= 222, 231,
 igr2= 352, 357,
 &end
#
# 567 TRP H 573 TYR QE 4.93
 &rst
  ixpk= 0, nxpk= 0, iat= 235,  -1, r1= 1.30, r2= 1.80, r3= 5.53, r4= 6.03,
 igr2= 352, 357,
 &end
#
# 566 TYR H 573 TYR QE 4.38
 &rst
  ixpk= 0, nxpk= 0, iat= 214,  -1, r1= 1.30, r2= 1.80, r3= 4.92, r4= 5.42,
 igr2= 352, 357,
 &end
#
# 566 TYR HB2 573 TYR QE 3.51
 &rst
  ixpk= 0, nxpk= 0, iat= 218,  -1, r1= 1.30, r2= 1.80, r3= 3.94, r4= 4.44,
 igr2= 352, 357,
 &end
#
# 566 TYR HB3 573 TYR QE 3.51
 &rst
  ixpk= 0, nxpk= 0, iat= 219,  -1, r1= 1.30, r2= 1.80, r3= 3.94, r4= 4.44,
 igr2= 352, 357,
 &end
#
# 571 LYS HB2 573 TYR QE 3.25
 &rst
  ixpk= 0, nxpk= 0, iat= 304,  -1, r1= 1.30, r2= 1.80, r3= 3.65, r4= 4.15,
 igr2= 352, 357,
 &end
#
# 571 LYS HB3 573 TYR QE 3.50
 &rst
  ixpk= 0, nxpk= 0, iat= 305,  -1, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr2= 352, 357,
 &end
#
# 567 TRP HZ2 568 GLU HB2 4.71
 &rst
  ixpk= 0, nxpk= 0, iat= 248, 263, r1= 1.30, r2= 1.80, r3= 4.71, r4= 5.21,  &end
#
# 567 TRP HZ2 568 GLU HB3 5.41
 &rst
  ixpk= 0, nxpk= 0, iat= 248, 264, r1= 1.30, r2= 1.80, r3= 5.41, r4= 5.91,  &end
#
# 567 TRP HH2 568 GLU HB2 4.33
 &rst
  ixpk= 0, nxpk= 0, iat= 250, 263, r1= 1.30, r2= 1.80, r3= 4.33, r4= 4.83,  &end
#
# 563 PHE HA 563 PHE QD 3.52
 &rst
  ixpk= 0, nxpk= 0, iat= 167,  -1, r1= 1.30, r2= 1.80, r3= 3.95, r4= 4.45,
 igr2= 173, 181,
 &end
#
# 563 PHE QD 572 PHE HB2 3.58
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 326, r1= 1.30, r2= 1.80, r3= 4.02, r4= 4.52,
 igr1= 173, 181,
 &end
#
# 563 PHE QE 574 ARG QB 4.34
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.47, r4= 5.97,
 igr1= 175, 179,
 igr2= 367, 368,
 &end
#
# 563 PHE QD 608 ILE QD1 4.59
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.19, r4= 6.69,
 igr1= 173, 181,
 igr2= 904, 905, 906,
 &end
#
# 563 PHE QE 608 ILE QD1 4.81
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.48, r4= 6.98,
 igr1= 175, 179,
 igr2= 904, 905, 906,
 &end
#
# 572 PHE H 572 PHE QD 3.58
 &rst
  ixpk= 0, nxpk= 0, iat= 322,  -1, r1= 1.30, r2= 1.80, r3= 4.02, r4= 4.52,
 igr2= 330, 338,
 &end
#
# 572 PHE QD 606 LYS H 4.07
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 855, r1= 1.30, r2= 1.80, r3= 4.57, r4= 5.07,
 igr1= 330, 338,
 &end
#
# 572 PHE QD 573 TYR H 4.76
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 342, r1= 1.30, r2= 1.80, r3= 5.34, r4= 5.84,
 igr1= 330, 338,
 &end
#
# 572 PHE QD 605 ILE HA 4.17
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 838, r1= 1.30, r2= 1.80, r3= 4.68, r4= 5.18,
 igr1= 330, 338,
 &end
#
# 563 PHE HB3 572 PHE QD 3.94
 &rst
  ixpk= 0, nxpk= 0, iat= 170,  -1, r1= 1.30, r2= 1.80, r3= 4.42, r4= 4.92,
 igr2= 330, 338,
 &end
#
# 565 LEU HB2 572 PHE QD 5.35
 &rst
  ixpk= 0, nxpk= 0, iat= 199,  -1, r1= 1.30, r2= 1.80, r3= 6.01, r4= 6.51,
 igr2= 330, 338,
 &end
#
# 565 LEU HB2 572 PHE QE 5.50
 &rst
  ixpk= 0, nxpk= 0, iat= 199,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2= 332, 336,
 &end
#
# 591 PHE QD 592 ILE H 4.74
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 633, r1= 1.30, r2= 1.80, r3= 5.32, r4= 5.82,
 igr1= 621, 629,
 &end
#
# 573 TYR HB3 591 PHE QD 4.16
 &rst
  ixpk= 0, nxpk= 0, iat= 347,  -1, r1= 1.30, r2= 1.80, r3= 4.67, r4= 5.17,
 igr2= 621, 629,
 &end
#
# 575 ALA QB 591 PHE QD 4.26
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.74, r4= 6.24,
 igr1= 391, 392, 393,
 igr2= 621, 629,
 &end
#
# 573 TYR HB2 591 PHE QD 4.11
 &rst
  ixpk= 0, nxpk= 0, iat= 346,  -1, r1= 1.30, r2= 1.80, r3= 4.61, r4= 5.11,
 igr2= 621, 629,
 &end
#
# 573 TYR HB2 591 PHE QE 4.46
 &rst
  ixpk= 0, nxpk= 0, iat= 346,  -1, r1= 1.30, r2= 1.80, r3= 5.01, r4= 5.51,
 igr2= 623, 627,
 &end
#
# 566 TYR QE 567 TRP HD1 3.45
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 243, r1= 1.30, r2= 1.80, r3= 3.87, r4= 4.37,
 igr1= 224, 229,
 &end
#
# 566 TYR QE 567 TRP HZ2 4.51
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 248, r1= 1.30, r2= 1.80, r3= 5.06, r4= 5.56,
 igr1= 224, 229,
 &end
#
# 566 TYR QE 568 GLU H 4.02
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 259, r1= 1.30, r2= 1.80, r3= 4.51, r4= 5.01,
 igr1= 224, 229,
 &end
#
# 566 TYR QE 568 GLU QG 3.39
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.27, r4= 4.77,
 igr1= 224, 229,
 igr2= 266, 267,
 &end
#
# 566 TYR QE 568 GLU HB2 3.09
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 263, r1= 1.30, r2= 1.80, r3= 3.47, r4= 3.97,
 igr1= 224, 229,
 &end
#
# 566 TYR QE 568 GLU HB3 3.42
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 264, r1= 1.30, r2= 1.80, r3= 3.84, r4= 4.34,
 igr1= 224, 229,
 &end
#
# 566 TYR QE 567 TRP H 4.30
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 235, r1= 1.30, r2= 1.80, r3= 4.83, r4= 5.33,
 igr1= 224, 229,
 &end
#
# 566 TYR QE 567 TRP HE1 3.47
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 245, r1= 1.30, r2= 1.80, r3= 3.89, r4= 4.39,
 igr1= 224, 229,
 &end
#
# 573 TYR HA 594 TYR QE 5.50
 &rst
  ixpk= 0, nxpk= 0, iat= 344,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2= 674, 679,
 &end
#
# 573 TYR QD 594 TYR QE 3.69
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.65, r4= 5.15,
 igr1= 350, 359,
 igr2= 674, 679,
 &end
#
# 591 PHE QB 594 TYR QE 3.61
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.55, r4= 5.05,
 igr1= 617, 618,
 igr2= 674, 679,
 &end
#
# 591 PHE QB 594 TYR QD 2.78
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,
 igr1= 617, 618,
 igr2= 672, 681,
 &end
#
# 566 TYR QD 568 GLU HB2 4.09
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 263, r1= 1.30, r2= 1.80, r3= 4.59, r4= 5.09,
 igr1= 222, 231,
 &end
#
# 566 TYR QD 568 GLU HB3 4.54
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 264, r1= 1.30, r2= 1.80, r3= 5.10, r4= 5.60,
 igr1= 222, 231,
 &end
#
# 556 TRP HB2 580 LEU QQD 4.63
 &rst
  ixpk= 0, nxpk= 0, iat=  64, 459, r1= 1.30, r2= 1.80, r3= 6.83, r4= 7.33,  &end
#
# 556 TRP HB3 580 LEU QQD 3.91
 &rst
  ixpk= 0, nxpk= 0, iat=  65, 459, r1= 1.30, r2= 1.80, r3= 6.11, r4= 6.61,  &end
#
# 556 TRP HE1 580 LEU QQD 4.36
 &rst
  ixpk= 0, nxpk= 0, iat=  70, 459, r1= 1.30, r2= 1.80, r3= 6.56, r4= 7.06,  &end
#
# 556 TRP HZ2 562 CYS QB 3.83
 &rst
  ixpk= 0, nxpk= 0, iat=  73,  -1, r1= 1.30, r2= 1.80, r3= 4.30, r4= 4.80,
 igr2= 158, 159,
 &end
#
# 556 TRP HH2 562 CYS QB 3.73
 &rst
  ixpk= 0, nxpk= 0, iat=  75,  -1, r1= 1.30, r2= 1.80, r3= 4.19, r4= 4.69,
 igr2= 158, 159,
 &end
#
# 557 LYS H 580 LEU QQD 4.55
 &rst
  ixpk= 0, nxpk= 0, iat=  84, 459, r1= 1.30, r2= 1.80, r3= 6.75, r4= 7.25,  &end
#
# 558 PRO HA 580 LEU QQD 3.51
 &rst
  ixpk= 0, nxpk= 0, iat= 116, 459, r1= 1.30, r2= 1.80, r3= 5.71, r4= 6.21,  &end
#
# 562 CYS QB 563 PHE H 2.89
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 165, r1= 1.30, r2= 1.80, r3= 3.24, r4= 3.74,
 igr1= 158, 159,
 &end
#
# 562 CYS QB 577 VAL QG2 4.44
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.99, r4= 6.49,
 igr1= 158, 159,
 igr2= 422, 423, 424,
 &end
#
# 562 CYS QB 589 VAL QG1 5.13
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.92, r4= 7.42,
 igr1= 158, 159,
 igr2= 581, 582, 583,
 &end
#
# 562 CYS QB 605 ILE HB 4.44
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 840, r1= 1.30, r2= 1.80, r3= 4.98, r4= 5.48,
 igr1= 158, 159,
 &end
#
# 562 CYS QB 605 ILE QG2 3.06
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.12, r4= 4.62,
 igr1= 158, 159,
 igr2= 842, 843, 844,
 &end
#
# 562 CYS QB 605 ILE QD1 4.82
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.50, r4= 7.00,
 igr1= 158, 159,
 igr2= 849, 850, 851,
 &end
#
# 562 CYS QB 606 LYS H 4.67
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 855, r1= 1.30, r2= 1.80, r3= 5.24, r4= 5.74,
 igr1= 158, 159,
 &end
#
# 562 CYS QB 608 ILE QG1 5.34
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.73, r4= 7.23,
 igr1= 158, 159,
 igr2= 901, 902,
 &end
#
# 565 LEU H 565 LEU QQD 3.78
 &rst
  ixpk= 0, nxpk= 0, iat= 195, 201, r1= 1.30, r2= 1.80, r3= 5.98, r4= 6.48,  &end
#
# 565 LEU H 604 ASN QB 3.94
 &rst
  ixpk= 0, nxpk= 0, iat= 195,  -1, r1= 1.30, r2= 1.80, r3= 4.42, r4= 4.92,
 igr2= 826, 827,
 &end
#
# 565 LEU HA 565 LEU QQD 2.93
 &rst
  ixpk= 0, nxpk= 0, iat= 197, 201, r1= 1.30, r2= 1.80, r3= 5.13, r4= 5.63,  &end
#
# 565 LEU HB2 604 ASN QB 3.52
 &rst
  ixpk= 0, nxpk= 0, iat= 199,  -1, r1= 1.30, r2= 1.80, r3= 3.95, r4= 4.45,
 igr2= 826, 827,
 &end
#
# 565 LEU HB3 604 ASN QB 3.68
 &rst
  ixpk= 0, nxpk= 0, iat= 200,  -1, r1= 1.30, r2= 1.80, r3= 4.13, r4= 4.63,
 igr2= 826, 827,
 &end
#
# 565 LEU HG 566 TYR QB 5.34
 &rst
  ixpk= 0, nxpk= 0, iat= 202,  -1, r1= 1.30, r2= 1.80, r3= 5.99, r4= 6.49,
 igr2= 218, 219,
 &end
#
# 565 LEU HG 604 ASN QB 4.05
 &rst
  ixpk= 0, nxpk= 0, iat= 202,  -1, r1= 1.30, r2= 1.80, r3= 4.55, r4= 5.05,
 igr2= 826, 827,
 &end
#
# 565 LEU QQD 566 TYR H 3.30
 &rst
  ixpk= 0, nxpk= 0, iat= 201, 214, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
# 565 LEU QQD 566 TYR QB 4.13
 &rst
  ixpk= 0, nxpk= 0, iat= 201,  -1, r1= 1.30, r2= 1.80, r3= 6.84, r4= 7.34,
 igr2= 218, 219,
 &end
#
# 565 LEU QQD 567 TRP HA 5.16
 &rst
  ixpk= 0, nxpk= 0, iat= 201, 237, r1= 1.30, r2= 1.80, r3= 7.36, r4= 7.86,  &end
#
# 565 LEU QQD 570 ASN H 4.29
 &rst
  ixpk= 0, nxpk= 0, iat= 201, 286, r1= 1.30, r2= 1.80, r3= 6.49, r4= 6.99,  &end
#
# 565 LEU QQD 570 ASN HA 2.90
 &rst
  ixpk= 0, nxpk= 0, iat= 201, 288, r1= 1.30, r2= 1.80, r3= 5.10, r4= 5.60,  &end
#
# 565 LEU QQD 570 ASN HB2 4.40
 &rst
  ixpk= 0, nxpk= 0, iat= 201, 290, r1= 1.30, r2= 1.80, r3= 6.60, r4= 7.10,  &end
#
# 565 LEU QQD 570 ASN HB3 3.71
 &rst
  ixpk= 0, nxpk= 0, iat= 201, 291, r1= 1.30, r2= 1.80, r3= 5.91, r4= 6.41,  &end
#
# 565 LEU QQD 571 LYS H 3.67
 &rst
  ixpk= 0, nxpk= 0, iat= 201, 300, r1= 1.30, r2= 1.80, r3= 5.87, r4= 6.37,  &end
#
# 565 LEU QQD 571 LYS HA 3.74
 &rst
  ixpk= 0, nxpk= 0, iat= 201, 302, r1= 1.30, r2= 1.80, r3= 5.94, r4= 6.44,  &end
#
# 565 LEU QQD 572 PHE H 4.30
 &rst
  ixpk= 0, nxpk= 0, iat= 201, 322, r1= 1.30, r2= 1.80, r3= 6.50, r4= 7.00,  &end
#
# 565 LEU QQD 572 PHE HA 3.80
 &rst
  ixpk= 0, nxpk= 0, iat= 201, 324, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,  &end
#
# 565 LEU QQD 572 PHE QE 3.92
 &rst
  ixpk= 0, nxpk= 0, iat= 201,  -1, r1= 1.30, r2= 1.80, r3= 6.60, r4= 7.10,
 igr2= 332, 336,
 &end
#
# 565 LEU QQD 600 VAL QQG 4.74
 &rst
  ixpk= 0, nxpk= 0, iat= 201, 760, r1= 1.30, r2= 1.80, r3= 9.14, r4= 9.64,  &end
#
# 565 LEU QQD 604 ASN QB 4.90
 &rst
  ixpk= 0, nxpk= 0, iat= 201,  -1, r1= 1.30, r2= 1.80, r3= 7.70, r4= 8.20,
 igr2= 826, 827,
 &end
#
# 566 TYR H 566 TYR QB 3.52
 &rst
  ixpk= 0, nxpk= 0, iat= 214,  -1, r1= 1.30, r2= 1.80, r3= 3.95, r4= 4.45,
 igr2= 218, 219,
 &end
#
# 566 TYR QB 567 TRP H 3.97
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 235, r1= 1.30, r2= 1.80, r3= 4.46, r4= 4.96,
 igr1= 218, 219,
 &end
#
# 566 TYR QB 568 GLU QG 5.00
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.30, r4= 6.80,
 igr1= 218, 219,
 igr2= 266, 267,
 &end
#
# 566 TYR QB 569 ASP H 4.04
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 274, r1= 1.30, r2= 1.80, r3= 4.53, r4= 5.03,
 igr1= 218, 219,
 &end
#
# 566 TYR QB 571 LYS H 3.99
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 300, r1= 1.30, r2= 1.80, r3= 4.48, r4= 4.98,
 igr1= 218, 219,
 &end
#
# 566 TYR QB 573 TYR QD 3.03
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 3.82, r4= 4.32,
 igr1= 218, 219,
 igr2= 350, 359,
 &end
#
# 566 TYR QB 573 TYR QE 3.01
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 3.79, r4= 4.29,
 igr1= 218, 219,
 igr2= 352, 357,
 &end
#
# 577 VAL HB 580 LEU QQD 5.01
 &rst
  ixpk= 0, nxpk= 0, iat= 416, 459, r1= 1.30, r2= 1.80, r3= 7.21, r4= 7.71,  &end
#
# 577 VAL QG1 580 LEU QQD 2.86
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 459, r1= 1.30, r2= 1.80, r3= 5.63, r4= 6.13,
 igr1= 418, 419, 420,
 &end
#
# 579 ALA HA 580 LEU QQD 4.15
 &rst
  ixpk= 0, nxpk= 0, iat= 445, 459, r1= 1.30, r2= 1.80, r3= 6.35, r4= 6.85,  &end
#
# 580 LEU H 580 LEU QQD 3.87
 &rst
  ixpk= 0, nxpk= 0, iat= 453, 459, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,  &end
#
# 580 LEU HA 580 LEU QQD 3.85
 &rst
  ixpk= 0, nxpk= 0, iat= 455, 459, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55,  &end
#
# 580 LEU QB 580 LEU QQD 2.76
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 459, r1= 1.30, r2= 1.80, r3= 5.30, r4= 5.80,
 igr1= 457, 458,
 &end
#
# 580 LEU QQD 581 HIS H 4.18
 &rst
  ixpk= 0, nxpk= 0, iat= 459, 472, r1= 1.30, r2= 1.80, r3= 6.38, r4= 6.88,  &end
#
# 580 LEU QQD 587 ALA H 4.97
 &rst
  ixpk= 0, nxpk= 0, iat= 459, 549, r1= 1.30, r2= 1.80, r3= 7.17, r4= 7.67,  &end
#
# 580 LEU QQD 587 ALA HA 3.52
 &rst
  ixpk= 0, nxpk= 0, iat= 459, 551, r1= 1.30, r2= 1.80, r3= 5.72, r4= 6.22,  &end
#
# 580 LEU QQD 587 ALA QB 2.84
 &rst
  ixpk= 0, nxpk= 0, iat= 459,  -1, r1= 1.30, r2= 1.80, r3= 5.61, r4= 6.11,
 igr2= 553, 554, 555,
 &end
#
# 580 LEU QQD 589 VAL H 5.24
 &rst
  ixpk= 0, nxpk= 0, iat= 459, 575, r1= 1.30, r2= 1.80, r3= 7.44, r4= 7.94,  &end
#
# 580 LEU QQD 605 ILE QD1 3.70
 &rst
  ixpk= 0, nxpk= 0, iat= 459,  -1, r1= 1.30, r2= 1.80, r3= 6.64, r4= 7.14,
 igr2= 849, 850, 851,
 &end
#
# 588 VAL HA 597 TYR QB 5.34
 &rst
  ixpk= 0, nxpk= 0, iat= 561,  -1, r1= 1.30, r2= 1.80, r3= 5.99, r4= 6.49,
 igr2= 710, 711,
 &end
#
# 588 VAL QG1 597 TYR QB 3.09
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.17, r4= 4.67,
 igr1= 565, 566, 567,
 igr2= 710, 711,
 &end
#
# 590 LYS HA 597 TYR QB 4.52
 &rst
  ixpk= 0, nxpk= 0, iat= 593,  -1, r1= 1.30, r2= 1.80, r3= 5.07, r4= 5.57,
 igr2= 710, 711,
 &end
#
# 590 LYS HB2 590 LYS QE 4.12
 &rst
  ixpk= 0, nxpk= 0, iat= 595,  -1, r1= 1.30, r2= 1.80, r3= 4.62, r4= 5.12,
 igr2= 604, 605,
 &end
#
# 590 LYS HB3 590 LYS QE 5.14
 &rst
  ixpk= 0, nxpk= 0, iat= 596,  -1, r1= 1.30, r2= 1.80, r3= 5.77, r4= 6.27,
 igr2= 604, 605,
 &end
#
# 590 LYS QE 592 ILE HA 5.08
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 635, r1= 1.30, r2= 1.80, r3= 5.70, r4= 6.20,
 igr1= 604, 605,
 &end
#
# 590 LYS QE 595 GLY H 4.41
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 685, r1= 1.30, r2= 1.80, r3= 4.95, r4= 5.45,
 igr1= 604, 605,
 &end
#
# 590 LYS QE 595 GLY HA2 4.48
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 687, r1= 1.30, r2= 1.80, r3= 5.03, r4= 5.53,
 igr1= 604, 605,
 &end
#
# 590 LYS QE 596 ASN H 4.14
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 692, r1= 1.30, r2= 1.80, r3= 4.65, r4= 5.15,
 igr1= 604, 605,
 &end
#
# 596 ASN HA 597 TYR QB 5.34
 &rst
  ixpk= 0, nxpk= 0, iat= 694,  -1, r1= 1.30, r2= 1.80, r3= 5.99, r4= 6.49,
 igr2= 710, 711,
 &end
#
# 597 TYR H 597 TYR QB 3.39
 &rst
  ixpk= 0, nxpk= 0, iat= 706,  -1, r1= 1.30, r2= 1.80, r3= 3.81, r4= 4.31,
 igr2= 710, 711,
 &end
#
# 597 TYR QB 598 GLU H 3.63
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 727, r1= 1.30, r2= 1.80, r3= 4.07, r4= 4.57,
 igr1= 710, 711,
 &end
#
# 600 VAL HA 604 ASN QB 5.02
 &rst
  ixpk= 0, nxpk= 0, iat= 759,  -1, r1= 1.30, r2= 1.80, r3= 5.63, r4= 6.13,
 igr2= 826, 827,
 &end
#
# 600 VAL HB 604 ASN QB 4.70
 &rst
  ixpk= 0, nxpk= 0, iat= 761,  -1, r1= 1.30, r2= 1.80, r3= 5.28, r4= 5.78,
 igr2= 826, 827,
 &end
#
# 600 VAL QQG 604 ASN QB 3.20
 &rst
  ixpk= 0, nxpk= 0, iat= 760,  -1, r1= 1.30, r2= 1.80, r3= 5.79, r4= 6.29,
 igr2= 826, 827,
 &end
#
# 601 LEU H 604 ASN QB 3.89
 &rst
  ixpk= 0, nxpk= 0, iat= 773,  -1, r1= 1.30, r2= 1.80, r3= 4.37, r4= 4.87,
 igr2= 826, 827,
 &end
#
# 601 LEU QB 603 SER QB 4.41
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.56, r4= 6.06,
 igr1= 777, 778,
 igr2= 815, 816,
 &end
#
# 601 LEU QB 604 ASN QB 4.57
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.76, r4= 6.26,
 igr1= 777, 778,
 igr2= 826, 827,
 &end
#
# 601 LEU HG 603 SER QB 5.34
 &rst
  ixpk= 0, nxpk= 0, iat= 780,  -1, r1= 1.30, r2= 1.80, r3= 5.99, r4= 6.49,
 igr2= 815, 816,
 &end
#
# 601 LEU HG 604 ASN QB 4.88
 &rst
  ixpk= 0, nxpk= 0, iat= 780,  -1, r1= 1.30, r2= 1.80, r3= 5.48, r4= 5.98,
 igr2= 826, 827,
 &end
#
# 601 LEU QQD 603 SER QB 4.16
 &rst
  ixpk= 0, nxpk= 0, iat= 779,  -1, r1= 1.30, r2= 1.80, r3= 6.87, r4= 7.37,
 igr2= 815, 816,
 &end
#
# 602 LEU QB 603 SER QB 5.34
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.73, r4= 7.23,
 igr1= 796, 797,
 igr2= 815, 816,
 &end
#
# 603 SER H 603 SER QB 3.63
 &rst
  ixpk= 0, nxpk= 0, iat= 811,  -1, r1= 1.30, r2= 1.80, r3= 4.07, r4= 4.57,
 igr2= 815, 816,
 &end
#
# 603 SER QB 604 ASN HA 5.16
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 824, r1= 1.30, r2= 1.80, r3= 5.79, r4= 6.29,
 igr1= 815, 816,
 &end
#
# 603 SER QB 605 ILE H 5.34
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 836, r1= 1.30, r2= 1.80, r3= 5.99, r4= 6.49,
 igr1= 815, 816,
 &end
#
# 604 ASN H 604 ASN QB 3.01
 &rst
  ixpk= 0, nxpk= 0, iat= 822,  -1, r1= 1.30, r2= 1.80, r3= 3.38, r4= 3.88,
 igr2= 826, 827,
 &end
#
# 617 DA2 QHC1 573 TYR QD 5
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.74, r4= 7.24,
 igr1=1049,1050,1051,
 igr2= 350, 359,
 &end
#
# 617 DA2 QHC2 573 TYR QE 4
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.39, r4= 5.89,
 igr1=1053,1054,1055,
 igr2= 352, 357,
 &end
#
# 617 DA2 QHC2 594 TYR HE1 4
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 674, r1= 1.30, r2= 1.80, r3= 4.80, r4= 5.30,
 igr1=1053,1054,1055,
 &end
#
# 617 DA2 QHC1 594 TYR HD1 4
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 672, r1= 1.30, r2= 1.80, r3= 4.80, r4= 5.30,
 igr1=1049,1050,1051,
 &end
#
# 617 DA2 HCD3 566 TYR HE1 5
 &rst
  ixpk= 0, nxpk= 0, iat=1040, 224, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50,  &end
#
# 617 DA2 HCD1 566 TYR HE2 5
 &rst
  ixpk= 0, nxpk= 0, iat=1040, 229, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50,  &end
#
# 617 DA2 HCD2 594 TYR HE2 5
 &rst
  ixpk= 0, nxpk= 0, iat=1039, 679, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50,  &end
#
# 617 DA2 HCD2 594 TYR HD2 4
 &rst
  ixpk= 0, nxpk= 0, iat=1039, 681, r1= 1.30, r2= 1.80, r3= 4.00, r4= 4.50,  &end
#
# 617 DA2 QY 566 TYR HE2 4
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 229, r1= 1.30, r2= 1.80, r3= 4.80, r4= 5.30,
 igr1=1053,1054,1055,
 &end
#
# 617 DA2 QHC1 566 TYR HE1 4.5
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 224, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr1=1049,1050,1051,
 &end
#
# 618 TYR HH 568 GLU CD 6
 &rst
  ixpk= 0, nxpk= 0, iat=1072, 268, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,  &end
#
# 576 GLU H 591 PHE HA 4.32  (#peak 2 #SUP 0.68 #QF 0.68 )
 &rst
  ixpk= 2, nxpk= 0, iat= 405, 624, r1= 1.30, r2= 1.80, r3= 4.32, r4= 4.82, 
      rk2=20.0, rk3=20.0, ir6=1, ialtd=0,
 &end
#
# 591 PHE HA 591 PHE QD 3.89  (#peak 4 #SUP 0.32 #QF 0.32 )
 &rst
  ixpk= 4, nxpk= 0, iat= 624,  -1, r1= 1.30, r2= 1.80, r3= 4.37, r4= 4.87,
 igr2= 627, 628,
 &end
#
# 575 ALA HA 591 PHE HA 3.28  (#peak 5 #SUP 0.65 #QF 0.65 )
 &rst
  ixpk= 5, nxpk= 0, iat= 392, 624, r1= 1.30, r2= 1.80, r3= 3.28, r4= 3.78,  &end
#
# 591 PHE HA 592 ILE HG12 4.40  (#peak 10 #SUP 0.63 #QF 0.63 )
 &rst
  ixpk= 10, nxpk= 0, iat= 624, 643, r1= 1.30, r2= 1.80, r3= 4.40, r4= 4.90,  &end
#
# 575 ALA QB 591 PHE HA 3.36  (#peak 11 #SUP 0.58 #QF 0.58 )
 &rst
  ixpk= 11, nxpk= 0, iat=  -1, 624, r1= 1.30, r2= 1.80, r3= 4.04, r4= 4.54,
 igr1= 393, 394, 395,
 &end
#
# 602 LEU QB 603 SER HA 3.98  (#peak 19 #SUP 0.74 #QF 0.74 )
 &rst
  ixpk= 19, nxpk= 0, iat=  -1, 817, r1= 1.30, r2= 1.80, r3= 4.47, r4= 4.97,
 igr1= 801, 802,
 &end
#
# 601 LEU QQD 603 SER HA 4.71  (#peak 21 #SUP 0.42 #QF 0.42 )
 &rst
  ixpk= 21, nxpk= 0, iat= 777, 817, r1= 1.30, r2= 1.80, r3= 6.91, r4= 7.41,  &end
#
# 583 SER HA 583 SER QB 2.83  (#peak 25 #SUP 0.99 #QF 0.99 )
 &rst
  ixpk= 25, nxpk= 0, iat= 506,  -1, r1= 1.30, r2= 1.80, r3= 3.18, r4= 3.68,
 igr2= 507, 508,
 &end
#
# 565 LEU HA 566 TYR H 3.05  (#peak 32 #SUP 0.87 #QF 0.87 )
 &rst
  ixpk= 32, nxpk= 0, iat= 203, 225, r1= 1.30, r2= 1.80, r3= 3.05, r4= 3.55,  &end
#
# 565 LEU HA 573 TYR H 4.21  (#peak 33 #SUP 0.96 #QF 0.96 )
 &rst
  ixpk= 33, nxpk= 0, iat= 203, 353, r1= 1.30, r2= 1.80, r3= 4.21, r4= 4.71,  &end
#
# 565 LEU HA 573 TYR QE 5.36  (#peak 35 #SUP 0.95 #QF 0.95 )
 &rst
  ixpk= 35, nxpk= 0, iat= 203,  -1, r1= 1.30, r2= 1.80, r3= 6.02, r4= 6.52,
 igr2= 359, 360,
 &end
#
# 565 LEU HA 572 PHE QD 4.23  (#peak 36 #SUP 0.97 #QF 0.86 )
 &rst
  ixpk= 36, nxpk= 0, iat= 203,  -1, r1= 1.30, r2= 1.80, r3= 4.75, r4= 5.25,
 igr2= 336, 337,
 &end
#
# 565 LEU HA 572 PHE HA 3.37  (#peak 37 #SUP 0.87 #QF 0.87 )
 &rst
  ixpk= 37, nxpk= 0, iat= 203, 333, r1= 1.30, r2= 1.80, r3= 3.37, r4= 3.87,  &end
#
# 590 LYS HA 591 PHE QD 4.48  (#peak 44 #SUP 0.51 #QF 0.51 )
 &rst
  ixpk= 44, nxpk= 0, iat= 600,  -1, r1= 1.30, r2= 1.80, r3= 5.03, r4= 5.53,
 igr2= 627, 628,
 &end
#
# 590 LYS HA 590 LYS HG2 3.83  (#peak 47 #SUP 0.98 #QF 0.98 )
 &rst
  ixpk= 47, nxpk= 0, iat= 600, 603, r1= 1.30, r2= 1.80, r3= 3.83, r4= 4.33,  &end
#
# 590 LYS HA 590 LYS HG3 3.85  (#peak 48 #SUP 0.99 #QF 0.99 )
 &rst
  ixpk= 48, nxpk= 0, iat= 600, 604, r1= 1.30, r2= 1.80, r3= 3.85, r4= 4.35,  &end
#
# 580 LEU HA 587 ALA QB 3.67  (#peak 55 #SUP 0.56 #QF 0.56 )
 &rst
  ixpk= 55, nxpk= 0, iat= 461,  -1, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,
 igr2= 555, 556, 557,
 &end
#
# 563 PHE HB3 564 ALA QB 4.97  (#peak 79 #SUP 0.77 #QF 0.77 )
 &rst
  ixpk= 79, nxpk= 0, iat= 178,  -1, r1= 1.30, r2= 1.80, r3= 5.97, r4= 6.47,
 igr2= 191, 192, 193,
 &end
#
# 590 LYS HE3 596 ASN HA 4.46  (#peak 80 #SUP 0.76 #QF 0.76 )
 &rst
  ixpk= 80, nxpk= 0, iat= 608, 700, r1= 1.30, r2= 1.80, r3= 4.46, r4= 4.96,  &end
#
# 590 LYS HG2 590 LYS HE3 4.16  (#peak 88     )
 &rst
  ixpk= 88, nxpk= 0, iat= 603, 608, r1= 1.30, r2= 1.80, r3= 4.16, r4= 4.66,  &end
#
# 563 PHE HB2 606 LYS H 4.52  (#peak 90 #SUP 0.80 #QF 0.68 )
 &rst
  ixpk= 90, nxpk= 0, iat= 177, 863, r1= 1.30, r2= 1.80, r3= 4.52, r4= 5.02,  &end
#
# 563 PHE H 563 PHE HB2 4.00  (#peak 91 #SUP 0.95 #QF 0.95 )
 &rst
  ixpk= 91, nxpk= 0, iat= 175, 177, r1= 1.30, r2= 1.80, r3= 4.00, r4= 4.50,  &end
#
# 590 LYS HE2 596 ASN HA 4.46  (#peak 94 #SUP 0.71 #QF 0.71 )
 &rst
  ixpk= 94, nxpk= 0, iat= 607, 700, r1= 1.30, r2= 1.80, r3= 4.46, r4= 4.96,  &end
#
# 590 LYS HB2 590 LYS HE2 4.69  (#peak 99 #SUP 0.70 #QF 0.70 )
 &rst
  ixpk= 99, nxpk= 0, iat= 601, 607, r1= 1.30, r2= 1.80, r3= 4.69, r4= 5.19,  &end
#
# 590 LYS HG2 590 LYS HE2 4.16  (#peak 100     )
 &rst
  ixpk= 100, nxpk= 0, iat= 603, 607, r1= 1.30, r2= 1.80, r3= 4.16, r4= 4.66,  &end
#
# 571 LYS HA 573 TYR QE 4.77  (#peak 111 #SUP 0.77 #QF 0.77 )
 &rst
  ixpk= 111, nxpk= 0, iat= 309,  -1, r1= 1.30, r2= 1.80, r3= 5.35, r4= 5.85,
 igr2= 359, 360,
 &end
#
# 571 LYS HA 572 PHE QD 4.36  (#peak 112 #SUP 0.90 #QF 0.87 )
 &rst
  ixpk= 112, nxpk= 0, iat= 309,  -1, r1= 1.30, r2= 1.80, r3= 4.89, r4= 5.39,
 igr2= 336, 337,
 &end
#
# 571 LYS HA 572 PHE QE 4.99  (#peak 112 #SUP 0.90 #QF 0.87 )
 &rst
  ixpk= 112, nxpk= 0, iat= 309,  -1, r1= 1.30, r2= 1.80, r3= 5.60, r4= 6.10,
 igr2= 338, 339,
 &end
#
# 571 LYS HA 572 PHE HB2 4.96  (#peak 115 #SUP 0.84 #QF 0.84 )
 &rst
  ixpk= 115, nxpk= 0, iat= 309, 334, r1= 1.30, r2= 1.80, r3= 4.96, r4= 5.46,  &end
#
# 575 ALA HA 591 PHE H 4.41  (#peak 138 #SUP 0.75 #QF 0.75 )
 &rst
  ixpk= 138, nxpk= 0, iat= 392, 623, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,  &end
#
# 575 ALA HA 592 ILE H 3.41  (#peak 140 #SUP 0.97 #QF 0.97 )
 &rst
  ixpk= 140, nxpk= 0, iat= 392, 640, r1= 1.30, r2= 1.80, r3= 3.41, r4= 3.91,  &end
#
# 575 ALA HA 576 GLU QB 4.54  (#peak 142 #SUP 0.96 #QF 0.96 )
 &rst
  ixpk= 142, nxpk= 0, iat= 392,  -1, r1= 1.30, r2= 1.80, r3= 5.10, r4= 5.60,
 igr2= 407, 408,
 &end
#
# 575 ALA HA 592 ILE HG12 3.82  (#peak 144 #SUP 0.95 #QF 0.95 )
 &rst
  ixpk= 144, nxpk= 0, iat= 392, 643, r1= 1.30, r2= 1.80, r3= 3.82, r4= 4.32,  &end
#
# 570 ASN H 570 ASN HA 2.91  (#peak 148     )
 &rst
  ixpk= 148, nxpk= 0, iat= 293, 294, r1= 1.30, r2= 1.80, r3= 2.91, r4= 3.41,  &end
#
# 570 ASN HA 571 LYS H 3.46  (#peak 149     )
 &rst
  ixpk= 149, nxpk= 0, iat= 294, 308, r1= 1.30, r2= 1.80, r3= 3.46, r4= 3.96,  &end
#
# 569 ASP H 570 ASN HA 4.28  (#peak 150 #SUP 0.98 #QF 0.98 )
 &rst
  ixpk= 150, nxpk= 0, iat= 281, 294, r1= 1.30, r2= 1.80, r3= 4.28, r4= 4.78,  &end
#
# 570 ASN HA 571 LYS HA 4.69  (#peak 151 #SUP 0.87 #QF 0.87 )
 &rst
  ixpk= 151, nxpk= 0, iat= 294, 309, r1= 1.30, r2= 1.80, r3= 4.69, r4= 5.19,  &end
#
# 609 LEU HA 609 LEU QB 2.84  (#peak 166     )
 &rst
  ixpk= 166, nxpk= 0, iat= 918,  -1, r1= 1.30, r2= 1.80, r3= 3.19, r4= 3.69,
 igr2= 919, 920,
 &end
#
# 600 VAL HA 601 LEU H 2.91  (#peak 169 #SUP 0.96 #QF 0.96 )
 &rst
  ixpk= 169, nxpk= 0, iat= 764, 780, r1= 1.30, r2= 1.80, r3= 2.91, r4= 3.41,  &end
#
# 564 ALA HA 605 ILE H 4.66  (#peak 193 #SUP 0.83 #QF 0.83 )
 &rst
  ixpk= 193, nxpk= 0, iat= 190, 843, r1= 1.30, r2= 1.80, r3= 4.66, r4= 5.16,  &end
#
# 564 ALA HA 572 PHE QD 3.90  (#peak 194 #SUP 0.92 #QF 0.92 )
 &rst
  ixpk= 194, nxpk= 0, iat= 190,  -1, r1= 1.30, r2= 1.80, r3= 4.38, r4= 4.88,
 igr2= 336, 337,
 &end
#
# 564 ALA HA 605 ILE HA 3.22  (#peak 196 #SUP 0.99 #QF 0.99 )
 &rst
  ixpk= 196, nxpk= 0, iat= 190, 844, r1= 1.30, r2= 1.80, r3= 3.22, r4= 3.72,  &end
#
# 564 ALA HA 565 LEU HB2 4.46  (#peak 197 #SUP 0.99 #QF 0.99 )
 &rst
  ixpk= 197, nxpk= 0, iat= 190, 204, r1= 1.30, r2= 1.80, r3= 4.46, r4= 4.96,  &end
#
# 599 GLU HA 600 VAL H 2.89  (#peak 202 #SUP 0.97 #QF 0.97 )
 &rst
  ixpk= 202, nxpk= 0, iat= 751, 763, r1= 1.30, r2= 1.80, r3= 2.89, r4= 3.39,  &end
#
# 587 ALA H 599 GLU HA 3.57  (#peak 203 #SUP 0.60 #QF 0.60 )
 &rst
  ixpk= 203, nxpk= 0, iat= 553, 751, r1= 1.30, r2= 1.80, r3= 3.57, r4= 4.07,  &end
#
# 588 VAL HA 599 GLU HA 3.21  (#peak 206 #SUP 0.72 #QF 0.72 )
 &rst
  ixpk= 206, nxpk= 0, iat= 566, 751, r1= 1.30, r2= 1.80, r3= 3.21, r4= 3.71,  &end
#
# 599 GLU HA 599 GLU QG 3.59  (#peak 208 #SUP 0.99 #QF 0.99 )
 &rst
  ixpk= 208, nxpk= 0, iat= 751,  -1, r1= 1.30, r2= 1.80, r3= 4.03, r4= 4.53,
 igr2= 754, 755,
 &end
#
# 599 GLU HA 599 GLU QB 3.02  (#peak 209 #SUP 0.81 #QF 0.81 )
 &rst
  ixpk= 209, nxpk= 0, iat= 751,  -1, r1= 1.30, r2= 1.80, r3= 3.39, r4= 3.89,
 igr2= 752, 753,
 &end
#
# 588 VAL QG2 599 GLU HA 3.41  (#peak 211 #SUP 0.83 #QF 0.83 )
 &rst
  ixpk= 211, nxpk= 0, iat=  -1, 751, r1= 1.30, r2= 1.80, r3= 4.10, r4= 4.60,
 igr1= 571, 572, 573,
 &end
#
# 589 VAL QG2 599 GLU HA 4.89  (#peak 212 #SUP 0.96 #QF 0.96 )
 &rst
  ixpk= 212, nxpk= 0, iat=  -1, 751, r1= 1.30, r2= 1.80, r3= 5.87, r4= 6.37,
 igr1= 587, 588, 589,
 &end
#
# 566 TYR HA 573 TYR QD 4.48  (#peak 215 #SUP 0.49 #QF 0.49 )
 &rst
  ixpk= 215, nxpk= 0, iat= 226,  -1, r1= 1.30, r2= 1.80, r3= 5.03, r4= 5.53,
 igr2= 357, 358,
 &end
#
# 569 ASP HA 569 ASP HB3 2.90  (#peak 237 #SUP 0.98 #QF 0.98 )
 &rst
  ixpk= 237, nxpk= 0, iat= 282, 284, r1= 1.30, r2= 1.80, r3= 2.90, r4= 3.40,  &end
#
# 569 ASP HA 570 ASN HB2 4.30  (#peak 238 #SUP 0.96 #QF 0.96 )
 &rst
  ixpk= 238, nxpk= 0, iat= 282, 295, r1= 1.30, r2= 1.80, r3= 4.30, r4= 4.80,  &end
#
# 569 ASP HA 569 ASP HB2 2.94  (#peak 239 #SUP 0.77 #QF 0.77 )
 &rst
  ixpk= 239, nxpk= 0, iat= 282, 283, r1= 1.30, r2= 1.80, r3= 2.94, r4= 3.44,  &end
#
# 568 GLU HB2 569 ASP HA 5.50  (#peak 240 #SUP 0.61 #QF 0.61 )
 &rst
  ixpk= 240, nxpk= 0, iat= 269, 282, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
# 579 ALA HA 580 LEU H 2.92  (#peak 241 #SUP 0.94 #QF 0.94 )
 &rst
  ixpk= 241, nxpk= 0, iat= 448, 460, r1= 1.30, r2= 1.80, r3= 2.92, r4= 3.42,  &end
#
# 557 LYS HA 579 ALA HA 5.50  (#peak 243 #SUP 0.85 #QF 0.85 )
 &rst
  ixpk= 243, nxpk= 0, iat=  93, 448, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
# 558 PRO HB2 579 ALA HA 3.70  (#peak 246 #SUP 0.89 #QF 0.89 )
 &rst
  ixpk= 246, nxpk= 0, iat= 113, 448, r1= 1.30, r2= 1.80, r3= 3.70, r4= 4.20,  &end
#
# 579 ALA HA 580 LEU HG 4.24  (#peak 247 #SUP 0.76 #QF 0.76 )
 &rst
  ixpk= 247, nxpk= 0, iat= 448, 464, r1= 1.30, r2= 1.80, r3= 4.24, r4= 4.74,  &end
#
# 577 VAL QG1 579 ALA HA 4.27  (#peak 250 #SUP 0.99 #QF 0.99 )
 &rst
  ixpk= 250, nxpk= 0, iat=  -1, 448, r1= 1.30, r2= 1.80, r3= 5.13, r4= 5.63,
 igr1= 421, 422, 423,
 &end
#
# 560 ASP HA 577 VAL HB 4.06  (#peak 271 #SUP 0.55 #QF 0.55 )
 &rst
  ixpk= 271, nxpk= 0, iat= 135, 420, r1= 1.30, r2= 1.80, r3= 4.06, r4= 4.56,  &end
#
# 562 CYS H 576 GLU HA 3.77  (#peak 275 #SUP 0.68 #QF 0.68 )
 &rst
  ixpk= 275, nxpk= 0, iat= 159, 406, r1= 1.30, r2= 1.80, r3= 3.77, r4= 4.27,  &end
#
# 597 TYR HA 598 GLU HA 4.68  (#peak 286 #SUP 0.93 #QF 0.93 )
 &rst
  ixpk= 286, nxpk= 0, iat= 718, 736, r1= 1.30, r2= 1.80, r3= 4.68, r4= 5.18,  &end
#
# 598 GLU HA 599 GLU QB 4.83  (#peak 294 #SUP 0.60 #QF 0.60 )
 &rst
  ixpk= 294, nxpk= 0, iat= 736,  -1, r1= 1.30, r2= 1.80, r3= 5.42, r4= 5.92,
 igr2= 752, 753,
 &end
#
# 598 GLU HA 598 GLU QG 3.55  (#peak 295 #SUP 0.99 #QF 0.99 )
 &rst
  ixpk= 295, nxpk= 0, iat= 736,  -1, r1= 1.30, r2= 1.80, r3= 3.98, r4= 4.48,
 igr2= 739, 740,
 &end
#
# 608 ILE HA 609 LEU H 3.54  (#peak 300 #SUP 0.99 #QF 0.99 )
 &rst
  ixpk= 300, nxpk= 0, iat= 899, 917, r1= 1.30, r2= 1.80, r3= 3.54, r4= 4.04,  &end
#
# 563 PHE QD 608 ILE HA 3.68  (#peak 302 #SUP 0.65 #QF 0.41 )
 &rst
  ixpk= 302, nxpk= 0, iat=  -1, 899, r1= 1.30, r2= 1.80, r3= 4.13, r4= 4.63,
 igr1= 179, 180,
 &end
#
# 563 PHE QE 608 ILE HA 4.16  (#peak 302 #SUP 0.65 #QF 0.41 )
 &rst
  ixpk= 302, nxpk= 0, iat=  -1, 899, r1= 1.30, r2= 1.80, r3= 4.67, r4= 5.17,
 igr1= 181, 182,
 &end
#
# 562 CYS HA 608 ILE HA 4.12  (#peak 303 #SUP 0.90 #QF 0.90 )
 &rst
  ixpk= 303, nxpk= 0, iat= 160, 899, r1= 1.30, r2= 1.80, r3= 4.12, r4= 4.62,  &end
#
# 608 ILE HA 608 ILE QG1 3.81  (#peak 308 #SUP 0.98 #QF 0.98 )
 &rst
  ixpk= 308, nxpk= 0, iat= 899,  -1, r1= 1.30, r2= 1.80, r3= 4.28, r4= 4.78,
 igr2= 901, 902,
 &end
#
# 608 ILE HA 608 ILE QG2 3.03  (#peak 309 #SUP 0.90 #QF 0.90 )
 &rst
  ixpk= 309, nxpk= 0, iat= 899,  -1, r1= 1.30, r2= 1.80, r3= 3.64, r4= 4.14,
 igr2= 903, 904, 905,
 &end
#
# 557 LYS H 580 LEU HG 4.45  (#peak 322 #SUP 0.88 #QF 0.88 )
 &rst
  ixpk= 322, nxpk= 0, iat=  92, 464, r1= 1.30, r2= 1.80, r3= 4.45, r4= 4.95,  &end
#
# 557 LYS HA 580 LEU HG 4.20  (#peak 323 #SUP 0.86 #QF 0.86 )
 &rst
  ixpk= 323, nxpk= 0, iat=  93, 464, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,  &end
#
# 577 VAL QG1 580 LEU HG 4.63  (#peak 332 #SUP 0.57 #QF 0.57 )
 &rst
  ixpk= 332, nxpk= 0, iat=  -1, 464, r1= 1.30, r2= 1.80, r3= 5.56, r4= 6.06,
 igr1= 421, 422, 423,
 &end
#
# 578 GLU QG 579 ALA HA 4.42  (#peak 356 #SUP 0.78 #QF 0.78 )
 &rst
  ixpk= 356, nxpk= 0, iat=  -1, 448, r1= 1.30, r2= 1.80, r3= 4.96, r4= 5.46,
 igr1= 440, 441,
 &end
#
# 578 GLU QG 588 VAL HB 3.77  (#peak 361 #SUP 0.66 #QF 0.66 )
 &rst
  ixpk= 361, nxpk= 0, iat=  -1, 567, r1= 1.30, r2= 1.80, r3= 4.23, r4= 4.73,
 igr1= 440, 441,
 &end
#
# 578 GLU QG 579 ALA QB 4.67  (#peak 363 #SUP 0.65 #QF 0.65 )
 &rst
  ixpk= 363, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.30, r4= 6.80,
 igr1= 440, 441,
 igr2= 449, 450, 451,
 &end
#
# 568 GLU HB2 570 ASN H 5.50  (#peak 364 #SUP 0.74 #QF 0.74 )
 &rst
  ixpk= 364, nxpk= 0, iat= 269, 293, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
# 578 GLU H 588 VAL QG1 4.80  (#peak 372 #SUP 0.34 #QF 0.34 )
 &rst
  ixpk= 372, nxpk= 0, iat= 436,  -1, r1= 1.30, r2= 1.80, r3= 5.76, r4= 6.26,
 igr2= 568, 569, 570,
 &end
#
# 588 VAL QG2 600 VAL H 4.76  (#peak 373 #SUP 0.65 #QF 0.65 )
 &rst
  ixpk= 373, nxpk= 0, iat=  -1, 763, r1= 1.30, r2= 1.80, r3= 5.72, r4= 6.22,
 igr1= 571, 572, 573,
 &end
#
# 588 VAL QG1 589 VAL H 3.11  (#peak 374 #SUP 0.67 #QF 0.67 )
 &rst
  ixpk= 374, nxpk= 0, iat=  -1, 581, r1= 1.30, r2= 1.80, r3= 3.73, r4= 4.23,
 igr1= 568, 569, 570,
 &end
#
# 588 VAL QG1 598 GLU H 3.78  (#peak 375 #SUP 0.54 #QF 0.54 )
 &rst
  ixpk= 375, nxpk= 0, iat=  -1, 735, r1= 1.30, r2= 1.80, r3= 4.54, r4= 5.04,
 igr1= 568, 569, 570,
 &end
#
# 588 VAL H 588 VAL QG2 3.07  (#peak 376 #SUP 0.93 #QF 0.93 )
 &rst
  ixpk= 376, nxpk= 0, iat= 565,  -1, r1= 1.30, r2= 1.80, r3= 3.69, r4= 4.19,
 igr2= 571, 572, 573,
 &end
#
# 588 VAL QG1 598 GLU HA 3.70  (#peak 381 #SUP 0.67 #QF 0.67 )
 &rst
  ixpk= 381, nxpk= 0, iat=  -1, 736, r1= 1.30, r2= 1.80, r3= 4.44, r4= 4.94,
 igr1= 568, 569, 570,
 &end
#
# 588 VAL HA 588 VAL QG1 2.92  (#peak 382 #SUP 0.99 #QF 0.91 )
 &rst
  ixpk= 382, nxpk= 0, iat= 566,  -1, r1= 1.30, r2= 1.80, r3= 3.51, r4= 4.01,
 igr2= 568, 569, 570,
 &end
#
# 588 VAL HA 588 VAL QG2 3.35  (#peak 382 #SUP 0.99 #QF 0.91 )
 &rst
  ixpk= 382, nxpk= 0, iat= 566,  -1, r1= 1.30, r2= 1.80, r3= 4.02, r4= 4.52,
 igr2= 571, 572, 573,
 &end
#
# 588 VAL QG1 590 LYS HA 4.96  (#peak 383 #SUP 0.79 #QF 0.79 )
 &rst
  ixpk= 383, nxpk= 0, iat=  -1, 600, r1= 1.30, r2= 1.80, r3= 5.96, r4= 6.46,
 igr1= 568, 569, 570,
 &end
#
# 588 VAL QG1 597 TYR HB2 3.61  (#peak 384 #SUP 0.53 #QF 0.53 )
 &rst
  ixpk= 384, nxpk= 0, iat=  -1, 719, r1= 1.30, r2= 1.80, r3= 4.34, r4= 4.84,
 igr1= 568, 569, 570,
 &end
#
# 578 GLU H 589 VAL QG1 3.46  (#peak 415 #SUP 0.94 #QF 0.94 )
 &rst
  ixpk= 415, nxpk= 0, iat= 436,  -1, r1= 1.30, r2= 1.80, r3= 4.16, r4= 4.66,
 igr2= 584, 585, 586,
 &end
#
# 589 VAL H 589 VAL QG1 3.40  (#peak 416 #SUP 0.98 #QF 0.98 )
 &rst
  ixpk= 416, nxpk= 0, iat= 581,  -1, r1= 1.30, r2= 1.80, r3= 4.08, r4= 4.58,
 igr2= 584, 585, 586,
 &end
#
# 577 VAL H 589 VAL QG1 4.08  (#peak 417 #SUP 0.98 #QF 0.98 )
 &rst
  ixpk= 417, nxpk= 0, iat= 418,  -1, r1= 1.30, r2= 1.80, r3= 4.90, r4= 5.40,
 igr2= 584, 585, 586,
 &end
#
# 589 VAL QG1 590 LYS H 4.04  (#peak 418 #SUP 0.56 #QF 0.56 )
 &rst
  ixpk= 418, nxpk= 0, iat=  -1, 599, r1= 1.30, r2= 1.80, r3= 4.85, r4= 5.35,
 igr1= 584, 585, 586,
 &end
#
# 576 GLU H 589 VAL QG1 5.50  (#peak 419 #SUP 0.80 #QF 0.80 )
 &rst
  ixpk= 419, nxpk= 0, iat= 405,  -1, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr2= 584, 585, 586,
 &end
#
# 579 ALA H 589 VAL QG1 4.59  (#peak 420 #SUP 0.96 #QF 0.96 )
 &rst
  ixpk= 420, nxpk= 0, iat= 447,  -1, r1= 1.30, r2= 1.80, r3= 5.51, r4= 6.01,
 igr2= 584, 585, 586,
 &end
#
# 589 VAL HA 589 VAL QG1 2.98  (#peak 421 #SUP 0.91 #QF 0.91 )
 &rst
  ixpk= 421, nxpk= 0, iat= 582,  -1, r1= 1.30, r2= 1.80, r3= 3.58, r4= 4.08,
 igr2= 584, 585, 586,
 &end
#
# 588 VAL HA 589 VAL QG1 4.18  (#peak 422 #SUP 0.98 #QF 0.98 )
 &rst
  ixpk= 422, nxpk= 0, iat= 566,  -1, r1= 1.30, r2= 1.80, r3= 5.02, r4= 5.52,
 igr2= 584, 585, 586,
 &end
#
# 577 VAL HA 589 VAL QG1 3.03  (#peak 423 #SUP 0.96 #QF 0.96 )
 &rst
  ixpk= 423, nxpk= 0, iat= 419,  -1, r1= 1.30, r2= 1.80, r3= 3.64, r4= 4.14,
 igr2= 584, 585, 586,
 &end
#
# 577 VAL HB 589 VAL QG1 4.31  (#peak 424 #SUP 0.67 #QF 0.67 )
 &rst
  ixpk= 424, nxpk= 0, iat= 420,  -1, r1= 1.30, r2= 1.80, r3= 5.18, r4= 5.68,
 igr2= 584, 585, 586,
 &end
#
# 589 VAL QG1 600 VAL HB 4.46  (#peak 425 #SUP 0.87 #QF 0.87 )
 &rst
  ixpk= 425, nxpk= 0, iat=  -1, 765, r1= 1.30, r2= 1.80, r3= 5.36, r4= 5.86,
 igr1= 584, 585, 586,
 &end
#
# 587 ALA QB 589 VAL QG1 2.93  (#peak 427 #SUP 0.33 #QF 0.33 )
 &rst
  ixpk= 427, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.23, r4= 4.73,
 igr1= 555, 556, 557,
 igr2= 584, 585, 586,
 &end
#
# 589 VAL QG1 605 ILE QG2 3.01  (#peak 429 #SUP 0.99 #QF 0.98 )
 &rst
  ixpk= 429, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.34, r4= 4.84,
 igr1= 584, 585, 586,
 igr2= 848, 849, 850,
 &end
#
# 589 VAL QG1 605 ILE QD1 3.18  (#peak 430 #SUP 0.99 #QF 0.99 )
 &rst
  ixpk= 430, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.59, r4= 5.09,
 igr1= 584, 585, 586,
 igr2= 851, 852, 853,
 &end
#
# 589 VAL QG2 598 GLU QB 4.94  (#peak 445 #SUP 0.79 #QF 0.79 )
 &rst
  ixpk= 445, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.66, r4= 7.16,
 igr1= 587, 588, 589,
 igr2= 737, 738,
 &end
#
# 590 LYS HB2 597 TYR QE 4.18  (#peak 458 #SUP 0.58 #QF 0.58 )
 &rst
  ixpk= 458, nxpk= 0, iat= 601,  -1, r1= 1.30, r2= 1.80, r3= 4.69, r4= 5.19,
 igr2= 723, 724,
 &end
#
# 576 GLU QB 590 LYS HB2 4.79  (#peak 461 #SUP 0.97 #QF 0.97 )
 &rst
  ixpk= 461, nxpk= 0, iat=  -1, 601, r1= 1.30, r2= 1.80, r3= 5.38, r4= 5.88,
 igr1= 407, 408,
 &end
#
# 576 GLU H 590 LYS HB3 4.62  (#peak 477 #SUP 0.62 #QF 0.62 )
 &rst
  ixpk= 477, nxpk= 0, iat= 405, 602, r1= 1.30, r2= 1.80, r3= 4.62, r4= 5.12,  &end
#
# 607 PRO HB3 608 ILE H 3.93  (#peak 485 #SUP 0.99 #QF 0.99 )
 &rst
  ixpk= 485, nxpk= 0, iat= 885, 898, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,  &end
#
# 556 TRP HZ2 562 CYS HB2 4.54  (#peak 496 #SUP 0.98 #QF 0.98 )
 &rst
  ixpk= 496, nxpk= 0, iat=  80, 161, r1= 1.30, r2= 1.80, r3= 4.54, r4= 5.04,  &end
#
# 574 ARG H 592 ILE HG13 5.26  (#peak 523 #SUP 0.88 #QF 0.88 )
 &rst
  ixpk= 523, nxpk= 0, iat= 373, 644, r1= 1.30, r2= 1.80, r3= 5.26, r4= 5.76,  &end
#
# 575 ALA HA 592 ILE HG13 3.66  (#peak 525 #SUP 0.90 #QF 0.90 )
 &rst
  ixpk= 525, nxpk= 0, iat= 392, 644, r1= 1.30, r2= 1.80, r3= 3.66, r4= 4.16,  &end
#
# 591 PHE HA 592 ILE HG13 4.20  (#peak 527 #SUP 0.83 #QF 0.83 )
 &rst
  ixpk= 527, nxpk= 0, iat= 624, 644, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,  &end
#
# 592 ILE QG2 592 ILE HG13 3.27  (#peak 531 #SUP 0.75 #QF 0.75 )
 &rst
  ixpk= 531, nxpk= 0, iat=  -1, 644, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1= 645, 646, 647,
 &end
#
# 592 ILE H 592 ILE HG12 3.85  (#peak 532 #SUP 0.99 #QF 0.99 )
 &rst
  ixpk= 532, nxpk= 0, iat= 640, 643, r1= 1.30, r2= 1.80, r3= 3.85, r4= 4.35,  &end
#
# 558 PRO HB2 559 GLY H 3.81  (#peak 558 #SUP 0.94 #QF 0.67 )
 &rst
  ixpk= 558, nxpk= 0, iat= 113, 123, r1= 1.30, r2= 1.80, r3= 3.81, r4= 4.31,  &end
#
# 559 GLY H 577 VAL HB 4.22  (#peak 558 #SUP 0.94 #QF 0.67 )
 &rst
  ixpk= 558, nxpk= 0, iat= 123, 420, r1= 1.30, r2= 1.80, r3= 4.22, r4= 4.72,  &end
#
# 576 GLU HA 577 VAL HB 4.54  (#peak 561 #SUP 0.67 #QF 0.67 )
 &rst
  ixpk= 561, nxpk= 0, iat= 406, 420, r1= 1.30, r2= 1.80, r3= 4.54, r4= 5.04,  &end
#
# 558 PRO HB2 578 GLU HA 4.89  (#peak 562 #SUP 0.90 #QF 0.90 )
 &rst
  ixpk= 562, nxpk= 0, iat= 113, 437, r1= 1.30, r2= 1.80, r3= 4.89, r4= 5.39,  &end
#
# 560 ASP QB 577 VAL HB 3.89  (#peak 566 #SUP 0.48 #QF 0.48 )
 &rst
  ixpk= 566, nxpk= 0, iat=  -1, 420, r1= 1.30, r2= 1.80, r3= 4.37, r4= 4.87,
 igr1= 136, 137,
 &end
#
# 561 GLU QB 608 ILE QG1 4.60  (#peak 584 #SUP 0.99 #QF 0.99 )
 &rst
  ixpk= 584, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.80, r4= 6.30,
 igr1= 149, 150,
 igr2= 901, 902,
 &end
#
# 561 GLU QB 592 ILE QD1 4.25  (#peak 586 #SUP 0.99 #QF 0.70 )
 &rst
  ixpk= 586, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.73, r4= 6.23,
 igr1= 149, 150,
 igr2= 648, 649, 650,
 &end
#
# 561 GLU QB 608 ILE QD1 3.79  (#peak 587 #SUP 0.90 #QF 0.90 )
 &rst
  ixpk= 587, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.11, r4= 5.61,
 igr1= 149, 150,
 igr2= 906, 907, 908,
 &end
#
# 566 TYR H 566 TYR HB2 4.02  (#peak 612 #SUP 0.87 #QF 0.87 )
 &rst
  ixpk= 612, nxpk= 0, iat= 225, 227, r1= 1.30, r2= 1.80, r3= 4.02, r4= 4.52,  &end
#
# 569 ASP H 570 ASN HB2 4.98  (#peak 621 #SUP 0.82 #QF 0.82 )
 &rst
  ixpk= 621, nxpk= 0, iat= 281, 295, r1= 1.30, r2= 1.80, r3= 4.98, r4= 5.48,  &end
#
# 605 ILE HB 606 LYS H 4.18  (#peak 627 #SUP 0.99 #QF 0.99 )
 &rst
  ixpk= 627, nxpk= 0, iat= 845, 863, r1= 1.30, r2= 1.80, r3= 4.18, r4= 4.68,  &end
#
# 605 ILE H 605 ILE HB 3.65  (#peak 628 #SUP 0.99 #QF 0.99 )
 &rst
  ixpk= 628, nxpk= 0, iat= 843, 845, r1= 1.30, r2= 1.80, r3= 3.65, r4= 4.15,  &end
#
# 564 ALA HA 605 ILE HB 4.76  (#peak 629 #SUP 1.00   )
 &rst
  ixpk= 629, nxpk= 0, iat= 190, 845, r1= 1.30, r2= 1.80, r3= 4.76, r4= 5.26,  &end
#
# 602 LEU HA 605 ILE HB 4.28  (#peak 631 #SUP 1.00   )
 &rst
  ixpk= 631, nxpk= 0, iat= 800, 845, r1= 1.30, r2= 1.80, r3= 4.28, r4= 4.78,  &end
#
# 562 CYS HB3 605 ILE HB 5.17  (#peak 632 #SUP 1.00   )
 &rst
  ixpk= 632, nxpk= 0, iat= 162, 845, r1= 1.30, r2= 1.80, r3= 5.17, r4= 5.67,  &end
#
# 602 LEU QB 605 ILE HB 5.34  (#peak 633 #SUP 0.84 #QF 0.84 )
 &rst
  ixpk= 633, nxpk= 0, iat=  -1, 845, r1= 1.30, r2= 1.80, r3= 5.99, r4= 6.49,
 igr1= 801, 802,
 &end
#
# 605 ILE HB 605 ILE QD1 3.41  (#peak 637 #SUP 1.00   )
 &rst
  ixpk= 637, nxpk= 0, iat= 845,  -1, r1= 1.30, r2= 1.80, r3= 4.10, r4= 4.60,
 igr2= 851, 852, 853,
 &end
#
# 568 GLU HA 568 GLU HB2 2.85  (#peak 645 #SUP 0.87 #QF 0.87 )
 &rst
  ixpk= 645, nxpk= 0, iat= 268, 269, r1= 1.30, r2= 1.80, r3= 2.85, r4= 3.35,  &end
#
# 561 GLU HA 561 GLU QG 3.77  (#peak 659 #SUP 0.99 #QF 0.99 )
 &rst
  ixpk= 659, nxpk= 0, iat= 148,  -1, r1= 1.30, r2= 1.80, r3= 4.23, r4= 4.73,
 igr2= 151, 152,
 &end
#
# 560 ASP HA 561 GLU QG 4.60  (#peak 660 #SUP 0.94 #QF 0.94 )
 &rst
  ixpk= 660, nxpk= 0, iat= 135,  -1, r1= 1.30, r2= 1.80, r3= 5.16, r4= 5.66,
 igr2= 151, 152,
 &end
#
# 561 GLU QB 561 GLU QG 3.00  (#peak 664 #SUP 0.81 #QF 0.81 )
 &rst
  ixpk= 664, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 3.78, r4= 4.28,
 igr1= 149, 150,
 igr2= 151, 152,
 &end
#
# 596 ASN QB 597 TYR H 3.77  (#peak 675 #SUP 0.92 #QF 0.92 )
 &rst
  ixpk= 675, nxpk= 0, iat=  -1, 717, r1= 1.30, r2= 1.80, r3= 4.23, r4= 4.73,
 igr1= 701, 702,
 &end
#
# 565 LEU H 604 ASN HB2 4.48  (#peak 679 #SUP 0.99 #QF 0.99 )
 &rst
  ixpk= 679, nxpk= 0, iat= 202, 831, r1= 1.30, r2= 1.80, r3= 4.48, r4= 4.98,  &end
#
# 604 ASN HB2 605 ILE H 4.09  (#peak 680 #SUP 0.76 #QF 0.76 )
 &rst
  ixpk= 680, nxpk= 0, iat= 831, 843, r1= 1.30, r2= 1.80, r3= 4.09, r4= 4.59,  &end
#
# 562 CYS HA 608 ILE HB 4.25  (#peak 702 #SUP 1.00 #QF 0.99 )
 &rst
  ixpk= 702, nxpk= 0, iat= 160, 900, r1= 1.30, r2= 1.80, r3= 4.25, r4= 4.75,  &end
#
# 592 ILE H 592 ILE HB 3.64  (#peak 709 #SUP 1.00   )
 &rst
  ixpk= 709, nxpk= 0, iat= 640, 642, r1= 1.30, r2= 1.80, r3= 3.64, r4= 4.14,  &end
#
# 575 ALA HA 592 ILE HB 4.53  (#peak 710 #SUP 1.00   )
 &rst
  ixpk= 710, nxpk= 0, iat= 392, 642, r1= 1.30, r2= 1.80, r3= 4.53, r4= 5.03,  &end
#
# 591 PHE HA 592 ILE HB 5.14  (#peak 712 #SUP 0.56 #QF 0.56 )
 &rst
  ixpk= 712, nxpk= 0, iat= 624, 642, r1= 1.30, r2= 1.80, r3= 5.14, r4= 5.64,  &end
#
# 565 LEU HB3 605 ILE H 5.38  (#peak 719 #SUP 0.51 #QF 0.51 )
 &rst
  ixpk= 719, nxpk= 0, iat= 205, 843, r1= 1.30, r2= 1.80, r3= 5.38, r4= 5.88,  &end
#
# 585 MET QE 586 THR HB 4.96  (#peak 731 #SUP 1.00   )
 &rst
  ixpk= 731, nxpk= 0, iat=  -1, 543, r1= 1.30, r2= 1.80, r3= 5.96, r4= 6.46,
 igr1= 531, 532, 533,
 &end
#
# 592 ILE H 592 ILE QD1 3.88  (#peak 748 #SUP 1.00   )
 &rst
  ixpk= 748, nxpk= 0, iat= 640,  -1, r1= 1.30, r2= 1.80, r3= 4.66, r4= 5.16,
 igr2= 648, 649, 650,
 &end
#
# 575 ALA HA 592 ILE QD1 3.67  (#peak 749 #SUP 0.97 #QF 0.97 )
 &rst
  ixpk= 749, nxpk= 0, iat= 392,  -1, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,
 igr2= 648, 649, 650,
 &end
#
# 561 GLU QG 592 ILE QD1 4.40  (#peak 755 #SUP 0.83 #QF 0.83 )
 &rst
  ixpk= 755, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.93, r4= 6.43,
 igr1= 151, 152,
 igr2= 648, 649, 650,
 &end
#
# 576 GLU QG 592 ILE QD1 3.48  (#peak 757 #SUP 0.97 #QF 0.61 )
 &rst
  ixpk= 757, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.69, r4= 5.19,
 igr1= 409, 410,
 igr2= 648, 649, 650,
 &end
#
# 576 GLU QB 592 ILE QD1 3.53  (#peak 758 #SUP 0.99 #QF 0.99 )
 &rst
  ixpk= 758, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.76, r4= 5.26,
 igr1= 407, 408,
 igr2= 648, 649, 650,
 &end
#
# 562 CYS H 608 ILE QD1 4.35  (#peak 762 #SUP 0.97 #QF 0.97 )
 &rst
  ixpk= 762, nxpk= 0, iat= 159,  -1, r1= 1.30, r2= 1.80, r3= 5.22, r4= 5.72,
 igr2= 906, 907, 908,
 &end
#
# 562 CYS HA 608 ILE QD1 3.45  (#peak 766 #SUP 0.96 #QF 0.96 )
 &rst
  ixpk= 766, nxpk= 0, iat= 160,  -1, r1= 1.30, r2= 1.80, r3= 4.14, r4= 4.64,
 igr2= 906, 907, 908,
 &end
#
# 574 ARG HA 608 ILE QD1 4.48  (#peak 767 #SUP 0.98 #QF 0.98 )
 &rst
  ixpk= 767, nxpk= 0, iat= 374,  -1, r1= 1.30, r2= 1.80, r3= 5.38, r4= 5.88,
 igr2= 906, 907, 908,
 &end
#
# 608 ILE HA 608 ILE QD1 3.77  (#peak 768 #SUP 0.99 #QF 0.99 )
 &rst
  ixpk= 768, nxpk= 0, iat= 899,  -1, r1= 1.30, r2= 1.80, r3= 4.53, r4= 5.03,
 igr2= 906, 907, 908,
 &end
#
# 561 GLU QG 608 ILE QD1 4.05  (#peak 770 #SUP 0.99 #QF 0.99 )
 &rst
  ixpk= 770, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.46, r4= 5.96,
 igr1= 151, 152,
 igr2= 906, 907, 908,
 &end
#
# 608 ILE HB 608 ILE QD1 3.19  (#peak 772 #SUP 1.00   )
 &rst
  ixpk= 772, nxpk= 0, iat= 900,  -1, r1= 1.30, r2= 1.80, r3= 3.83, r4= 4.33,
 igr2= 906, 907, 908,
 &end
#
# 608 ILE QG2 608 ILE QD1 2.57  (#peak 775 #SUP 0.57 #QF 0.57 )
 &rst
  ixpk= 775, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 3.71, r4= 4.21,
 igr1= 903, 904, 905,
 igr2= 906, 907, 908,
 &end
#
# 562 CYS H 608 ILE QG2 5.50  (#peak 777 #SUP 0.82 #QF 0.82 )
 &rst
  ixpk= 777, nxpk= 0, iat= 159,  -1, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr2= 903, 904, 905,
 &end
#
# 608 ILE H 608 ILE QG2 3.48  (#peak 778 #SUP 0.99 #QF 0.99 )
 &rst
  ixpk= 778, nxpk= 0, iat= 898,  -1, r1= 1.30, r2= 1.80, r3= 4.18, r4= 4.68,
 igr2= 903, 904, 905,
 &end
#
# 608 ILE QG2 609 LEU H 3.83  (#peak 779 #SUP 0.98 #QF 0.98 )
 &rst
  ixpk= 779, nxpk= 0, iat=  -1, 917, r1= 1.30, r2= 1.80, r3= 4.60, r4= 5.10,
 igr1= 903, 904, 905,
 &end
#
# 563 PHE QE 608 ILE QG2 4.23  (#peak 781 #SUP 0.60 #QF 0.25 )
 &rst
  ixpk= 781, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.70, r4= 6.20,
 igr1= 181, 182,
 igr2= 903, 904, 905,
 &end
#
# 562 CYS HA 608 ILE QG2 4.03  (#peak 782 #SUP 0.99 #QF 0.99 )
 &rst
  ixpk= 782, nxpk= 0, iat= 160,  -1, r1= 1.30, r2= 1.80, r3= 4.84, r4= 5.34,
 igr2= 903, 904, 905,
 &end
#
# 608 ILE QG2 609 LEU HA 4.10  (#peak 783 #SUP 0.88 #QF 0.88 )
 &rst
  ixpk= 783, nxpk= 0, iat=  -1, 918, r1= 1.30, r2= 1.80, r3= 4.92, r4= 5.42,
 igr1= 903, 904, 905,
 &end
#
# 561 GLU QG 608 ILE QG2 4.67  (#peak 786 #SUP 0.82 #QF 0.82 )
 &rst
  ixpk= 786, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.30, r4= 6.80,
 igr1= 151, 152,
 igr2= 903, 904, 905,
 &end
#
# 608 ILE QG2 609 LEU QB 3.64  (#peak 789 #SUP 0.92 #QF 0.92 )
 &rst
  ixpk= 789, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.91, r4= 5.41,
 igr1= 903, 904, 905,
 igr2= 919, 920,
 &end
#
# 592 ILE QG2 593 ASP H 4.53  (#peak 794 #SUP 0.92 #QF 0.92 )
 &rst
  ixpk= 794, nxpk= 0, iat=  -1, 659, r1= 1.30, r2= 1.80, r3= 5.44, r4= 5.94,
 igr1= 645, 646, 647,
 &end
#
# 576 GLU H 592 ILE QG2 4.01  (#peak 795 #SUP 0.90 #QF 0.90 )
 &rst
  ixpk= 795, nxpk= 0, iat= 405,  -1, r1= 1.30, r2= 1.80, r3= 4.82, r4= 5.32,
 igr2= 645, 646, 647,
 &end
#
# 592 ILE H 592 ILE QG2 3.82  (#peak 796 #SUP 1.00   )
 &rst
  ixpk= 796, nxpk= 0, iat= 640,  -1, r1= 1.30, r2= 1.80, r3= 4.59, r4= 5.09,
 igr2= 645, 646, 647,
 &end
#
# 592 ILE HA 592 ILE QG2 2.97  (#peak 800 #SUP 0.99 #QF 0.99 )
 &rst
  ixpk= 800, nxpk= 0, iat= 641,  -1, r1= 1.30, r2= 1.80, r3= 3.57, r4= 4.07,
 igr2= 645, 646, 647,
 &end
#
# 605 ILE QG2 606 LYS H 3.29  (#peak 812 #SUP 0.89 #QF 0.89 )
 &rst
  ixpk= 812, nxpk= 0, iat=  -1, 863, r1= 1.30, r2= 1.80, r3= 3.95, r4= 4.45,
 igr1= 848, 849, 850,
 &end
#
# 589 VAL QG2 598 GLU H 3.67  (#peak 814 #SUP 0.68 #QF 0.68 )
 &rst
  ixpk= 814, nxpk= 0, iat=  -1, 735, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,
 igr1= 587, 588, 589,
 &end
#
# 589 VAL QG2 590 LYS H 4.19  (#peak 815 #SUP 0.83 #QF 0.83 )
 &rst
  ixpk= 815, nxpk= 0, iat=  -1, 599, r1= 1.30, r2= 1.80, r3= 5.03, r4= 5.53,
 igr1= 587, 588, 589,
 &end
#
# 605 ILE H 605 ILE QG2 3.80  (#peak 817 #SUP 0.86 #QF 0.86 )
 &rst
  ixpk= 817, nxpk= 0, iat= 843,  -1, r1= 1.30, r2= 1.80, r3= 4.56, r4= 5.06,
 igr2= 848, 849, 850,
 &end
#
# 556 TRP HZ2 605 ILE QG2 3.56  (#peak 818 #SUP 0.78 #QF 0.78 )
 &rst
  ixpk= 818, nxpk= 0, iat=  80,  -1, r1= 1.30, r2= 1.80, r3= 4.28, r4= 4.78,
 igr2= 848, 849, 850,
 &end
#
# 556 TRP HH2 605 ILE QG2 4.82  (#peak 820 #SUP 0.77 #QF 0.77 )
 &rst
  ixpk= 820, nxpk= 0, iat=  82,  -1, r1= 1.30, r2= 1.80, r3= 5.79, r4= 6.29,
 igr2= 848, 849, 850,
 &end
#
# 564 ALA HA 605 ILE QG2 3.40  (#peak 821 #SUP 0.87 #QF 0.87 )
 &rst
  ixpk= 821, nxpk= 0, iat= 190,  -1, r1= 1.30, r2= 1.80, r3= 4.08, r4= 4.58,
 igr2= 848, 849, 850,
 &end
#
# 605 ILE HA 605 ILE QG2 3.01  (#peak 822 #SUP 0.81 #QF 0.81 )
 &rst
  ixpk= 822, nxpk= 0, iat= 844,  -1, r1= 1.30, r2= 1.80, r3= 3.61, r4= 4.11,
 igr2= 848, 849, 850,
 &end
#
# 588 VAL HA 589 VAL QG2 3.77  (#peak 823 #SUP 0.88 #QF 0.88 )
 &rst
  ixpk= 823, nxpk= 0, iat= 566,  -1, r1= 1.30, r2= 1.80, r3= 4.53, r4= 5.03,
 igr2= 587, 588, 589,
 &end
#
# 562 CYS HB2 605 ILE QG2 3.58  (#peak 826 #SUP 0.84 #QF 0.84 )
 &rst
  ixpk= 826, nxpk= 0, iat= 161,  -1, r1= 1.30, r2= 1.80, r3= 4.30, r4= 4.80,
 igr2= 848, 849, 850,
 &end
#
# 562 CYS HB3 605 ILE QG2 3.58  (#peak 827 #SUP 0.86 #QF 0.86 )
 &rst
  ixpk= 827, nxpk= 0, iat= 162,  -1, r1= 1.30, r2= 1.80, r3= 4.30, r4= 4.80,
 igr2= 848, 849, 850,
 &end
#
# 589 VAL QG2 600 VAL HB 4.14  (#peak 828 #SUP 0.83 #QF 0.73 )
 &rst
  ixpk= 828, nxpk= 0, iat=  -1, 765, r1= 1.30, r2= 1.80, r3= 4.97, r4= 5.47,
 igr1= 587, 588, 589,
 &end
#
# 589 VAL QG2 598 GLU QG 4.31  (#peak 829 #SUP 0.89 #QF 0.89 )
 &rst
  ixpk= 829, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.81, r4= 6.31,
 igr1= 587, 588, 589,
 igr2= 739, 740,
 &end
#
# 564 ALA QB 589 VAL QG2 2.81  (#peak 831 #SUP 0.99 #QF 0.68 )
 &rst
  ixpk= 831, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.05, r4= 4.55,
 igr1= 191, 192, 193,
 igr2= 587, 588, 589,
 &end
#
# 605 ILE QG2 605 ILE QD1 2.77  (#peak 833 #SUP 0.86 #QF 0.86 )
 &rst
  ixpk= 833, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.00, r4= 4.50,
 igr1= 848, 849, 850,
 igr2= 851, 852, 853,
 &end
#
# 605 ILE H 605 ILE QG1 4.03  (#peak 836 #SUP 0.98 #QF 0.65 )
 &rst
  ixpk= 836, nxpk= 0, iat= 843,  -1, r1= 1.30, r2= 1.80, r3= 4.52, r4= 5.02,
 igr2= 846, 847,
 &end
#
# 556 TRP HZ2 605 ILE QG1 5.09  (#peak 837 #SUP 0.68 #QF 0.68 )
 &rst
  ixpk= 837, nxpk= 0, iat=  80,  -1, r1= 1.30, r2= 1.80, r3= 5.71, r4= 6.21,
 igr2= 846, 847,
 &end
#
# 602 LEU HA 605 ILE QG1 4.11  (#peak 838 #SUP 0.98 #QF 0.98 )
 &rst
  ixpk= 838, nxpk= 0, iat= 800,  -1, r1= 1.30, r2= 1.80, r3= 4.61, r4= 5.11,
 igr2= 846, 847,
 &end
#
# 605 ILE QG2 605 ILE QG1 3.73  (#peak 841 #SUP 0.80 #QF 0.80 )
 &rst
  ixpk= 841, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.03, r4= 5.53,
 igr1= 848, 849, 850,
 igr2= 846, 847,
 &end
#
# 562 CYS HA 608 ILE QG1 3.89  (#peak 844 #SUP 0.95 #QF 0.95 )
 &rst
  ixpk= 844, nxpk= 0, iat= 160,  -1, r1= 1.30, r2= 1.80, r3= 4.37, r4= 4.87,
 igr2= 901, 902,
 &end
#
# 571 LYS QD 572 PHE HA 4.76  (#peak 861 #SUP 0.55 #QF 0.55 )
 &rst
  ixpk= 861, nxpk= 0, iat=  -1, 333, r1= 1.30, r2= 1.80, r3= 5.34, r4= 5.84,
 igr1= 314, 315,
 &end
#
# 574 ARG QB 592 ILE HG12 4.06  (#peak 884 #SUP 0.28 #QF 0.28 )
 &rst
  ixpk= 884, nxpk= 0, iat=  -1, 643, r1= 1.30, r2= 1.80, r3= 4.56, r4= 5.06,
 igr1= 375, 376,
 &end
#
# 574 ARG QB 592 ILE QD1 3.65  (#peak 885 #SUP 0.29 #QF 0.29 )
 &rst
  ixpk= 885, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.92, r4= 5.42,
 igr1= 375, 376,
 igr2= 648, 649, 650,
 &end
#
# 574 ARG QB 608 ILE QD1 4.23  (#peak 888 #SUP 0.34 #QF 0.34 )
 &rst
  ixpk= 888, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.70, r4= 6.20,
 igr1= 375, 376,
 igr2= 906, 907, 908,
 &end
#
# 578 GLU QB 597 TYR QE 4.75  (#peak 889 #SUP 0.40 #QF 0.40 )
 &rst
  ixpk= 889, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.98, r4= 6.48,
 igr1= 438, 439,
 igr2= 723, 724,
 &end
#
# 588 VAL HA 599 GLU QB 4.75  (#peak 890 #SUP 0.81 #QF 0.81 )
 &rst
  ixpk= 890, nxpk= 0, iat= 566,  -1, r1= 1.30, r2= 1.80, r3= 5.33, r4= 5.83,
 igr2= 752, 753,
 &end
#
# 574 ARG QB 574 ARG QD 3.48  (#peak 891     )
 &rst
  ixpk= 891, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.38, r4= 4.88,
 igr1= 375, 376,
 igr2= 379, 380,
 &end
#
# 574 ARG QB 574 ARG QG 2.50  (#peak 892     )
 &rst
  ixpk= 892, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 3.15, r4= 3.65,
 igr1= 375, 376,
 igr2= 377, 378,
 &end
#
# 578 GLU QB 579 ALA QB 4.08  (#peak 894 #SUP 0.93 #QF 0.93 )
 &rst
  ixpk= 894, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,
 igr1= 438, 439,
 igr2= 449, 450, 451,
 &end
#
# 578 GLU QB 588 VAL QG1 3.37  (#peak 896 #SUP 0.69 #QF 0.69 )
 &rst
  ixpk= 896, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.54, r4= 5.04,
 igr1= 438, 439,
 igr2= 568, 569, 570,
 &end
#
# 578 GLU H 589 VAL HB 4.96  (#peak 909 #SUP 0.92 #QF 0.92 )
 &rst
  ixpk= 909, nxpk= 0, iat= 436, 583, r1= 1.30, r2= 1.80, r3= 4.96, r4= 5.46,  &end
#
# 575 ALA QB 589 VAL HB 3.23  (#peak 913 #SUP 0.66 #QF 0.66 )
 &rst
  ixpk= 913, nxpk= 0, iat=  -1, 583, r1= 1.30, r2= 1.80, r3= 3.88, r4= 4.38,
 igr1= 393, 394, 395,
 &end
#
# 576 GLU QB 577 VAL H 3.73  (#peak 916 #SUP 0.97 #QF 0.97 )
 &rst
  ixpk= 916, nxpk= 0, iat=  -1, 418, r1= 1.30, r2= 1.80, r3= 4.19, r4= 4.69,
 igr1= 407, 408,
 &end
#
# 576 GLU QB 592 ILE HG12 3.76  (#peak 922 #SUP 0.53 #QF 0.53 )
 &rst
  ixpk= 922, nxpk= 0, iat=  -1, 643, r1= 1.30, r2= 1.80, r3= 4.22, r4= 4.72,
 igr1= 407, 408,
 &end
#
# 576 GLU QB 590 LYS HG2 4.56  (#peak 924 #SUP 0.77 #QF 0.77 )
 &rst
  ixpk= 924, nxpk= 0, iat=  -1, 603, r1= 1.30, r2= 1.80, r3= 5.12, r4= 5.62,
 igr1= 407, 408,
 &end
#
# 600 VAL H 600 VAL HB 3.62  (#peak 931 #SUP 0.85 #QF 0.85 )
 &rst
  ixpk= 931, nxpk= 0, iat= 763, 765, r1= 1.30, r2= 1.80, r3= 3.62, r4= 4.12,  &end
#
# 576 GLU QG 577 VAL H 4.46  (#peak 932 #SUP 0.95 #QF 0.95 )
 &rst
  ixpk= 932, nxpk= 0, iat=  -1, 418, r1= 1.30, r2= 1.80, r3= 5.01, r4= 5.51,
 igr1= 409, 410,
 &end
#
# 562 CYS H 576 GLU QG 4.76  (#peak 933 #SUP 0.99 #QF 0.64 )
 &rst
  ixpk= 933, nxpk= 0, iat= 159,  -1, r1= 1.30, r2= 1.80, r3= 5.34, r4= 5.84,
 igr2= 409, 410,
 &end
#
# 576 GLU H 576 GLU QG 3.94  (#peak 934 #SUP 0.92 #QF 0.92 )
 &rst
  ixpk= 934, nxpk= 0, iat= 405,  -1, r1= 1.30, r2= 1.80, r3= 4.42, r4= 4.92,
 igr2= 409, 410,
 &end
#
# 576 GLU HA 576 GLU QG 3.24  (#peak 935 #SUP 0.91 #QF 0.91 )
 &rst
  ixpk= 935, nxpk= 0, iat= 406,  -1, r1= 1.30, r2= 1.80, r3= 3.64, r4= 4.14,
 igr2= 409, 410,
 &end
#
# 576 GLU QB 576 GLU QG 2.47  (#peak 941 #SUP 0.86 #QF 0.86 )
 &rst
  ixpk= 941, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 3.11, r4= 3.61,
 igr1= 407, 408,
 igr2= 409, 410,
 &end
#
# 576 GLU QG 592 ILE HG13 4.58  (#peak 942 #SUP 0.83 #QF 0.83 )
 &rst
  ixpk= 942, nxpk= 0, iat=  -1, 644, r1= 1.30, r2= 1.80, r3= 5.14, r4= 5.64,
 igr1= 409, 410,
 &end
#
# 576 GLU QG 592 ILE QG2 3.07  (#peak 944 #SUP 0.57 #QF 0.57 )
 &rst
  ixpk= 944, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.14, r4= 4.64,
 igr1= 409, 410,
 igr2= 645, 646, 647,
 &end
#
# 600 VAL HB 605 ILE QD1 4.11  (#peak 946 #SUP 0.98 #QF 0.98 )
 &rst
  ixpk= 946, nxpk= 0, iat= 765,  -1, r1= 1.30, r2= 1.80, r3= 4.94, r4= 5.44,
 igr2= 851, 852, 853,
 &end
#
# 607 PRO HB2 608 ILE HA 4.62  (#peak 959 #SUP 0.59 #QF 0.59 )
 &rst
  ixpk= 959, nxpk= 0, iat= 884, 899, r1= 1.30, r2= 1.80, r3= 4.62, r4= 5.12,  &end
#
# 585 MET H 585 MET QG 4.49  (#peak 963 #SUP 0.98 #QF 0.98 )
 &rst
  ixpk= 963, nxpk= 0, iat= 525,  -1, r1= 1.30, r2= 1.80, r3= 5.04, r4= 5.54,
 igr2= 529, 530,
 &end
#
# 585 MET HA 585 MET QG 3.69  (#peak 964 #SUP 0.95 #QF 0.95 )
 &rst
  ixpk= 964, nxpk= 0, iat= 526,  -1, r1= 1.30, r2= 1.80, r3= 4.14, r4= 4.64,
 igr2= 529, 530,
 &end
#
# 585 MET QG 586 THR HB 5.30  (#peak 965 #SUP 0.98 #QF 0.98 )
 &rst
  ixpk= 965, nxpk= 0, iat=  -1, 543, r1= 1.30, r2= 1.80, r3= 5.95, r4= 6.45,
 igr1= 529, 530,
 &end
#
# 585 MET QG 585 MET QE 3.35  (#peak 968 #SUP 1.00 #QF 0.61 )
 &rst
  ixpk= 968, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.52, r4= 5.02,
 igr1= 529, 530,
 igr2= 531, 532, 533,
 &end
#
# 556 TRP HB2 602 LEU QQD 3.93  (#peak 972 #SUP 0.38 #QF 0.38 )
 &rst
  ixpk= 972, nxpk= 0, iat=  75, 796, r1= 1.30, r2= 1.80, r3= 6.13, r4= 6.63,  &end
#
# 559 GLY HA2 560 ASP QB 4.81  (#peak 986 #SUP 0.62 #QF 0.62 )
 &rst
  ixpk= 986, nxpk= 0, iat= 124,  -1, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr2= 136, 137,
 &end
#
# 556 TRP HD1 580 LEU QB 4.60  (#peak 1008 #SUP 0.64 #QF 0.49 )
 &rst
  ixpk= 1008, nxpk= 0, iat=  77,  -1, r1= 1.30, r2= 1.80, r3= 5.16, r4= 5.66,
 igr2= 462, 463,
 &end
#
# 565 LEU HB2 605 ILE H 5.22  (#peak 1013 #SUP 0.74 #QF 0.74 )
 &rst
  ixpk= 1013, nxpk= 0, iat= 204, 843, r1= 1.30, r2= 1.80, r3= 5.22, r4= 5.72,  &end
#
# 608 ILE QG1 609 LEU QB 5.29  (#peak 1023 #SUP 0.76 #QF 0.76 )
 &rst
  ixpk= 1023, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.66, r4= 7.16,
 igr1= 901, 902,
 igr2= 919, 920,
 &end
#
# 595 GLY HA2 596 ASN HA 4.54  (#peak 1048 #SUP 0.35 #QF 0.35 )
 &rst
  ixpk= 1048, nxpk= 0, iat= 689, 700, r1= 1.30, r2= 1.80, r3= 4.54, r4= 5.04,  &end
#
# 595 GLY HA3 596 ASN HA 4.63  (#peak 1057 #SUP 0.76 #QF 0.76 )
 &rst
  ixpk= 1057, nxpk= 0, iat= 690, 700, r1= 1.30, r2= 1.80, r3= 4.63, r4= 5.13,  &end
#
# 590 LYS HG2 595 GLY HA3 5.50  (#peak 1062 #SUP 0.90 #QF 0.90 )
 &rst
  ixpk= 1062, nxpk= 0, iat= 603, 690, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
# 559 GLY HA2 576 GLU QB 5.10  (#peak 1071 #SUP 0.37 #QF 0.37 )
 &rst
  ixpk= 1071, nxpk= 0, iat= 124,  -1, r1= 1.30, r2= 1.80, r3= 5.72, r4= 6.22,
 igr2= 407, 408,
 &end
#
# 558 PRO HB2 559 GLY HA2 5.08  (#peak 1072 #SUP 0.73 #QF 0.28 )
 &rst
  ixpk= 1072, nxpk= 0, iat= 113, 124, r1= 1.30, r2= 1.80, r3= 5.08, r4= 5.58,  &end
#
# 559 GLY HA2 577 VAL HB 5.31  (#peak 1072 #SUP 0.73 #QF 0.28 )
 &rst
  ixpk= 1072, nxpk= 0, iat= 124, 420, r1= 1.30, r2= 1.80, r3= 5.31, r4= 5.81,  &end
#
# 556 TRP HD1 602 LEU HA 4.16  (#peak 1076 #SUP 1.00 #QF 0.76 )
 &rst
  ixpk= 1076, nxpk= 0, iat=  77, 800, r1= 1.30, r2= 1.80, r3= 4.16, r4= 4.66,  &end
#
# 601 LEU HA 602 LEU HA 4.40  (#peak 1078 #SUP 0.94 #QF 0.94 )
 &rst
  ixpk= 1078, nxpk= 0, iat= 781, 800, r1= 1.30, r2= 1.80, r3= 4.40, r4= 4.90,  &end
#
# 602 LEU HA 602 LEU QB 2.95  (#peak 1080 #SUP 1.00   )
 &rst
  ixpk= 1080, nxpk= 0, iat= 800,  -1, r1= 1.30, r2= 1.80, r3= 3.31, r4= 3.81,
 igr2= 801, 802,
 &end
#
# 602 LEU HA 602 LEU HG 3.52  (#peak 1081 #SUP 0.82 #QF 0.82 )
 &rst
  ixpk= 1081, nxpk= 0, iat= 800, 803, r1= 1.30, r2= 1.80, r3= 3.52, r4= 4.02,  &end
#
# 587 ALA QB 602 LEU HA 4.13  (#peak 1082 #SUP 0.92 #QF 0.92 )
 &rst
  ixpk= 1082, nxpk= 0, iat=  -1, 800, r1= 1.30, r2= 1.80, r3= 4.96, r4= 5.46,
 igr1= 555, 556, 557,
 &end
#
# 602 LEU HA 605 ILE QG2 4.85  (#peak 1084 #SUP 0.99 #QF 0.99 )
 &rst
  ixpk= 1084, nxpk= 0, iat= 800,  -1, r1= 1.30, r2= 1.80, r3= 5.82, r4= 6.32,
 igr2= 848, 849, 850,
 &end
#
# 602 LEU HA 605 ILE QD1 3.35  (#peak 1085 #SUP 1.00   )
 &rst
  ixpk= 1085, nxpk= 0, iat= 800,  -1, r1= 1.30, r2= 1.80, r3= 4.02, r4= 4.52,
 igr2= 851, 852, 853,
 &end
#
# 567 TRP HA 570 ASN H 4.12  (#peak 1087 #SUP 0.70 #QF 0.70 )
 &rst
  ixpk= 1087, nxpk= 0, iat= 249, 293, r1= 1.30, r2= 1.80, r3= 4.12, r4= 4.62,  &end
#
# 566 TYR HA 567 TRP HA 5.11  (#peak 1089 #SUP 1.00 #QF 0.98 )
 &rst
  ixpk= 1089, nxpk= 0, iat= 226, 249, r1= 1.30, r2= 1.80, r3= 5.11, r4= 5.61,  &end
#
# 586 THR HA 587 ALA HA 5.47  (#peak 1089 #SUP 1.00 #QF 0.98 )
 &rst
  ixpk= 1089, nxpk= 0, iat= 542, 554, r1= 1.30, r2= 1.80, r3= 5.47, r4= 5.97,  &end
#
# 567 TRP HA 567 TRP HB2 2.88  (#peak 1093     )
 &rst
  ixpk= 1093, nxpk= 0, iat= 249, 250, r1= 1.30, r2= 1.80, r3= 2.88, r4= 3.38,  &end
#
# 567 TRP HA 567 TRP HB3 2.94  (#peak 1094     )
 &rst
  ixpk= 1094, nxpk= 0, iat= 249, 251, r1= 1.30, r2= 1.80, r3= 2.94, r4= 3.44,  &end
#
# 567 TRP HA 568 GLU HA 5.00  (#peak 1095 #SUP 0.96 #QF 0.96 )
 &rst
  ixpk= 1095, nxpk= 0, iat= 249, 268, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50,  &end
#
# 586 THR HA 601 LEU QQD 4.25  (#peak 1096 #SUP 0.24 #QF 0.24 )
 &rst
  ixpk= 1096, nxpk= 0, iat= 542, 777, r1= 1.30, r2= 1.80, r3= 6.45, r4= 6.95,  &end
#
# 565 LEU HG 567 TRP HA 4.90  (#peak 1097 #SUP 0.68 #QF 0.68 )
 &rst
  ixpk= 1097, nxpk= 0, iat= 206, 249, r1= 1.30, r2= 1.80, r3= 4.90, r4= 5.40,  &end
#
# 562 CYS H 574 ARG HA 5.27  (#peak 1109 #SUP 0.62 #QF 0.62 )
 &rst
  ixpk= 1109, nxpk= 0, iat= 159, 374, r1= 1.30, r2= 1.80, r3= 5.27, r4= 5.77,  &end
#
# 565 LEU HB2 605 ILE HA 4.51  (#peak 1136 #SUP 0.72 #QF 0.72 )
 &rst
  ixpk= 1136, nxpk= 0, iat= 204, 844, r1= 1.30, r2= 1.80, r3= 4.51, r4= 5.01,  &end
#
# 607 PRO HA 608 ILE HA 4.53  (#peak 1150 #SUP 0.90 #QF 0.90 )
 &rst
  ixpk= 1150, nxpk= 0, iat= 883, 899, r1= 1.30, r2= 1.80, r3= 4.53, r4= 5.03,  &end
#
# 607 PRO HA 608 ILE HB 4.54  (#peak 1153 #SUP 0.67 #QF 0.67 )
 &rst
  ixpk= 1153, nxpk= 0, iat= 883, 900, r1= 1.30, r2= 1.80, r3= 4.54, r4= 5.04,  &end
#
# 597 TYR HA 598 GLU H 3.03  (#peak 1157 #SUP 0.98 #QF 0.98 )
 &rst
  ixpk= 1157, nxpk= 0, iat= 718, 735, r1= 1.30, r2= 1.80, r3= 3.03, r4= 3.53,  &end
#
# 596 ASN HA 597 TYR HA 4.59  (#peak 1161 #SUP 0.86 #QF 0.86 )
 &rst
  ixpk= 1161, nxpk= 0, iat= 700, 718, r1= 1.30, r2= 1.80, r3= 4.59, r4= 5.09,  &end
#
# 590 LYS HA 597 TYR HA 3.31  (#peak 1162 #SUP 1.00   )
 &rst
  ixpk= 1162, nxpk= 0, iat= 600, 718, r1= 1.30, r2= 1.80, r3= 3.31, r4= 3.81,  &end
#
# 588 VAL QG1 597 TYR HA 4.22  (#peak 1165 #SUP 0.86 #QF 0.86 )
 &rst
  ixpk= 1165, nxpk= 0, iat=  -1, 718, r1= 1.30, r2= 1.80, r3= 5.07, r4= 5.57,
 igr1= 568, 569, 570,
 &end
#
# 563 PHE HA 573 TYR H 4.75  (#peak 1168 #SUP 0.65 #QF 0.65 )
 &rst
  ixpk= 1168, nxpk= 0, iat= 176, 353, r1= 1.30, r2= 1.80, r3= 4.75, r4= 5.25,  &end
#
# 563 PHE HA 564 ALA QB 4.22  (#peak 1174 #SUP 0.65 #QF 0.65 )
 &rst
  ixpk= 1174, nxpk= 0, iat= 176,  -1, r1= 1.30, r2= 1.80, r3= 5.07, r4= 5.57,
 igr2= 191, 192, 193,
 &end
#
# 563 PHE HA 575 ALA QB 4.46  (#peak 1175 #SUP 0.44 #QF 0.44 )
 &rst
  ixpk= 1175, nxpk= 0, iat= 176,  -1, r1= 1.30, r2= 1.80, r3= 5.36, r4= 5.86,
 igr2= 393, 394, 395,
 &end
#
# 578 GLU H 589 VAL HA 3.32  (#peak 1177 #SUP 0.88 #QF 0.88 )
 &rst
  ixpk= 1177, nxpk= 0, iat= 436, 582, r1= 1.30, r2= 1.80, r3= 3.32, r4= 3.82,  &end
#
# 588 VAL HB 589 VAL HA 4.52  (#peak 1181 #SUP 0.50 #QF 0.50 )
 &rst
  ixpk= 1181, nxpk= 0, iat= 567, 582, r1= 1.30, r2= 1.80, r3= 4.52, r4= 5.02,  &end
#
# 577 VAL QG2 589 VAL HA 3.86  (#peak 1183 #SUP 0.47 #QF 0.47 )
 &rst
  ixpk= 1183, nxpk= 0, iat=  -1, 582, r1= 1.30, r2= 1.80, r3= 4.64, r4= 5.14,
 igr1= 424, 425, 426,
 &end
#
# 589 VAL HA 589 VAL QG2 3.94  (#peak 1185 #SUP 0.58 #QF 0.58 )
 &rst
  ixpk= 1185, nxpk= 0, iat= 582,  -1, r1= 1.30, r2= 1.80, r3= 4.73, r4= 5.23,
 igr2= 587, 588, 589,
 &end
#
# 573 TYR HA 574 ARG H 3.12  (#peak 1186 #SUP 0.97 #QF 0.97 )
 &rst
  ixpk= 1186, nxpk= 0, iat= 354, 373, r1= 1.30, r2= 1.80, r3= 3.12, r4= 3.62,  &end
#
# 563 PHE QD 573 TYR HA 4.28  (#peak 1190 #SUP 0.85 #QF 0.62 )
 &rst
  ixpk= 1190, nxpk= 0, iat=  -1, 354, r1= 1.30, r2= 1.80, r3= 4.80, r4= 5.30,
 igr1= 179, 180,
 &end
#
# 563 PHE QE 573 TYR HA 4.72  (#peak 1190 #SUP 0.85 #QF 0.62 )
 &rst
  ixpk= 1190, nxpk= 0, iat=  -1, 354, r1= 1.30, r2= 1.80, r3= 5.30, r4= 5.80,
 igr1= 181, 182,
 &end
#
# 573 TYR HA 574 ARG HA 4.54  (#peak 1194 #SUP 0.87 #QF 0.87 )
 &rst
  ixpk= 1194, nxpk= 0, iat= 354, 374, r1= 1.30, r2= 1.80, r3= 4.54, r4= 5.04,  &end
#
# 573 TYR HA 574 ARG QB 4.64  (#peak 1197 #SUP 0.42 #QF 0.42 )
 &rst
  ixpk= 1197, nxpk= 0, iat= 354,  -1, r1= 1.30, r2= 1.80, r3= 5.21, r4= 5.71,
 igr2= 375, 376,
 &end
#
# 586 THR HB 587 ALA H 3.18  (#peak 1202 #SUP 0.99 #QF 0.99 )
 &rst
  ixpk= 1202, nxpk= 0, iat= 543, 553, r1= 1.30, r2= 1.80, r3= 3.18, r4= 3.68,  &end
#
# 586 THR HB 599 GLU HA 3.62  (#peak 1203 #SUP 0.68 #QF 0.68 )
 &rst
  ixpk= 1203, nxpk= 0, iat= 543, 751, r1= 1.30, r2= 1.80, r3= 3.62, r4= 4.12,  &end
#
# 586 THR HB 599 GLU QG 3.68  (#peak 1207 #SUP 0.94 #QF 0.94 )
 &rst
  ixpk= 1207, nxpk= 0, iat= 543,  -1, r1= 1.30, r2= 1.80, r3= 4.13, r4= 4.63,
 igr2= 754, 755,
 &end
#
# 586 THR HB 599 GLU QB 3.40  (#peak 1208 #SUP 0.56 #QF 0.56 )
 &rst
  ixpk= 1208, nxpk= 0, iat= 543,  -1, r1= 1.30, r2= 1.80, r3= 3.82, r4= 4.32,
 igr2= 752, 753,
 &end
#
# 592 ILE HA 592 ILE HG13 3.75  (#peak 1218 #SUP 1.00   )
 &rst
  ixpk= 1218, nxpk= 0, iat= 641, 644, r1= 1.30, r2= 1.80, r3= 3.75, r4= 4.25,  &end
#
# 592 ILE HA 592 ILE HG12 3.77  (#peak 1219 #SUP 0.98 #QF 0.98 )
 &rst
  ixpk= 1219, nxpk= 0, iat= 641, 643, r1= 1.30, r2= 1.80, r3= 3.77, r4= 4.27,  &end
#
# 590 LYS HG2 592 ILE HA 4.42  (#peak 1221 #SUP 0.33 #QF 0.33 )
 &rst
  ixpk= 1221, nxpk= 0, iat= 603, 641, r1= 1.30, r2= 1.80, r3= 4.42, r4= 4.92,  &end
#
# 577 VAL HA 578 GLU H 3.07  (#peak 1222 #SUP 0.78 #QF 0.78 )
 &rst
  ixpk= 1222, nxpk= 0, iat= 419, 436, r1= 1.30, r2= 1.80, r3= 3.07, r4= 3.57,  &end
#
# 577 VAL HA 579 ALA H 4.26  (#peak 1225 #SUP 0.64 #QF 0.64 )
 &rst
  ixpk= 1225, nxpk= 0, iat= 419, 447, r1= 1.30, r2= 1.80, r3= 4.26, r4= 4.76,  &end
#
# 577 VAL HA 589 VAL HA 3.36  (#peak 1226 #SUP 0.65 #QF 0.65 )
 &rst
  ixpk= 1226, nxpk= 0, iat= 419, 582, r1= 1.30, r2= 1.80, r3= 3.36, r4= 3.86,  &end
#
# 577 VAL HA 578 GLU HA 4.47  (#peak 1227 #SUP 0.71 #QF 0.71 )
 &rst
  ixpk= 1227, nxpk= 0, iat= 419, 437, r1= 1.30, r2= 1.80, r3= 4.47, r4= 4.97,  &end
#
# 577 VAL HA 589 VAL HB 4.31  (#peak 1231 #SUP 0.66 #QF 0.66 )
 &rst
  ixpk= 1231, nxpk= 0, iat= 419, 583, r1= 1.30, r2= 1.80, r3= 4.31, r4= 4.81,  &end
#
# 577 VAL HA 587 ALA QB 5.18  (#peak 1232 #SUP 0.55 #QF 0.55 )
 &rst
  ixpk= 1232, nxpk= 0, iat= 419,  -1, r1= 1.30, r2= 1.80, r3= 6.22, r4= 6.72,
 igr2= 555, 556, 557,
 &end
#
# 558 PRO HA 559 GLY H 2.91  (#peak 1240 #SUP 0.88 #QF 0.88 )
 &rst
  ixpk= 1240, nxpk= 0, iat= 112, 123, r1= 1.30, r2= 1.80, r3= 2.91, r4= 3.41,  &end
#
# 558 PRO HA 560 ASP H 4.14  (#peak 1241 #SUP 0.95 #QF 0.95 )
 &rst
  ixpk= 1241, nxpk= 0, iat= 112, 134, r1= 1.30, r2= 1.80, r3= 4.14, r4= 4.64,  &end
#
# 558 PRO HA 578 GLU HA 4.19  (#peak 1242 #SUP 0.94 #QF 0.94 )
 &rst
  ixpk= 1242, nxpk= 0, iat= 112, 437, r1= 1.30, r2= 1.80, r3= 4.19, r4= 4.69,  &end
#
# 558 PRO HA 580 LEU HG 3.65  (#peak 1245 #SUP 0.60 #QF 0.60 )
 &rst
  ixpk= 1245, nxpk= 0, iat= 112, 464, r1= 1.30, r2= 1.80, r3= 3.65, r4= 4.15,  &end
#
# 594 TYR HA 594 TYR QD 4.52  (#peak 1310 #SUP 0.46 #QF 0.46 )
 &rst
  ixpk= 1310, nxpk= 0, iat= 676,  -1, r1= 1.30, r2= 1.80, r3= 5.07, r4= 5.57,
 igr2= 679, 680,
 &end
#
# 591 PHE HA 594 TYR QD 4.45  (#peak 1311 #SUP 0.72 #QF 0.72 )
 &rst
  ixpk= 1311, nxpk= 0, iat= 624,  -1, r1= 1.30, r2= 1.80, r3= 4.99, r4= 5.49,
 igr2= 679, 680,
 &end
#
# 567 TRP HH2 568 GLU HB3 5.50  (#peak 1318 #SUP 0.71 #QF 0.71 )
 &rst
  ixpk= 1318, nxpk= 0, iat= 257, 270, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
# 565 LEU H 565 LEU QD2 4.77  (#peak 1329 #SUP 1.00 #QF 0.97 )
 &rst
  ixpk= 1329, nxpk= 0, iat= 202,  -1, r1= 1.30, r2= 1.80, r3= 5.73, r4= 6.23,
 igr2= 210, 211, 212,
 &end
#
# 565 LEU HB2 565 LEU QD1 4.03  (#peak 1338 #SUP 1.00   )
 &rst
  ixpk= 1338, nxpk= 0, iat= 204,  -1, r1= 1.30, r2= 1.80, r3= 4.84, r4= 5.34,
 igr2= 207, 208, 209,
 &end
#
# 565 LEU HB2 565 LEU QD2 4.03  (#peak 1338 #SUP 1.00   )
 &rst
  ixpk= 1338, nxpk= 0, iat= 204,  -1, r1= 1.30, r2= 1.80, r3= 4.84, r4= 5.34,
 igr2= 210, 211, 212,
 &end
#
# 565 LEU QD1 600 VAL QQG 5.48  (#peak 1339 #SUP 0.98 #QF 0.57 )
 &rst
  ixpk= 1339, nxpk= 0, iat=  -1, 760, r1= 1.30, r2= 1.80, r3= 8.78, r4= 9.28,
 igr1= 207, 208, 209,
 &end
#
# 565 LEU QD2 600 VAL QQG 5.48  (#peak 1339 #SUP 0.98 #QF 0.57 )
 &rst
  ixpk= 1339, nxpk= 0, iat=  -1, 760, r1= 1.30, r2= 1.80, r3= 8.78, r4= 9.28,
 igr1= 210, 211, 212,
 &end
#
# 556 TRP HZ2 605 ILE QD1 4.78  (#peak 1346 #SUP 0.97 #QF 0.97 )
 &rst
  ixpk= 1346, nxpk= 0, iat=  80,  -1, r1= 1.30, r2= 1.80, r3= 5.74, r4= 6.24,
 igr2= 851, 852, 853,
 &end
#
# 605 ILE HA 605 ILE QD1 4.04  (#peak 1347 #SUP 0.99 #QF 0.99 )
 &rst
  ixpk= 1347, nxpk= 0, iat= 844,  -1, r1= 1.30, r2= 1.80, r3= 4.85, r4= 5.35,
 igr2= 851, 852, 853,
 &end
#
# 602 LEU QB 605 ILE QD1 4.12  (#peak 1350 #SUP 0.95 #QF 0.95 )
 &rst
  ixpk= 1350, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.55, r4= 6.05,
 igr1= 801, 802,
 igr2= 851, 852, 853,
 &end
#
# 587 ALA QB 605 ILE QD1 2.97  (#peak 1352 #SUP 0.97 #QF 0.97 )
 &rst
  ixpk= 1352, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.28, r4= 4.78,
 igr1= 555, 556, 557,
 igr2= 851, 852, 853,
 &end
#
# 578 GLU H 579 ALA QB 4.49  (#peak 1361 #SUP 1.00   )
 &rst
  ixpk= 1361, nxpk= 0, iat= 436,  -1, r1= 1.30, r2= 1.80, r3= 5.39, r4= 5.89,
 igr2= 449, 450, 451,
 &end
#
# 579 ALA QB 580 LEU H 3.41  (#peak 1363 #SUP 0.98 #QF 0.98 )
 &rst
  ixpk= 1363, nxpk= 0, iat=  -1, 460, r1= 1.30, r2= 1.80, r3= 4.10, r4= 4.60,
 igr1= 449, 450, 451,
 &end
#
# 579 ALA QB 588 VAL H 3.74  (#peak 1364 #SUP 1.00   )
 &rst
  ixpk= 1364, nxpk= 0, iat=  -1, 565, r1= 1.30, r2= 1.80, r3= 4.49, r4= 4.99,
 igr1= 449, 450, 451,
 &end
#
# 579 ALA QB 581 HIS H 5.11  (#peak 1365 #SUP 0.63 #QF 0.63 )
 &rst
  ixpk= 1365, nxpk= 0, iat=  -1, 481, r1= 1.30, r2= 1.80, r3= 6.14, r4= 6.64,
 igr1= 449, 450, 451,
 &end
#
# 579 ALA H 579 ALA QB 3.08  (#peak 1366 #SUP 1.00   )
 &rst
  ixpk= 1366, nxpk= 0, iat= 447,  -1, r1= 1.30, r2= 1.80, r3= 3.70, r4= 4.20,
 igr2= 449, 450, 451,
 &end
#
# 579 ALA QB 587 ALA HA 5.23  (#peak 1367 #SUP 0.86 #QF 0.86 )
 &rst
  ixpk= 1367, nxpk= 0, iat=  -1, 554, r1= 1.30, r2= 1.80, r3= 6.28, r4= 6.78,
 igr1= 449, 450, 451,
 &end
#
# 579 ALA QB 588 VAL HB 2.74  (#peak 1372 #SUP 0.92 #QF 0.92 )
 &rst
  ixpk= 1372, nxpk= 0, iat=  -1, 567, r1= 1.30, r2= 1.80, r3= 3.29, r4= 3.79,
 igr1= 449, 450, 451,
 &end
#
# 579 ALA QB 588 VAL QG2 2.79  (#peak 1376 #SUP 0.96 #QF 0.96 )
 &rst
  ixpk= 1376, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.02, r4= 4.52,
 igr1= 449, 450, 451,
 igr2= 571, 572, 573,
 &end
#
# 587 ALA QB 600 VAL H 3.96  (#peak 1378 #SUP 0.68 #QF 0.68 )
 &rst
  ixpk= 1378, nxpk= 0, iat=  -1, 763, r1= 1.30, r2= 1.80, r3= 4.76, r4= 5.26,
 igr1= 555, 556, 557,
 &end
#
# 600 VAL H 600 VAL QQG 3.66  (#peak 1379 #SUP 0.99 #QF 0.99 )
 &rst
  ixpk= 1379, nxpk= 0, iat= 763, 760, r1= 1.30, r2= 1.80, r3= 5.86, r4= 6.36,  &end
#
# 587 ALA H 587 ALA QB 3.15  (#peak 1380 #SUP 1.00   )
 &rst
  ixpk= 1380, nxpk= 0, iat= 553,  -1, r1= 1.30, r2= 1.80, r3= 3.78, r4= 4.28,
 igr2= 555, 556, 557,
 &end
#
# 587 ALA QB 588 VAL H 2.98  (#peak 1381 #SUP 0.90 #QF 0.90 )
 &rst
  ixpk= 1381, nxpk= 0, iat=  -1, 565, r1= 1.30, r2= 1.80, r3= 3.58, r4= 4.08,
 igr1= 555, 556, 557,
 &end
#
# 600 VAL QQG 604 ASN H 4.16  (#peak 1382 #SUP 0.64 #QF 0.64 )
 &rst
  ixpk= 1382, nxpk= 0, iat= 760, 829, r1= 1.30, r2= 1.80, r3= 6.36, r4= 6.86,  &end
#
# 581 HIS H 587 ALA QB 4.29  (#peak 1383 #SUP 0.84 #QF 0.84 )
 &rst
  ixpk= 1383, nxpk= 0, iat= 481,  -1, r1= 1.30, r2= 1.80, r3= 5.15, r4= 5.65,
 igr2= 555, 556, 557,
 &end
#
# 565 LEU H 600 VAL QQG 3.61  (#peak 1384 #SUP 0.79 #QF 0.79 )
 &rst
  ixpk= 1384, nxpk= 0, iat= 202, 760, r1= 1.30, r2= 1.80, r3= 5.81, r4= 6.31,  &end
#
# 599 GLU HA 600 VAL QQG 3.86  (#peak 1386 #SUP 0.83 #QF 0.77 )
 &rst
  ixpk= 1386, nxpk= 0, iat= 751, 760, r1= 1.30, r2= 1.80, r3= 6.06, r4= 6.56,  &end
#
# 600 VAL QQG 605 ILE HA 4.25  (#peak 1386 #SUP 0.83 #QF 0.77 )
 &rst
  ixpk= 1386, nxpk= 0, iat= 760, 844, r1= 1.30, r2= 1.80, r3= 6.45, r4= 6.95,  &end
#
# 600 VAL HA 600 VAL QQG 3.07  (#peak 1389 #SUP 1.00   )
 &rst
  ixpk= 1389, nxpk= 0, iat= 764, 760, r1= 1.30, r2= 1.80, r3= 5.27, r4= 5.77,  &end
#
# 600 VAL QQG 601 LEU HA 4.60  (#peak 1390 #SUP 0.50 #QF 0.50 )
 &rst
  ixpk= 1390, nxpk= 0, iat= 760, 781, r1= 1.30, r2= 1.80, r3= 6.80, r4= 7.30,  &end
#
# 600 VAL QQG 604 ASN HB2 3.75  (#peak 1392 #SUP 0.98 #QF 0.98 )
 &rst
  ixpk= 1392, nxpk= 0, iat= 760, 831, r1= 1.30, r2= 1.80, r3= 5.95, r4= 6.45,  &end
#
# 600 VAL QQG 604 ASN HB3 3.75  (#peak 1393 #SUP 0.96 #QF 0.96 )
 &rst
  ixpk= 1393, nxpk= 0, iat= 760, 832, r1= 1.30, r2= 1.80, r3= 5.95, r4= 6.45,  &end
#
# 598 GLU QB 600 VAL QQG 4.37  (#peak 1394 #SUP 0.88 #QF 0.88 )
 &rst
  ixpk= 1394, nxpk= 0, iat=  -1, 760, r1= 1.30, r2= 1.80, r3= 7.11, r4= 7.61,
 igr1= 737, 738,
 &end
#
# 580 LEU QB 587 ALA QB 3.38  (#peak 1397 #SUP 0.77 #QF 0.33 )
 &rst
  ixpk= 1397, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.56, r4= 5.06,
 igr1= 462, 463,
 igr2= 555, 556, 557,
 &end
#
# 600 VAL QQG 605 ILE QG1 2.88  (#peak 1398 #SUP 0.34 #QF 0.34 )
 &rst
  ixpk= 1398, nxpk= 0, iat= 760,  -1, r1= 1.30, r2= 1.80, r3= 5.43, r4= 5.93,
 igr2= 846, 847,
 &end
#
# 587 ALA QB 605 ILE QG1 3.51  (#peak 1399 #SUP 0.88 #QF 0.88 )
 &rst
  ixpk= 1399, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.73, r4= 5.23,
 igr1= 555, 556, 557,
 igr2= 846, 847,
 &end
#
# 589 VAL QG2 600 VAL QQG 2.98  (#peak 1401 #SUP 0.75 #QF 0.75 )
 &rst
  ixpk= 1401, nxpk= 0, iat=  -1, 760, r1= 1.30, r2= 1.80, r3= 5.78, r4= 6.28,
 igr1= 587, 588, 589,
 &end
#
# 564 ALA H 564 ALA QB 3.10  (#peak 1412 #SUP 0.97 #QF 0.97 )
 &rst
  ixpk= 1412, nxpk= 0, iat= 189,  -1, r1= 1.30, r2= 1.80, r3= 3.72, r4= 4.22,
 igr2= 191, 192, 193,
 &end
#
# 563 PHE H 564 ALA QB 5.36  (#peak 1413 #SUP 0.84 #QF 0.84 )
 &rst
  ixpk= 1413, nxpk= 0, iat= 175,  -1, r1= 1.30, r2= 1.80, r3= 6.44, r4= 6.94,
 igr2= 191, 192, 193,
 &end
#
# 564 ALA QB 605 ILE HA 3.51  (#peak 1417 #SUP 0.99 #QF 0.99 )
 &rst
  ixpk= 1417, nxpk= 0, iat=  -1, 844, r1= 1.30, r2= 1.80, r3= 4.22, r4= 4.72,
 igr1= 191, 192, 193,
 &end
#
# 564 ALA QB 605 ILE QG2 3.15  (#peak 1418 #SUP 0.98 #QF 0.68 )
 &rst
  ixpk= 1418, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.54, r4= 5.04,
 igr1= 191, 192, 193,
 igr2= 848, 849, 850,
 &end
#
# 585 MET HA 601 LEU QQD 3.58  (#peak 1441 #SUP 0.90 #QF 0.90 )
 &rst
  ixpk= 1441, nxpk= 0, iat= 526, 777, r1= 1.30, r2= 1.80, r3= 5.78, r4= 6.28,  &end
#
# 585 MET QB 601 LEU QQD 4.08  (#peak 1444 #SUP 0.61 #QF 0.61 )
 &rst
  ixpk= 1444, nxpk= 0, iat=  -1, 777, r1= 1.30, r2= 1.80, r3= 6.78, r4= 7.28,
 igr1= 527, 528,
 &end
#
# 601 LEU QQD 602 LEU HG 3.55  (#peak 1445 #SUP 0.42 #QF 0.42 )
 &rst
  ixpk= 1445, nxpk= 0, iat= 777, 803, r1= 1.30, r2= 1.80, r3= 5.75, r4= 6.25,  &end
#
# 565 LEU H 565 LEU HG 4.73  (#peak 1462 #SUP 1.00   )
 &rst
  ixpk= 1462, nxpk= 0, iat= 202, 206, r1= 1.30, r2= 1.80, r3= 4.73, r4= 5.23,  &end
#
# 565 LEU HG 604 ASN HA 5.11  (#peak 1464 #SUP 0.99 #QF 0.99 )
 &rst
  ixpk= 1464, nxpk= 0, iat= 206, 830, r1= 1.30, r2= 1.80, r3= 5.11, r4= 5.61,  &end
#
# 565 LEU HG 570 ASN HA 3.70  (#peak 1465 #SUP 0.96 #QF 0.96 )
 &rst
  ixpk= 1465, nxpk= 0, iat= 206, 294, r1= 1.30, r2= 1.80, r3= 3.70, r4= 4.20,  &end
#
# 556 TRP HE1 602 LEU QQD 4.62  (#peak 1475 #SUP 0.76 #QF 0.76 )
 &rst
  ixpk= 1475, nxpk= 0, iat=  78, 796, r1= 1.30, r2= 1.80, r3= 6.82, r4= 7.32,  &end
#
# 587 ALA H 602 LEU QQD 4.16  (#peak 1476 #SUP 0.47 #QF 0.47 )
 &rst
  ixpk= 1476, nxpk= 0, iat= 553, 796, r1= 1.30, r2= 1.80, r3= 6.36, r4= 6.86,  &end
#
# 588 VAL H 602 LEU QQD 4.88  (#peak 1477 #SUP 0.51 #QF 0.51 )
 &rst
  ixpk= 1477, nxpk= 0, iat= 565, 796, r1= 1.30, r2= 1.80, r3= 7.08, r4= 7.58,  &end
#
# 602 LEU H 602 LEU QQD 3.75  (#peak 1478 #SUP 0.55 #QF 0.55 )
 &rst
  ixpk= 1478, nxpk= 0, iat= 799, 796, r1= 1.30, r2= 1.80, r3= 5.95, r4= 6.45,  &end
#
# 556 TRP H 602 LEU QQD 4.61  (#peak 1479 #SUP 0.72 #QF 0.44 )
 &rst
  ixpk= 1479, nxpk= 0, iat=  73, 796, r1= 1.30, r2= 1.80, r3= 6.81, r4= 7.31,  &end
#
# 556 TRP HD1 602 LEU QQD 3.23  (#peak 1480 #SUP 0.40 #QF 0.40 )
 &rst
  ixpk= 1480, nxpk= 0, iat=  77, 796, r1= 1.30, r2= 1.80, r3= 5.43, r4= 5.93,  &end
#
# 602 LEU HA 602 LEU QQD 2.87  (#peak 1483 #SUP 0.67 #QF 0.67 )
 &rst
  ixpk= 1483, nxpk= 0, iat= 800, 796, r1= 1.30, r2= 1.80, r3= 5.07, r4= 5.57,  &end
#
# 602 LEU QB 602 LEU QQD 2.83  (#peak 1484 #SUP 0.62 #QF 0.62 )
 &rst
  ixpk= 1484, nxpk= 0, iat=  -1, 796, r1= 1.30, r2= 1.80, r3= 5.38, r4= 5.88,
 igr1= 801, 802,
 &end
#
# 602 LEU QQD 605 ILE QD1 2.90  (#peak 1489 #SUP 0.64 #QF 0.64 )
 &rst
  ixpk= 1489, nxpk= 0, iat= 796,  -1, r1= 1.30, r2= 1.80, r3= 5.68, r4= 6.18,
 igr2= 851, 852, 853,
 &end
#
# 577 VAL QG2 578 GLU H 3.86  (#peak 1490 #SUP 0.99 #QF 0.99 )
 &rst
  ixpk= 1490, nxpk= 0, iat=  -1, 436, r1= 1.30, r2= 1.80, r3= 4.64, r4= 5.14,
 igr1= 424, 425, 426,
 &end
#
# 577 VAL H 577 VAL QG2 2.95  (#peak 1491 #SUP 0.97 #QF 0.97 )
 &rst
  ixpk= 1491, nxpk= 0, iat= 418,  -1, r1= 1.30, r2= 1.80, r3= 3.54, r4= 4.04,
 igr2= 424, 425, 426,
 &end
#
# 562 CYS H 577 VAL QG2 4.49  (#peak 1492 #SUP 0.53 #QF 0.53 )
 &rst
  ixpk= 1492, nxpk= 0, iat= 159,  -1, r1= 1.30, r2= 1.80, r3= 5.39, r4= 5.89,
 igr2= 424, 425, 426,
 &end
#
# 560 ASP H 577 VAL QG2 3.70  (#peak 1493 #SUP 0.98 #QF 0.98 )
 &rst
  ixpk= 1493, nxpk= 0, iat= 134,  -1, r1= 1.30, r2= 1.80, r3= 4.44, r4= 4.94,
 igr2= 424, 425, 426,
 &end
#
# 556 TRP HZ2 577 VAL QG2 5.01  (#peak 1494 #SUP 0.88 #QF 0.88 )
 &rst
  ixpk= 1494, nxpk= 0, iat=  80,  -1, r1= 1.30, r2= 1.80, r3= 6.02, r4= 6.52,
 igr2= 424, 425, 426,
 &end
#
# 576 GLU HA 577 VAL QG2 4.16  (#peak 1495 #SUP 0.61 #QF 0.61 )
 &rst
  ixpk= 1495, nxpk= 0, iat= 406,  -1, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50,
 igr2= 424, 425, 426,
 &end
#
# 560 ASP HA 577 VAL QG2 4.85  (#peak 1496 #SUP 0.93 #QF 0.93 )
 &rst
  ixpk= 1496, nxpk= 0, iat= 135,  -1, r1= 1.30, r2= 1.80, r3= 5.82, r4= 6.32,
 igr2= 424, 425, 426,
 &end
#
# 558 PRO HA 577 VAL QG2 4.45  (#peak 1497 #SUP 0.89 #QF 0.89 )
 &rst
  ixpk= 1497, nxpk= 0, iat= 112,  -1, r1= 1.30, r2= 1.80, r3= 5.34, r4= 5.84,
 igr2= 424, 425, 426,
 &end
#
# 577 VAL HA 577 VAL QG2 3.11  (#peak 1498 #SUP 1.00   )
 &rst
  ixpk= 1498, nxpk= 0, iat= 419,  -1, r1= 1.30, r2= 1.80, r3= 3.73, r4= 4.23,
 igr2= 424, 425, 426,
 &end
#
# 577 VAL QG2 587 ALA QB 4.03  (#peak 1502 #SUP 0.75 #QF 0.75 )
 &rst
  ixpk= 1502, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.81, r4= 6.31,
 igr1= 424, 425, 426,
 igr2= 555, 556, 557,
 &end
#
# 577 VAL QG2 605 ILE QG2 3.72  (#peak 1505 #SUP 0.85 #QF 0.85 )
 &rst
  ixpk= 1505, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.37, r4= 5.87,
 igr1= 424, 425, 426,
 igr2= 848, 849, 850,
 &end
#
# 577 VAL QG2 605 ILE QD1 3.37  (#peak 1506 #SUP 0.87 #QF 0.87 )
 &rst
  ixpk= 1506, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.86, r4= 5.36,
 igr1= 424, 425, 426,
 igr2= 851, 852, 853,
 &end
#
# 559 GLY H 577 VAL QG1 3.28  (#peak 1507 #SUP 1.00 #QF 0.92 )
 &rst
  ixpk= 1507, nxpk= 0, iat= 123,  -1, r1= 1.30, r2= 1.80, r3= 3.94, r4= 4.44,
 igr2= 421, 422, 423,
 &end
#
# 577 VAL QG1 578 GLU H 3.66  (#peak 1507 #SUP 1.00 #QF 0.92 )
 &rst
  ixpk= 1507, nxpk= 0, iat=  -1, 436, r1= 1.30, r2= 1.80, r3= 4.40, r4= 4.90,
 igr1= 421, 422, 423,
 &end
#
# 577 VAL QG1 580 LEU H 3.63  (#peak 1508 #SUP 0.89 #QF 0.89 )
 &rst
  ixpk= 1508, nxpk= 0, iat=  -1, 460, r1= 1.30, r2= 1.80, r3= 4.36, r4= 4.86,
 igr1= 421, 422, 423,
 &end
#
# 560 ASP H 577 VAL QG1 3.81  (#peak 1510 #SUP 1.00   )
 &rst
  ixpk= 1510, nxpk= 0, iat= 134,  -1, r1= 1.30, r2= 1.80, r3= 4.58, r4= 5.08,
 igr2= 421, 422, 423,
 &end
#
# 577 VAL QG1 579 ALA H 3.36  (#peak 1511 #SUP 0.98 #QF 0.98 )
 &rst
  ixpk= 1511, nxpk= 0, iat=  -1, 447, r1= 1.30, r2= 1.80, r3= 4.04, r4= 4.54,
 igr1= 421, 422, 423,
 &end
#
# 577 VAL QG1 589 VAL HA 4.20  (#peak 1512 #SUP 0.90 #QF 0.90 )
 &rst
  ixpk= 1512, nxpk= 0, iat=  -1, 582, r1= 1.30, r2= 1.80, r3= 5.04, r4= 5.54,
 igr1= 421, 422, 423,
 &end
#
# 560 ASP HA 577 VAL QG1 5.14  (#peak 1513 #SUP 0.92 #QF 0.78 )
 &rst
  ixpk= 1513, nxpk= 0, iat= 135,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2= 421, 422, 423,
 &end
#
# 577 VAL QG1 580 LEU HA 5.43  (#peak 1513 #SUP 0.92 #QF 0.78 )
 &rst
  ixpk= 1513, nxpk= 0, iat=  -1, 461, r1= 1.30, r2= 1.80, r3= 6.52, r4= 7.02,
 igr1= 421, 422, 423,
 &end
#
# 559 GLY HA3 577 VAL QG1 4.87  (#peak 1514 #SUP 1.00 #QF 0.53 )
 &rst
  ixpk= 1514, nxpk= 0, iat= 125,  -1, r1= 1.30, r2= 1.80, r3= 5.85, r4= 6.35,
 igr2= 421, 422, 423,
 &end
#
# 558 PRO HA 577 VAL QG1 3.23  (#peak 1515 #SUP 1.00   )
 &rst
  ixpk= 1515, nxpk= 0, iat= 112,  -1, r1= 1.30, r2= 1.80, r3= 3.88, r4= 4.38,
 igr2= 421, 422, 423,
 &end
#
# 577 VAL HA 577 VAL QG1 3.14  (#peak 1516 #SUP 1.00   )
 &rst
  ixpk= 1516, nxpk= 0, iat= 419,  -1, r1= 1.30, r2= 1.80, r3= 3.77, r4= 4.27,
 igr2= 421, 422, 423,
 &end
#
# 556 TRP HB3 577 VAL QG1 4.21  (#peak 1517 #SUP 0.89 #QF 0.89 )
 &rst
  ixpk= 1517, nxpk= 0, iat=  76,  -1, r1= 1.30, r2= 1.80, r3= 5.06, r4= 5.56,
 igr2= 421, 422, 423,
 &end
#
# 558 PRO HB3 577 VAL QG1 3.92  (#peak 1518 #SUP 0.87 #QF 0.87 )
 &rst
  ixpk= 1518, nxpk= 0, iat= 114,  -1, r1= 1.30, r2= 1.80, r3= 4.71, r4= 5.21,
 igr2= 421, 422, 423,
 &end
#
# 577 VAL QG1 579 ALA QB 4.58  (#peak 1520 #SUP 0.86 #QF 0.86 )
 &rst
  ixpk= 1520, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr1= 421, 422, 423,
 igr2= 449, 450, 451,
 &end
#
# 577 VAL QG1 605 ILE QD1 4.59  (#peak 1525 #SUP 0.98 #QF 0.98 )
 &rst
  ixpk= 1525, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.62, r4= 7.12,
 igr1= 421, 422, 423,
 igr2= 851, 852, 853,
 &end
#
# 575 ALA QB 590 LYS H 3.67  (#peak 1543 #SUP 0.68 #QF 0.68 )
 &rst
  ixpk= 1543, nxpk= 0, iat=  -1, 599, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,
 igr1= 393, 394, 395,
 &end
#
# 597 TYR HB3 598 GLU H 4.22  (#peak 1594 #SUP 0.97 #QF 0.97 )
 &rst
  ixpk= 1594, nxpk= 0, iat= 720, 735, r1= 1.30, r2= 1.80, r3= 4.22, r4= 4.72,  &end
#
# 597 TYR H 597 TYR HB3 4.06  (#peak 1595 #SUP 1.00   )
 &rst
  ixpk= 1595, nxpk= 0, iat= 717, 720, r1= 1.30, r2= 1.80, r3= 4.06, r4= 4.56,  &end
#
# 571 LYS QG 571 LYS QE 3.94  (#peak 1624     )
 &rst
  ixpk= 1624, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.96, r4= 5.46,
 igr1= 312, 313,
 igr2= 316, 317,
 &end
#
# 575 ALA HA 592 ILE QG2 4.60  (#peak 1628 #SUP 0.96 #QF 0.96 )
 &rst
  ixpk= 1628, nxpk= 0, iat= 392,  -1, r1= 1.30, r2= 1.80, r3= 5.52, r4= 6.02,
 igr2= 645, 646, 647,
 &end
#
# 608 ILE HA 609 LEU HA 4.67  (#peak 1630 #SUP 0.75 #QF 0.75 )
 &rst
  ixpk= 1630, nxpk= 0, iat= 899, 918, r1= 1.30, r2= 1.80, r3= 4.67, r4= 5.17,  &end
#
# 560 ASP HA 561 GLU QB 4.72  (#peak 1644 #SUP 0.38 #QF 0.38 )
 &rst
  ixpk= 1644, nxpk= 0, iat= 135,  -1, r1= 1.30, r2= 1.80, r3= 5.30, r4= 5.80,
 igr2= 149, 150,
 &end
#
# 592 ILE H 592 ILE HG13 3.86  (#peak 1665 #SUP 0.97 #QF 0.97 )
 &rst
  ixpk= 1665, nxpk= 0, iat= 640, 644, r1= 1.30, r2= 1.80, r3= 3.86, r4= 4.36,  &end
#
# 596 ASN H 596 ASN QB 4.09  (#peak 1697 #SUP 0.93 #QF 0.93 )
 &rst
  ixpk= 1697, nxpk= 0, iat= 699,  -1, r1= 1.30, r2= 1.80, r3= 4.59, r4= 5.09,
 igr2= 701, 702,
 &end
#
# 563 PHE HA 608 ILE QD1 4.62  (#peak 1702 #SUP 0.88 #QF 0.88 )
 &rst
  ixpk= 1702, nxpk= 0, iat= 176,  -1, r1= 1.30, r2= 1.80, r3= 5.55, r4= 6.05,
 igr2= 906, 907, 908,
 &end
#
# 561 GLU QG 608 ILE QG1 5.34  (#peak 1709 #SUP 0.87 #QF 0.51 )
 &rst
  ixpk= 1709, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.73, r4= 7.23,
 igr1= 151, 152,
 igr2= 901, 902,
 &end
#
# 574 ARG QB 592 ILE H 4.44  (#peak 1715 #SUP 0.31 #QF 0.31 )
 &rst
  ixpk= 1715, nxpk= 0, iat=  -1, 640, r1= 1.30, r2= 1.80, r3= 4.98, r4= 5.48,
 igr1= 375, 376,
 &end
#
# 574 ARG QB 575 ALA H 3.74  (#peak 1716 #SUP 0.36 #QF 0.36 )
 &rst
  ixpk= 1716, nxpk= 0, iat=  -1, 391, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
 igr1= 375, 376,
 &end
#
# 607 PRO HB2 609 LEU QB 5.50  (#peak 1727 #SUP 0.83 #QF 0.83 )
 &rst
  ixpk= 1727, nxpk= 0, iat= 884,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2= 919, 920,
 &end
#
# 607 PRO HB2 608 ILE QG1 5.50  (#peak 1728 #SUP 0.74 #QF 0.74 )
 &rst
  ixpk= 1728, nxpk= 0, iat= 884,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2= 901, 902,
 &end
#
# 585 MET QG 586 THR H 4.91  (#peak 1732 #SUP 0.97 #QF 0.97 )
 &rst
  ixpk= 1732, nxpk= 0, iat=  -1, 541, r1= 1.30, r2= 1.80, r3= 5.51, r4= 6.01,
 igr1= 529, 530,
 &end
#
# 558 PRO HA 580 LEU QB 5.00  (#peak 1744 #SUP 0.85 #QF 0.64 )
 &rst
  ixpk= 1744, nxpk= 0, iat= 112,  -1, r1= 1.30, r2= 1.80, r3= 5.61, r4= 6.11,
 igr2= 462, 463,
 &end
#
# 601 LEU QB 602 LEU HA 5.47  (#peak 1744 #SUP 0.85 #QF 0.64 )
 &rst
  ixpk= 1744, nxpk= 0, iat=  -1, 800, r1= 1.30, r2= 1.80, r3= 6.14, r4= 6.64,
 igr1= 782, 783,
 &end
#
# 590 LYS HE3 595 GLY HA2 5.31  (#peak 1753 #SUP 0.54 #QF 0.54 )
 &rst
  ixpk= 1753, nxpk= 0, iat= 608, 689, r1= 1.30, r2= 1.80, r3= 5.31, r4= 5.81,  &end
#
# 590 LYS HD2 595 GLY HA3 5.50  (#peak 1757 #SUP 0.55 #QF 0.55 )
 &rst
  ixpk= 1757, nxpk= 0, iat= 605, 690, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
# 586 THR HA 602 LEU HA 4.72  (#peak 1762 #SUP 0.28 #QF 0.28 )
 &rst
  ixpk= 1762, nxpk= 0, iat= 542, 800, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,  &end
#
# 567 TRP HA 569 ASP H 4.73  (#peak 1765 #SUP 0.95 #QF 0.95 )
 &rst
  ixpk= 1765, nxpk= 0, iat= 249, 281, r1= 1.30, r2= 1.80, r3= 4.73, r4= 5.23,  &end
#
# 566 TYR QD 567 TRP HA 5.24  (#peak 1766 #SUP 0.51 #QF 0.51 )
 &rst
  ixpk= 1766, nxpk= 0, iat=  -1, 249, r1= 1.30, r2= 1.80, r3= 5.88, r4= 6.38,
 igr1= 229, 230,
 &end
#
# 578 GLU QB 578 GLU QG 2.63  (#peak 1967     )
 &rst
  ixpk= 1967, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 3.31, r4= 3.81,
 igr1= 438, 439,
 igr2= 440, 441,
 &end
#
# 601 LEU QB 601 LEU QQD 2.49  (#peak 1973 #SUP 0.93 #QF 0.87 )
 &rst
  ixpk= 1973, nxpk= 0, iat=  -1, 777, r1= 1.30, r2= 1.80, r3= 4.99, r4= 5.49,
 igr1= 782, 783,
 &end
#
# 588 VAL QG1 597 TYR HB3 3.61  (#peak 1984 #SUP 0.54 #QF 0.54 )
 &rst
  ixpk= 1984, nxpk= 0, iat=  -1, 720, r1= 1.30, r2= 1.80, r3= 4.34, r4= 4.84,
 igr1= 568, 569, 570,
 &end
#
# 586 THR QG2 601 LEU HA 2.89  (#peak 1986 #SUP 0.41 #QF 0.41 )
 &rst
  ixpk= 1986, nxpk= 0, iat=  -1, 781, r1= 1.30, r2= 1.80, r3= 3.47, r4= 3.97,
 igr1= 545, 546, 547,
 &end
#
# 586 THR H 586 THR QG2 3.71  (#peak 1991 #SUP 0.78 #QF 0.78 )
 &rst
  ixpk= 1991, nxpk= 0, iat= 541,  -1, r1= 1.30, r2= 1.80, r3= 4.46, r4= 4.96,
 igr2= 545, 546, 547,
 &end
#
# 586 THR QG2 602 LEU H 4.42  (#peak 1992 #SUP 0.82 #QF 0.82 )
 &rst
  ixpk= 1992, nxpk= 0, iat=  -1, 799, r1= 1.30, r2= 1.80, r3= 5.31, r4= 5.81,
 igr1= 545, 546, 547,
 &end
#
# 586 THR QG2 587 ALA H 3.72  (#peak 1993 #SUP 0.98 #QF 0.98 )
 &rst
  ixpk= 1993, nxpk= 0, iat=  -1, 553, r1= 1.30, r2= 1.80, r3= 4.47, r4= 4.97,
 igr1= 545, 546, 547,
 &end
#
# 586 THR QG2 600 VAL H 4.06  (#peak 1994 #SUP 0.72 #QF 0.72 )
 &rst
  ixpk= 1994, nxpk= 0, iat=  -1, 763, r1= 1.30, r2= 1.80, r3= 4.88, r4= 5.38,
 igr1= 545, 546, 547,
 &end
#
# 585 MET QE 586 THR QG2 2.98  (#peak 1995 #SUP 0.47 #QF 0.47 )
 &rst
  ixpk= 1995, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.30, r4= 4.80,
 igr1= 531, 532, 533,
 igr2= 545, 546, 547,
 &end
#
# 577 VAL QG1 588 VAL HB 5.38  (#peak 2006 #SUP 0.58 #QF 0.58 )
 &rst
  ixpk= 2006, nxpk= 0, iat=  -1, 567, r1= 1.30, r2= 1.80, r3= 6.46, r4= 6.96,
 igr1= 421, 422, 423,
 &end
#
# 574 ARG H 574 ARG QB 3.34  (#peak 2017 #SUP 0.32 #QF 0.32 )
 &rst
  ixpk= 2017, nxpk= 0, iat= 373,  -1, r1= 1.30, r2= 1.80, r3= 3.75, r4= 4.25,
 igr2= 375, 376,
 &end
#
# 586 THR QG2 599 GLU QB 3.78  (#peak 2028 #SUP 0.54 #QF 0.38 )
 &rst
  ixpk= 2028, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.10, r4= 5.60,
 igr1= 545, 546, 547,
 igr2= 752, 753,
 &end
#
# 599 GLU QB 600 VAL QQG 4.65  (#peak 2029 #SUP 0.31 #QF 0.31 )
 &rst
  ixpk= 2029, nxpk= 0, iat=  -1, 760, r1= 1.30, r2= 1.80, r3= 7.42, r4= 7.92,
 igr1= 752, 753,
 &end
#
# 586 THR HA 599 GLU QB 4.78  (#peak 2031 #SUP 0.32 #QF 0.32 )
 &rst
  ixpk= 2031, nxpk= 0, iat= 542,  -1, r1= 1.30, r2= 1.80, r3= 5.37, r4= 5.87,
 igr2= 752, 753,
 &end
#
# 599 GLU QB 599 GLU QG 2.65  (#peak 2034     )
 &rst
  ixpk= 2034, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 3.34, r4= 3.84,
 igr1= 752, 753,
 igr2= 754, 755,
 &end
#
# 565 LEU HB3 566 TYR HA 5.30  (#peak 2061 #SUP 0.84 #QF 0.84 )
 &rst
  ixpk= 2061, nxpk= 0, iat= 205, 226, r1= 1.30, r2= 1.80, r3= 5.30, r4= 5.80,  &end
#
# 565 LEU HB2 604 ASN HA 4.88  (#peak 2062 #SUP 0.88 #QF 0.88 )
 &rst
  ixpk= 2062, nxpk= 0, iat= 204, 830, r1= 1.30, r2= 1.80, r3= 4.88, r4= 5.38,  &end
#
# 585 MET HA 585 MET QB 3.01  (#peak 2076 #SUP 0.78 #QF 0.78 )
 &rst
  ixpk= 2076, nxpk= 0, iat= 526,  -1, r1= 1.30, r2= 1.80, r3= 3.38, r4= 3.88,
 igr2= 527, 528,
 &end
#
# 602 LEU QB 602 LEU HG 2.97  (#peak 2082 #SUP 0.98 #QF 0.98 )
 &rst
  ixpk= 2082, nxpk= 0, iat=  -1, 803, r1= 1.30, r2= 1.80, r3= 3.33, r4= 3.83,
 igr1= 801, 802,
 &end
#
# 587 ALA H 600 VAL HB 4.97  (#peak 2089 #SUP 0.80 #QF 0.73 )
 &rst
  ixpk= 2089, nxpk= 0, iat= 553, 765, r1= 1.30, r2= 1.80, r3= 4.97, r4= 5.47,  &end
#
# 578 GLU QB 579 ALA H 3.78  (#peak 2097 #SUP 0.70 #QF 0.70 )
 &rst
  ixpk= 2097, nxpk= 0, iat=  -1, 447, r1= 1.30, r2= 1.80, r3= 4.24, r4= 4.74,
 igr1= 438, 439,
 &end
#
# 569 ASP HB3 571 LYS HB2 4.85  (#peak 2099 #SUP 0.60 #QF 0.60 )
 &rst
  ixpk= 2099, nxpk= 0, iat= 284, 310, r1= 1.30, r2= 1.80, r3= 4.85, r4= 5.35,  &end
#
# 571 LYS H 571 LYS HB2 4.04  (#peak 2105 #SUP 0.85 #QF 0.85 )
 &rst
  ixpk= 2105, nxpk= 0, iat= 308, 310, r1= 1.30, r2= 1.80, r3= 4.04, r4= 4.54,  &end
#
# 571 LYS HB2 572 PHE H 4.52  (#peak 2107 #SUP 0.90 #QF 0.90 )
 &rst
  ixpk= 2107, nxpk= 0, iat= 310, 332, r1= 1.30, r2= 1.80, r3= 4.52, r4= 5.02,  &end
#
# 598 GLU QG 599 GLU H 4.51  (#peak 2108 #SUP 0.39 #QF 0.39 )
 &rst
  ixpk= 2108, nxpk= 0, iat=  -1, 750, r1= 1.30, r2= 1.80, r3= 5.06, r4= 5.56,
 igr1= 739, 740,
 &end
#
# 585 MET QB 586 THR QG2 4.17  (#peak 2123 #SUP 0.58 #QF 0.58 )
 &rst
  ixpk= 2123, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.62, r4= 6.12,
 igr1= 527, 528,
 igr2= 545, 546, 547,
 &end
#
# 592 ILE HB 592 ILE QD1 3.36  (#peak 2129 #SUP 1.00   )
 &rst
  ixpk= 2129, nxpk= 0, iat= 642,  -1, r1= 1.30, r2= 1.80, r3= 4.04, r4= 4.54,
 igr2= 648, 649, 650,
 &end
#
# 592 ILE HA 592 ILE QD1 3.82  (#peak 2130 #SUP 0.99 #QF 0.99 )
 &rst
  ixpk= 2130, nxpk= 0, iat= 641,  -1, r1= 1.30, r2= 1.80, r3= 4.59, r4= 5.09,
 igr2= 648, 649, 650,
 &end
#
# 592 ILE QG2 592 ILE QD1 2.40  (#peak 2131     )
 &rst
  ixpk= 2131, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 3.46, r4= 3.96,
 igr1= 645, 646, 647,
 igr2= 648, 649, 650,
 &end
#
# 587 ALA QB 602 LEU QQD 2.54  (#peak 2132 #SUP 0.40 #QF 0.40 )
 &rst
  ixpk= 2132, nxpk= 0, iat=  -1, 796, r1= 1.30, r2= 1.80, r3= 5.25, r4= 5.75,
 igr1= 555, 556, 557,
 &end
#
# 565 LEU HG 566 TYR H 4.73  (#peak 2139 #SUP 0.92 #QF 0.92 )
 &rst
  ixpk= 2139, nxpk= 0, iat= 206, 225, r1= 1.30, r2= 1.80, r3= 4.73, r4= 5.23,  &end
#
# 565 LEU HA 565 LEU HG 3.99  (#peak 2140 #SUP 0.86 #QF 0.86 )
 &rst
  ixpk= 2140, nxpk= 0, iat= 203, 206, r1= 1.30, r2= 1.80, r3= 3.99, r4= 4.49,  &end
#
# 565 LEU HG 600 VAL QQG 5.03  (#peak 2141 #SUP 0.80 #QF 0.80 )
 &rst
  ixpk= 2141, nxpk= 0, iat= 206, 760, r1= 1.30, r2= 1.80, r3= 7.23, r4= 7.73,  &end
#
# 564 ALA QB 565 LEU HA 5.04  (#peak 2144 #SUP 0.98 #QF 0.87 )
 &rst
  ixpk= 2144, nxpk= 0, iat=  -1, 203, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55,
 igr1= 191, 192, 193,
 &end
#
# 565 LEU HA 600 VAL QQG 5.42  (#peak 2144 #SUP 0.98 #QF 0.87 )
 &rst
  ixpk= 2144, nxpk= 0, iat= 203, 760, r1= 1.30, r2= 1.80, r3= 7.62, r4= 8.12,  &end
#
# 565 LEU HB2 600 VAL QQG 4.28  (#peak 2145 #SUP 0.94 #QF 0.94 )
 &rst
  ixpk= 2145, nxpk= 0, iat= 204, 760, r1= 1.30, r2= 1.80, r3= 6.48, r4= 6.98,  &end
#
# 565 LEU HB3 600 VAL QQG 4.75  (#peak 2146 #SUP 0.83 #QF 0.41 )
 &rst
  ixpk= 2146, nxpk= 0, iat= 205, 760, r1= 1.30, r2= 1.80, r3= 6.95, r4= 7.45,  &end
#
# 591 PHE QB 594 TYR HA 4.85  (#peak 2158 #SUP 0.77 #QF 0.77 )
 &rst
  ixpk= 2158, nxpk= 0, iat=  -1, 676, r1= 1.30, r2= 1.80, r3= 5.44, r4= 5.94,
 igr1= 625, 626,
 &end
#
# 575 ALA HA 591 PHE QB 4.92  (#peak 2159 #SUP 0.53 #QF 0.53 )
 &rst
  ixpk= 2159, nxpk= 0, iat= 392,  -1, r1= 1.30, r2= 1.80, r3= 5.52, r4= 6.02,
 igr2= 625, 626,
 &end
#
# 573 TYR HB3 591 PHE QB 4.92  (#peak 2160 #SUP 0.53 #QF 0.53 )
 &rst
  ixpk= 2160, nxpk= 0, iat= 356,  -1, r1= 1.30, r2= 1.80, r3= 5.52, r4= 6.02,
 igr2= 625, 626,
 &end
#
# 569 ASP HB2 570 ASN HB3 5.33  (#peak 2165 #SUP 0.74 #QF 0.74 )
 &rst
  ixpk= 2165, nxpk= 0, iat= 283, 296, r1= 1.30, r2= 1.80, r3= 5.33, r4= 5.83,  &end
#
# 565 LEU HG 570 ASN HB2 5.50  (#peak 2167 #SUP 0.99 #QF 0.77 )
 &rst
  ixpk= 2167, nxpk= 0, iat= 206, 295, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
# 565 LEU HG 572 PHE QD 5.46  (#peak 2168 #SUP 0.78 #QF 0.41 )
 &rst
  ixpk= 2168, nxpk= 0, iat= 206,  -1, r1= 1.30, r2= 1.80, r3= 6.13, r4= 6.63,
 igr2= 336, 337,
 &end
#
# 565 LEU HG 572 PHE QE 5.50  (#peak 2168 #SUP 0.78 #QF 0.41 )
 &rst
  ixpk= 2168, nxpk= 0, iat= 206,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2= 338, 339,
 &end
#
# 565 LEU HG 571 LYS H 5.31  (#peak 2169 #SUP 1.00   )
 &rst
  ixpk= 2169, nxpk= 0, iat= 206, 308, r1= 1.30, r2= 1.80, r3= 5.31, r4= 5.81,  &end
#
# 590 LYS HA 590 LYS HD3 4.87  (#peak 2176 #SUP 0.86 #QF 0.86 )
 &rst
  ixpk= 2176, nxpk= 0, iat= 600, 606, r1= 1.30, r2= 1.80, r3= 4.87, r4= 5.37,  &end
#
# 590 LYS HA 590 LYS HD2 4.54  (#peak 2177 #SUP 0.81 #QF 0.81 )
 &rst
  ixpk= 2177, nxpk= 0, iat= 600, 605, r1= 1.30, r2= 1.80, r3= 4.54, r4= 5.04,  &end
#
# 590 LYS H 590 LYS HD3 5.05  (#peak 2178 #SUP 0.86 #QF 0.86 )
 &rst
  ixpk= 2178, nxpk= 0, iat= 599, 606, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,  &end
#
# 590 LYS HD2 596 ASN H 5.11  (#peak 2179 #SUP 0.94 #QF 0.94 )
 &rst
  ixpk= 2179, nxpk= 0, iat= 605, 699, r1= 1.30, r2= 1.80, r3= 5.11, r4= 5.61,  &end
#
# 575 ALA QB 590 LYS HB3 4.79  (#peak 2189 #SUP 0.55 #QF 0.55 )
 &rst
  ixpk= 2189, nxpk= 0, iat=  -1, 602, r1= 1.30, r2= 1.80, r3= 5.75, r4= 6.25,
 igr1= 393, 394, 395,
 &end
#
# 571 LYS HB3 572 PHE QD 5.37  (#peak 2190 #SUP 0.92 #QF 0.92 )
 &rst
  ixpk= 2190, nxpk= 0, iat= 311,  -1, r1= 1.30, r2= 1.80, r3= 6.03, r4= 6.53,
 igr2= 336, 337,
 &end
#
# 590 LYS HB2 597 TYR HA 5.04  (#peak 2193 #SUP 0.88 #QF 0.88 )
 &rst
  ixpk= 2193, nxpk= 0, iat= 601, 718, r1= 1.30, r2= 1.80, r3= 5.04, r4= 5.54,  &end
#
# 576 GLU H 590 LYS HB2 5.31  (#peak 2194 #SUP 0.76 #QF 0.76 )
 &rst
  ixpk= 2194, nxpk= 0, iat= 405, 601, r1= 1.30, r2= 1.80, r3= 5.31, r4= 5.81,  &end
#
# 592 ILE HG12 608 ILE QD1 5.50  (#peak 2196 #SUP 0.73 #QF 0.73 )
 &rst
  ixpk= 2196, nxpk= 0, iat= 643,  -1, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr2= 906, 907, 908,
 &end
#
# 576 GLU QG 592 ILE HG12 5.41  (#peak 2198 #SUP 1.00 #QF 0.59 )
 &rst
  ixpk= 2198, nxpk= 0, iat=  -1, 643, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr1= 409, 410,
 &end
#
# 570 ASN HB3 571 LYS QG 5.50  (#peak 2199 #SUP 0.36 #QF 0.36 )
 &rst
  ixpk= 2199, nxpk= 0, iat= 296,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2= 312, 313,
 &end
#
# 590 LYS HD3 596 ASN HA 5.04  (#peak 2214 #SUP 0.72 #QF 0.72 )
 &rst
  ixpk= 2214, nxpk= 0, iat= 606, 700, r1= 1.30, r2= 1.80, r3= 5.04, r4= 5.54,  &end
#
# 571 LYS HB3 571 LYS QG 2.86  (#peak 2231     )
 &rst
  ixpk= 2231, nxpk= 0, iat= 311,  -1, r1= 1.30, r2= 1.80, r3= 3.21, r4= 3.71,
 igr2= 312, 313,
 &end
#
# 569 ASP HB2 571 LYS HB2 4.34  (#peak 2244 #SUP 0.60 #QF 0.60 )
 &rst
  ixpk= 2244, nxpk= 0, iat= 283, 310, r1= 1.30, r2= 1.80, r3= 4.34, r4= 4.84,  &end
#
# 590 LYS H 590 LYS HB3 3.82  (#peak 2253 #SUP 0.48 #QF 0.48 )
 &rst
  ixpk= 2253, nxpk= 0, iat= 599, 602, r1= 1.30, r2= 1.80, r3= 3.82, r4= 4.32,  &end
#
# 590 LYS HA 596 ASN HA 4.63  (#peak 2258 #SUP 0.32 #QF 0.32 )
 &rst
  ixpk= 2258, nxpk= 0, iat= 600, 700, r1= 1.30, r2= 1.80, r3= 4.63, r4= 5.13,  &end
#
# 590 LYS HB2 590 LYS HE3 4.69  (#peak 2273 #SUP 1.00   )
 &rst
  ixpk= 2273, nxpk= 0, iat= 601, 608, r1= 1.30, r2= 1.80, r3= 4.69, r4= 5.19,  &end
#
# 563 PHE HA 574 ARG HA 3.36  (#peak 2288 #SUP 0.92 #QF 0.92 )
 &rst
  ixpk= 2288, nxpk= 0, iat= 176, 374, r1= 1.30, r2= 1.80, r3= 3.36, r4= 3.86,  &end
#
# 574 ARG HA 575 ALA H 2.92  (#peak 2292 #SUP 0.91 #QF 0.91 )
 &rst
  ixpk= 2292, nxpk= 0, iat= 374, 391, r1= 1.30, r2= 1.80, r3= 2.92, r4= 3.42,  &end
#
# 574 ARG HA 575 ALA QB 4.45  (#peak 2296 #SUP 0.94 #QF 0.62 )
 &rst
  ixpk= 2296, nxpk= 0, iat= 374,  -1, r1= 1.30, r2= 1.80, r3= 5.34, r4= 5.84,
 igr2= 393, 394, 395,
 &end
#
# 574 ARG HA 592 ILE QD1 4.80  (#peak 2296 #SUP 0.94 #QF 0.62 )
 &rst
  ixpk= 2296, nxpk= 0, iat= 374,  -1, r1= 1.30, r2= 1.80, r3= 5.76, r4= 6.26,
 igr2= 648, 649, 650,
 &end
#
# 559 GLY H 578 GLU HA 3.74  (#peak 2299 #SUP 0.99 #QF 0.75 )
 &rst
  ixpk= 2299, nxpk= 0, iat= 123, 437, r1= 1.30, r2= 1.80, r3= 3.74, r4= 4.24,  &end
#
# 578 GLU HA 589 VAL HA 5.10  (#peak 2302 #SUP 0.95 #QF 0.95 )
 &rst
  ixpk= 2302, nxpk= 0, iat= 437, 582, r1= 1.30, r2= 1.80, r3= 5.10, r4= 5.60,  &end
#
# 578 GLU HA 579 ALA QB 4.62  (#peak 2305 #SUP 0.73 #QF 0.73 )
 &rst
  ixpk= 2305, nxpk= 0, iat= 437,  -1, r1= 1.30, r2= 1.80, r3= 5.55, r4= 6.05,
 igr2= 449, 450, 451,
 &end
#
# 577 VAL QG1 578 GLU HA 4.30  (#peak 2306 #SUP 0.77 #QF 0.77 )
 &rst
  ixpk= 2306, nxpk= 0, iat=  -1, 437, r1= 1.30, r2= 1.80, r3= 5.16, r4= 5.66,
 igr1= 421, 422, 423,
 &end
#
# 556 TRP HB3 577 VAL QG2 4.49  (#peak 2311 #SUP 0.57 #QF 0.57 )
 &rst
  ixpk= 2311, nxpk= 0, iat=  76,  -1, r1= 1.30, r2= 1.80, r3= 5.39, r4= 5.89,
 igr2= 424, 425, 426,
 &end
#
# 562 CYS HA 575 ALA H 4.83  (#peak 2329 #SUP 0.93 #QF 0.93 )
 &rst
  ixpk= 2329, nxpk= 0, iat= 160, 391, r1= 1.30, r2= 1.80, r3= 4.83, r4= 5.33,  &end
#
# 561 GLU HA 577 VAL HB 4.38  (#peak 2335 #SUP 0.82 #QF 0.82 )
 &rst
  ixpk= 2335, nxpk= 0, iat= 148, 420, r1= 1.30, r2= 1.80, r3= 4.38, r4= 4.88,  &end
#
# 561 GLU HA 576 GLU QB 4.25  (#peak 2336 #SUP 0.32 #QF 0.32 )
 &rst
  ixpk= 2336, nxpk= 0, iat= 148,  -1, r1= 1.30, r2= 1.80, r3= 4.77, r4= 5.27,
 igr2= 407, 408,
 &end
#
# 571 LYS HA 572 PHE H 2.93  (#peak 2342 #SUP 0.91 #QF 0.91 )
 &rst
  ixpk= 2342, nxpk= 0, iat= 309, 332, r1= 1.30, r2= 1.80, r3= 2.93, r4= 3.43,  &end
#
# 601 LEU HA 602 LEU H 2.99  (#peak 2343 #SUP 0.73 #QF 0.73 )
 &rst
  ixpk= 2343, nxpk= 0, iat= 781, 799, r1= 1.30, r2= 1.80, r3= 2.99, r4= 3.49,  &end
#
# 572 PHE HA 572 PHE QD 3.52  (#peak 2346 #SUP 0.85 #QF 0.85 )
 &rst
  ixpk= 2346, nxpk= 0, iat= 333,  -1, r1= 1.30, r2= 1.80, r3= 3.95, r4= 4.45,
 igr2= 336, 337,
 &end
#
# 572 PHE HA 573 TYR H 3.04  (#peak 2349 #SUP 0.86 #QF 0.86 )
 &rst
  ixpk= 2349, nxpk= 0, iat= 333, 353, r1= 1.30, r2= 1.80, r3= 3.04, r4= 3.54,  &end
#
# 558 PRO HB3 579 ALA HA 3.88  (#peak 2354 #SUP 0.85 #QF 0.85 )
 &rst
  ixpk= 2354, nxpk= 0, iat= 114, 448, r1= 1.30, r2= 1.80, r3= 3.88, r4= 4.38,  &end
#
# 580 LEU HA 587 ALA HA 3.21  (#peak 2357 #SUP 0.96 #QF 0.96 )
 &rst
  ixpk= 2357, nxpk= 0, iat= 461, 554, r1= 1.30, r2= 1.80, r3= 3.21, r4= 3.71,  &end
#
# 581 HIS H 587 ALA HA 4.08  (#peak 2360 #SUP 0.67 #QF 0.67 )
 &rst
  ixpk= 2360, nxpk= 0, iat= 481, 554, r1= 1.30, r2= 1.80, r3= 4.08, r4= 4.58,  &end
#
# 587 ALA HA 588 VAL H 3.04  (#peak 2361 #SUP 0.91 #QF 0.91 )
 &rst
  ixpk= 2361, nxpk= 0, iat= 554, 565, r1= 1.30, r2= 1.80, r3= 3.04, r4= 3.54,  &end
#
# 590 LYS HD2 595 GLY HA2 5.00  (#peak 2371 #SUP 0.63 #QF 0.63 )
 &rst
  ixpk= 2371, nxpk= 0, iat= 605, 689, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50,  &end
#
# 590 LYS HG2 595 GLY HA2 4.78  (#peak 2372 #SUP 0.55 #QF 0.55 )
 &rst
  ixpk= 2372, nxpk= 0, iat= 603, 689, r1= 1.30, r2= 1.80, r3= 4.78, r4= 5.28,  &end
#
# 590 LYS HG3 595 GLY HA2 5.26  (#peak 2373 #SUP 0.67 #QF 0.67 )
 &rst
  ixpk= 2373, nxpk= 0, iat= 604, 689, r1= 1.30, r2= 1.80, r3= 5.26, r4= 5.76,  &end
#
# 590 LYS HG3 595 GLY HA3 5.07  (#peak 2376 #SUP 0.91 #QF 0.91 )
 &rst
  ixpk= 2376, nxpk= 0, iat= 604, 690, r1= 1.30, r2= 1.80, r3= 5.07, r4= 5.57,  &end
#
# 591 PHE QB 595 GLY HA3 5.50  (#peak 2382 #SUP 0.20 #QF 0.20 )
 &rst
  ixpk= 2382, nxpk= 0, iat=  -1, 690, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 625, 626,
 &end
#
# 589 VAL QG1 599 GLU HA 5.50  (#peak 2384 #SUP 0.62 #QF 0.62 )
 &rst
  ixpk= 2384, nxpk= 0, iat=  -1, 751, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr1= 584, 585, 586,
 &end
#
# 556 TRP HE1 602 LEU HA 5.23  (#peak 2395 #SUP 0.60 #QF 0.60 )
 &rst
  ixpk= 2395, nxpk= 0, iat=  78, 800, r1= 1.30, r2= 1.80, r3= 5.23, r4= 5.73,  &end
#
# 565 LEU HB3 604 ASN HA 4.23  (#peak 2399 #SUP 0.55 #QF 0.55 )
 &rst
  ixpk= 2399, nxpk= 0, iat= 205, 830, r1= 1.30, r2= 1.80, r3= 4.23, r4= 4.73,  &end
#
# 565 LEU H 604 ASN HA 4.84  (#peak 2400 #SUP 0.77 #QF 0.77 )
 &rst
  ixpk= 2400, nxpk= 0, iat= 202, 830, r1= 1.30, r2= 1.80, r3= 4.84, r4= 5.34,  &end
#
# 604 ASN HA 605 ILE H 3.51  (#peak 2401 #SUP 0.98 #QF 0.98 )
 &rst
  ixpk= 2401, nxpk= 0, iat= 830, 843, r1= 1.30, r2= 1.80, r3= 3.51, r4= 4.01,  &end
#
# 563 PHE H 608 ILE HA 5.17  (#peak 2406 #SUP 0.48 #QF 0.48 )
 &rst
  ixpk= 2406, nxpk= 0, iat= 175, 899, r1= 1.30, r2= 1.80, r3= 5.17, r4= 5.67,  &end
#
# 556 TRP HH2 562 CYS HB3 4.43  (#peak 2419 #SUP 0.80 #QF 0.80 )
 &rst
  ixpk= 2419, nxpk= 0, iat=  82, 162, r1= 1.30, r2= 1.80, r3= 4.43, r4= 4.93,  &end
#
# 556 TRP HZ2 562 CYS HB3 4.54  (#peak 2420 #SUP 0.96 #QF 0.96 )
 &rst
  ixpk= 2420, nxpk= 0, iat=  80, 162, r1= 1.30, r2= 1.80, r3= 4.54, r4= 5.04,  &end
#
# 558 PRO HB2 579 ALA QB 5.45  (#peak 2439 #SUP 0.67 #QF 0.67 )
 &rst
  ixpk= 2439, nxpk= 0, iat= 113,  -1, r1= 1.30, r2= 1.80, r3= 6.55, r4= 7.05,
 igr2= 449, 450, 451,
 &end
#
# 558 PRO HB2 579 ALA H 5.38  (#peak 2441 #SUP 0.87 #QF 0.87 )
 &rst
  ixpk= 2441, nxpk= 0, iat= 113, 447, r1= 1.30, r2= 1.80, r3= 5.38, r4= 5.88,  &end
#
# 563 PHE HB3 574 ARG HA 5.50  (#peak 2451 #SUP 0.76 #QF 0.76 )
 &rst
  ixpk= 2451, nxpk= 0, iat= 178, 374, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
# 563 PHE HB3 572 PHE H 5.50  (#peak 2453 #SUP 0.38 #QF 0.38 )
 &rst
  ixpk= 2453, nxpk= 0, iat= 178, 332, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
# 590 LYS HE2 595 GLY HA2 5.31  (#peak 2458 #SUP 0.77 #QF 0.77 )
 &rst
  ixpk= 2458, nxpk= 0, iat= 607, 689, r1= 1.30, r2= 1.80, r3= 5.31, r4= 5.81,  &end
#
# 564 ALA QB 605 ILE QD1 4.02  (#peak 2461 #SUP 0.83 #QF 0.83 )
 &rst
  ixpk= 2461, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.80, r4= 6.30,
 igr1= 191, 192, 193,
 igr2= 851, 852, 853,
 &end
#
# 564 ALA QB 589 VAL QG1 3.27  (#peak 2462 #SUP 0.76 #QF 0.76 )
 &rst
  ixpk= 2462, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,
 igr1= 191, 192, 193,
 igr2= 584, 585, 586,
 &end
#
# 564 ALA QB 565 LEU H 3.11  (#peak 2470 #SUP 0.79 #QF 0.79 )
 &rst
  ixpk= 2470, nxpk= 0, iat=  -1, 202, r1= 1.30, r2= 1.80, r3= 3.73, r4= 4.23,
 igr1= 191, 192, 193,
 &end
#
# 564 ALA QB 573 TYR H 4.49  (#peak 2471 #SUP 0.70 #QF 0.70 )
 &rst
  ixpk= 2471, nxpk= 0, iat=  -1, 353, r1= 1.30, r2= 1.80, r3= 5.39, r4= 5.89,
 igr1= 191, 192, 193,
 &end
#
# 565 LEU HB2 572 PHE HA 5.46  (#peak 2472 #SUP 0.83 #QF 0.83 )
 &rst
  ixpk= 2472, nxpk= 0, iat= 204, 333, r1= 1.30, r2= 1.80, r3= 5.46, r4= 5.96,  &end
#
# 569 ASP HB3 571 LYS H 5.50  (#peak 2495 #SUP 0.81 #QF 0.81 )
 &rst
  ixpk= 2495, nxpk= 0, iat= 284, 308, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
# 569 ASP HB3 570 ASN H 4.89  (#peak 2496 #SUP 0.93 #QF 0.93 )
 &rst
  ixpk= 2496, nxpk= 0, iat= 284, 293, r1= 1.30, r2= 1.80, r3= 4.89, r4= 5.39,  &end
#
# 569 ASP HB2 571 LYS H 5.20  (#peak 2499 #SUP 0.88 #QF 0.88 )
 &rst
  ixpk= 2499, nxpk= 0, iat= 283, 308, r1= 1.30, r2= 1.80, r3= 5.20, r4= 5.70,  &end
#
# 569 ASP HB2 570 ASN H 5.06  (#peak 2500 #SUP 0.42 #QF 0.42 )
 &rst
  ixpk= 2500, nxpk= 0, iat= 283, 293, r1= 1.30, r2= 1.80, r3= 5.06, r4= 5.56,  &end
#
# 565 LEU HG 570 ASN HB3 5.34  (#peak 2505 #SUP 0.40 #QF 0.40 )
 &rst
  ixpk= 2505, nxpk= 0, iat= 206, 296, r1= 1.30, r2= 1.80, r3= 5.34, r4= 5.84,  &end
#
# 569 ASP H 570 ASN HB3 5.50  (#peak 2507 #SUP 0.70 #QF 0.70 )
 &rst
  ixpk= 2507, nxpk= 0, iat= 281, 296, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
# 570 ASN HB3 571 LYS H 4.78  (#peak 2508 #SUP 0.87 #QF 0.87 )
 &rst
  ixpk= 2508, nxpk= 0, iat= 296, 308, r1= 1.30, r2= 1.80, r3= 4.78, r4= 5.28,  &end
#
# 590 LYS HB3 597 TYR QE 5.50  (#peak 2515 #SUP 0.39 #QF 0.39 )
 &rst
  ixpk= 2515, nxpk= 0, iat= 602,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2= 723, 724,
 &end
#
# 563 PHE HA 572 PHE HB2 5.50  (#peak 2521 #SUP 0.53 #QF 0.53 )
 &rst
  ixpk= 2521, nxpk= 0, iat= 176, 334, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
# 564 ALA QB 572 PHE HB3 5.38  (#peak 2531 #SUP 0.78 #QF 0.78 )
 &rst
  ixpk= 2531, nxpk= 0, iat=  -1, 335, r1= 1.30, r2= 1.80, r3= 6.46, r4= 6.96,
 igr1= 191, 192, 193,
 &end
#
# 565 LEU HA 572 PHE HB3 5.04  (#peak 2532 #SUP 0.57 #QF 0.57 )
 &rst
  ixpk= 2532, nxpk= 0, iat= 203, 335, r1= 1.30, r2= 1.80, r3= 5.04, r4= 5.54,  &end
#
# 563 PHE HA 572 PHE HB3 4.95  (#peak 2534 #SUP 0.95 #QF 0.95 )
 &rst
  ixpk= 2534, nxpk= 0, iat= 176, 335, r1= 1.30, r2= 1.80, r3= 4.95, r4= 5.45,  &end
#
# 564 ALA H 572 PHE HB3 5.16  (#peak 2535 #SUP 0.72 #QF 0.72 )
 &rst
  ixpk= 2535, nxpk= 0, iat= 189, 335, r1= 1.30, r2= 1.80, r3= 5.16, r4= 5.66,  &end
#
# 573 TYR HB3 574 ARG QB 4.95  (#peak 2536 #SUP 0.58 #QF 0.58 )
 &rst
  ixpk= 2536, nxpk= 0, iat= 356,  -1, r1= 1.30, r2= 1.80, r3= 5.56, r4= 6.06,
 igr2= 375, 376,
 &end
#
# 573 TYR HB3 594 TYR QE 5.00  (#peak 2539 #SUP 0.87 #QF 0.87 )
 &rst
  ixpk= 2539, nxpk= 0, iat= 356,  -1, r1= 1.30, r2= 1.80, r3= 5.61, r4= 6.11,
 igr2= 681, 682,
 &end
#
# 576 GLU QB 578 GLU H 5.50  (#peak 2549 #SUP 0.84 #QF 0.84 )
 &rst
  ixpk= 2549, nxpk= 0, iat=  -1, 436, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 407, 408,
 &end
#
# 577 VAL QG1 578 GLU QB 4.81  (#peak 2551 #SUP 0.87 #QF 0.87 )
 &rst
  ixpk= 2551, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.48, r4= 6.98,
 igr1= 421, 422, 423,
 igr2= 438, 439,
 &end
#
# 579 ALA QB 597 TYR QE 5.50  (#peak 2555 #SUP 0.88 #QF 0.88 )
 &rst
  ixpk= 2555, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1= 449, 450, 451,
 igr2= 723, 724,
 &end
#
# 579 ALA QB 597 TYR QD 5.05  (#peak 2556 #SUP 0.64 #QF 0.64 )
 &rst
  ixpk= 2556, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.81, r4= 7.31,
 igr1= 449, 450, 451,
 igr2= 721, 722,
 &end
#
# 586 THR HB 600 VAL H 4.27  (#peak 2560 #SUP 0.97 #QF 0.97 )
 &rst
  ixpk= 2560, nxpk= 0, iat= 543, 763, r1= 1.30, r2= 1.80, r3= 4.27, r4= 4.77,  &end
#
# 590 LYS HB3 597 TYR HA 5.50  (#peak 2565 #SUP 0.67 #QF 0.67 )
 &rst
  ixpk= 2565, nxpk= 0, iat= 602, 718, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
# 590 LYS HB2 598 GLU H 5.49  (#peak 2566 #SUP 0.71 #QF 0.71 )
 &rst
  ixpk= 2566, nxpk= 0, iat= 601, 735, r1= 1.30, r2= 1.80, r3= 5.49, r4= 5.99,  &end
#
# 591 PHE QB 593 ASP H 5.40  (#peak 2567 #SUP 0.44 #QF 0.44 )
 &rst
  ixpk= 2567, nxpk= 0, iat=  -1, 659, r1= 1.30, r2= 1.80, r3= 6.06, r4= 6.56,
 igr1= 625, 626,
 &end
#
# 598 GLU QB 599 GLU QB 4.57  (#peak 2584 #SUP 0.96 #QF 0.96 )
 &rst
  ixpk= 2584, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.76, r4= 6.26,
 igr1= 737, 738,
 igr2= 752, 753,
 &end
#
# 601 LEU QQD 603 SER HB2 4.78  (#peak 2595 #SUP 0.84 #QF 0.84 )
 &rst
  ixpk= 2595, nxpk= 0, iat= 777, 818, r1= 1.30, r2= 1.80, r3= 6.98, r4= 7.48,  &end
#
# 601 LEU QQD 603 SER HB3 4.78  (#peak 2605 #SUP 0.93 #QF 0.93 )
 &rst
  ixpk= 2605, nxpk= 0, iat= 777, 819, r1= 1.30, r2= 1.80, r3= 6.98, r4= 7.48,  &end
#
# 600 VAL HB 604 ASN HB2 5.50  (#peak 2609 #SUP 0.97 #QF 0.97 )
 &rst
  ixpk= 2609, nxpk= 0, iat= 765, 831, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
# 600 VAL HB 604 ASN HB3 5.50  (#peak 2611 #SUP 0.40 #QF 0.40 )
 &rst
  ixpk= 2611, nxpk= 0, iat= 765, 832, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
# 589 VAL QG1 605 ILE HB 5.36  (#peak 2613 #SUP 0.96 #QF 0.96 )
 &rst
  ixpk= 2613, nxpk= 0, iat=  -1, 845, r1= 1.30, r2= 1.80, r3= 6.44, r4= 6.94,
 igr1= 584, 585, 586,
 &end
#
# 562 CYS HB2 605 ILE HB 5.17  (#peak 2614 #SUP 0.67 #QF 0.67 )
 &rst
  ixpk= 2614, nxpk= 0, iat= 161, 845, r1= 1.30, r2= 1.80, r3= 5.17, r4= 5.67,  &end
#
# 556 TRP HZ2 605 ILE HB 4.94  (#peak 2615 #SUP 0.90 #QF 0.90 )
 &rst
  ixpk= 2615, nxpk= 0, iat=  80, 845, r1= 1.30, r2= 1.80, r3= 4.94, r4= 5.44,  &end
#
# 604 ASN H 605 ILE HB 5.31  (#peak 2616 #SUP 0.80 #QF 0.80 )
 &rst
  ixpk= 2616, nxpk= 0, iat= 829, 845, r1= 1.30, r2= 1.80, r3= 5.31, r4= 5.81,  &end
#
# 565 LEU H 605 ILE HB 5.50  (#peak 2618 #SUP 0.60 #QF 0.60 )
 &rst
  ixpk= 2618, nxpk= 0, iat= 202, 845, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
# 563 PHE H 605 ILE HB 5.50  (#peak 2619 #SUP 0.83 #QF 0.83 )
 &rst
  ixpk= 2619, nxpk= 0, iat= 175, 845, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
# 556 TRP HE1 605 ILE HB 4.72  (#peak 2620 #SUP 0.94 #QF 0.94 )
 &rst
  ixpk= 2620, nxpk= 0, iat=  78, 845, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,  &end
#
# 564 ALA QB 605 ILE HB 4.91  (#peak 2621 #SUP 0.90 #QF 0.90 )
 &rst
  ixpk= 2621, nxpk= 0, iat=  -1, 845, r1= 1.30, r2= 1.80, r3= 5.90, r4= 6.40,
 igr1= 191, 192, 193,
 &end
#
# 556 TRP HZ2 607 PRO HB3 4.97  (#peak 2624 #SUP 0.61 #QF 0.61 )
 &rst
  ixpk= 2624, nxpk= 0, iat=  80, 885, r1= 1.30, r2= 1.80, r3= 4.97, r4= 5.47,  &end
#
# 608 ILE HA 609 LEU QB 5.02  (#peak 2631 #SUP 0.69 #QF 0.69 )
 &rst
  ixpk= 2631, nxpk= 0, iat= 899,  -1, r1= 1.30, r2= 1.80, r3= 5.63, r4= 6.13,
 igr2= 919, 920,
 &end
#
# 566 TYR HA 567 TRP HB3 5.02  (#peak 2635 #SUP 0.66 #QF 0.66 )
 &rst
  ixpk= 2635, nxpk= 0, iat= 226, 251, r1= 1.30, r2= 1.80, r3= 5.02, r4= 5.52,  &end
#
# 600 VAL HA 601 LEU HA 4.54  (#peak 2653 #SUP 0.93 #QF 0.93 )
 &rst
  ixpk= 2653, nxpk= 0, iat= 764, 781, r1= 1.30, r2= 1.80, r3= 4.54, r4= 5.04,  &end
#
# 564 ALA HA 565 LEU HA 5.10  (#peak 2656 #SUP 0.96 #QF 0.96 )
 &rst
  ixpk= 2656, nxpk= 0, iat= 190, 203, r1= 1.30, r2= 1.80, r3= 5.10, r4= 5.60,  &end
#
# 563 PHE HB3 564 ALA HA 4.94  (#peak 2657 #SUP 0.81 #QF 0.81 )
 &rst
  ixpk= 2657, nxpk= 0, iat= 178, 190, r1= 1.30, r2= 1.80, r3= 4.94, r4= 5.44,  &end
#
# 565 LEU HA 572 PHE H 4.92  (#peak 2658 #SUP 0.66 #QF 0.66 )
 &rst
  ixpk= 2658, nxpk= 0, iat= 203, 332, r1= 1.30, r2= 1.80, r3= 4.92, r4= 5.42,  &end
#
# 565 LEU HA 571 LYS HA 5.49  (#peak 2660 #SUP 0.51 #QF 0.51 )
 &rst
  ixpk= 2660, nxpk= 0, iat= 203, 309, r1= 1.30, r2= 1.80, r3= 5.49, r4= 5.99,  &end
#
# 565 LEU HA 570 ASN HA 5.25  (#peak 2661 #SUP 0.81 #QF 0.81 )
 &rst
  ixpk= 2661, nxpk= 0, iat= 203, 294, r1= 1.30, r2= 1.80, r3= 5.25, r4= 5.75,  &end
#
# 576 GLU QB 577 VAL HB 5.24  (#peak 2663 #SUP 0.60 #QF 0.60 )
 &rst
  ixpk= 2663, nxpk= 0, iat=  -1, 420, r1= 1.30, r2= 1.80, r3= 5.88, r4= 6.38,
 igr1= 407, 408,
 &end
#
# 592 ILE HA 595 GLY H 5.16  (#peak 2667 #SUP 0.53 #QF 0.53 )
 &rst
  ixpk= 2667, nxpk= 0, iat= 641, 688, r1= 1.30, r2= 1.80, r3= 5.16, r4= 5.66,  &end
#
# 591 PHE H 592 ILE HA 5.50  (#peak 2668 #SUP 0.54 #QF 0.54 )
 &rst
  ixpk= 2668, nxpk= 0, iat= 623, 641, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
# 592 ILE HA 595 GLY HA2 5.03  (#peak 2669 #SUP 0.84 #QF 0.84 )
 &rst
  ixpk= 2669, nxpk= 0, iat= 641, 689, r1= 1.30, r2= 1.80, r3= 5.03, r4= 5.53,  &end
#
# 575 ALA H 592 ILE HG13 5.50  (#peak 2672 #SUP 0.92 #QF 0.92 )
 &rst
  ixpk= 2672, nxpk= 0, iat= 391, 644, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
# 592 ILE QG2 595 GLY HA2 5.50  (#peak 2673 #SUP 0.73 #QF 0.73 )
 &rst
  ixpk= 2673, nxpk= 0, iat=  -1, 689, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr1= 645, 646, 647,
 &end
#
# 563 PHE H 608 ILE QD1 4.73  (#peak 2675 #SUP 0.98 #QF 0.98 )
 &rst
  ixpk= 2675, nxpk= 0, iat= 175,  -1, r1= 1.30, r2= 1.80, r3= 5.68, r4= 6.18,
 igr2= 906, 907, 908,
 &end
#
# 575 ALA H 608 ILE QD1 4.83  (#peak 2676 #SUP 0.96 #QF 0.96 )
 &rst
  ixpk= 2676, nxpk= 0, iat= 391,  -1, r1= 1.30, r2= 1.80, r3= 5.80, r4= 6.30,
 igr2= 906, 907, 908,
 &end
#
# 562 CYS HB3 605 ILE QD1 5.50  (#peak 2678 #SUP 0.91 #QF 0.91 )
 &rst
  ixpk= 2678, nxpk= 0, iat= 162,  -1, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr2= 851, 852, 853,
 &end
#
# 564 ALA HA 605 ILE QD1 4.95  (#peak 2679 #SUP 0.96 #QF 0.96 )
 &rst
  ixpk= 2679, nxpk= 0, iat= 190,  -1, r1= 1.30, r2= 1.80, r3= 5.94, r4= 6.44,
 igr2= 851, 852, 853,
 &end
#
# 604 ASN H 605 ILE QD1 5.14  (#peak 2681 #SUP 0.69 #QF 0.69 )
 &rst
  ixpk= 2681, nxpk= 0, iat= 829,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2= 851, 852, 853,
 &end
#
# 562 CYS HB2 605 ILE QD1 5.50  (#peak 2682 #SUP 0.79 #QF 0.79 )
 &rst
  ixpk= 2682, nxpk= 0, iat= 161,  -1, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr2= 851, 852, 853,
 &end
#
# 580 LEU HA 605 ILE QD1 5.17  (#peak 2683 #SUP 0.73 #QF 0.73 )
 &rst
  ixpk= 2683, nxpk= 0, iat= 461,  -1, r1= 1.30, r2= 1.80, r3= 6.21, r4= 6.71,
 igr2= 851, 852, 853,
 &end
#
# 589 VAL HA 605 ILE QD1 5.50  (#peak 2684 #SUP 0.69 #QF 0.69 )
 &rst
  ixpk= 2684, nxpk= 0, iat= 582,  -1, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr2= 851, 852, 853,
 &end
#
# 556 TRP HB3 605 ILE QD1 5.44  (#peak 2685 #SUP 0.79 #QF 0.79 )
 &rst
  ixpk= 2685, nxpk= 0, iat=  76,  -1, r1= 1.30, r2= 1.80, r3= 6.53, r4= 7.03,
 igr2= 851, 852, 853,
 &end
#
# 608 ILE QG2 608 ILE QG1 3.11  (#peak 2686 #SUP 0.97 #QF 0.97 )
 &rst
  ixpk= 2686, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.19, r4= 4.69,
 igr1= 903, 904, 905,
 igr2= 901, 902,
 &end
#
# 608 ILE QG1 609 LEU H 5.43  (#peak 2687 #SUP 0.72 #QF 0.72 )
 &rst
  ixpk= 2687, nxpk= 0, iat=  -1, 917, r1= 1.30, r2= 1.80, r3= 6.09, r4= 6.59,
 igr1= 901, 902,
 &end
#
# 563 PHE QD 608 ILE QG1 5.49  (#peak 2690 #SUP 0.89 #QF 0.66 )
 &rst
  ixpk= 2690, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.92, r4= 7.42,
 igr1= 179, 180,
 igr2= 901, 902,
 &end
#
# 563 PHE QE 608 ILE QG1 5.50  (#peak 2690 #SUP 0.89 #QF 0.66 )
 &rst
  ixpk= 2690, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1= 181, 182,
 igr2= 901, 902,
 &end
#
# 605 ILE HA 605 ILE QG1 4.18  (#peak 2691 #SUP 1.00   )
 &rst
  ixpk= 2691, nxpk= 0, iat= 844,  -1, r1= 1.30, r2= 1.80, r3= 4.69, r4= 5.19,
 igr2= 846, 847,
 &end
#
# 564 ALA HA 605 ILE QG1 5.22  (#peak 2693 #SUP 0.93 #QF 0.93 )
 &rst
  ixpk= 2693, nxpk= 0, iat= 190,  -1, r1= 1.30, r2= 1.80, r3= 5.86, r4= 6.36,
 igr2= 846, 847,
 &end
#
# 604 ASN H 605 ILE QG1 5.31  (#peak 2694 #SUP 0.69 #QF 0.69 )
 &rst
  ixpk= 2694, nxpk= 0, iat= 829,  -1, r1= 1.30, r2= 1.80, r3= 5.96, r4= 6.46,
 igr2= 846, 847,
 &end
#
# 605 ILE QG1 606 LYS H 5.04  (#peak 2695 #SUP 0.95 #QF 0.95 )
 &rst
  ixpk= 2695, nxpk= 0, iat=  -1, 863, r1= 1.30, r2= 1.80, r3= 5.66, r4= 6.16,
 igr1= 846, 847,
 &end
#
# 556 TRP HE1 605 ILE QG1 4.80  (#peak 2696 #SUP 1.00   )
 &rst
  ixpk= 2696, nxpk= 0, iat=  78,  -1, r1= 1.30, r2= 1.80, r3= 5.39, r4= 5.89,
 igr2= 846, 847,
 &end
#
# 556 TRP HB3 589 VAL QG1 5.50  (#peak 2698 #SUP 0.75 #QF 0.75 )
 &rst
  ixpk= 2698, nxpk= 0, iat=  76,  -1, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr2= 584, 585, 586,
 &end
#
# 578 GLU HA 589 VAL QG1 5.50  (#peak 2699 #SUP 0.97 #QF 0.97 )
 &rst
  ixpk= 2699, nxpk= 0, iat= 437,  -1, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr2= 584, 585, 586,
 &end
#
# 564 ALA HA 589 VAL QG1 5.24  (#peak 2700 #SUP 0.92 #QF 0.92 )
 &rst
  ixpk= 2700, nxpk= 0, iat= 190,  -1, r1= 1.30, r2= 1.80, r3= 6.29, r4= 6.79,
 igr2= 584, 585, 586,
 &end
#
# 575 ALA QB 589 VAL QG2 2.85  (#peak 2703 #SUP 0.50 #QF 0.50 )
 &rst
  ixpk= 2703, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.11, r4= 4.61,
 igr1= 393, 394, 395,
 igr2= 587, 588, 589,
 &end
#
# 556 TRP HA 557 LYS H 2.76  (#peak 21 #SUP 0.62 #QF 0.62 )
 &rst
  ixpk= 21, nxpk= 0, iat=  74,  92, r1= 1.30, r2= 1.80, r3= 2.76, r4= 3.26,  &end
#
# 556 TRP HB3 557 LYS H 3.11  (#peak 25 #SUP 0.86 #QF 0.86 )
 &rst
  ixpk= 25, nxpk= 0, iat=  76,  92, r1= 1.30, r2= 1.80, r3= 3.11, r4= 3.61,  &end
#
# 557 LYS H 577 VAL QG2 4.10  (#peak 31 #SUP 0.33 #QF 0.33 )
 &rst
  ixpk= 31, nxpk= 0, iat=  92,  -1, r1= 1.30, r2= 1.80, r3= 4.92, r4= 5.42,
 igr2= 424, 425, 426,
 &end
#
# 559 GLY H 560 ASP H 3.01  (#peak 33 #SUP 0.71 #QF 0.71 )
 &rst
  ixpk= 33, nxpk= 0, iat= 123, 134, r1= 1.30, r2= 1.80, r3= 3.01, r4= 3.51,  &end
#
# 560 ASP H 577 VAL H 3.78  (#peak 34 #SUP 0.73 #QF 0.73 )
 &rst
  ixpk= 34, nxpk= 0, iat= 134, 418, r1= 1.30, r2= 1.80, r3= 3.78, r4= 4.28,  &end
#
# 560 ASP H 577 VAL HB 2.99  (#peak 44 #SUP 0.94 #QF 0.94 )
 &rst
  ixpk= 44, nxpk= 0, iat= 134, 420, r1= 1.30, r2= 1.80, r3= 2.99, r4= 3.49,  &end
#
# 560 ASP H 576 GLU QB 4.71  (#peak 45 #SUP 0.46 #QF 0.46 )
 &rst
  ixpk= 45, nxpk= 0, iat= 134,  -1, r1= 1.30, r2= 1.80, r3= 5.29, r4= 5.79,
 igr2= 407, 408,
 &end
#
# 578 GLU H 590 LYS H 3.84  (#peak 49 #SUP 0.45 #QF 0.45 )
 &rst
  ixpk= 49, nxpk= 0, iat= 436, 599, r1= 1.30, r2= 1.80, r3= 3.84, r4= 4.34,  &end
#
# 589 VAL H 590 LYS H 4.38  (#peak 51 #SUP 0.80 #QF 0.80 )
 &rst
  ixpk= 51, nxpk= 0, iat= 581, 599, r1= 1.30, r2= 1.80, r3= 4.38, r4= 4.88,  &end
#
# 561 GLU H 577 VAL H 4.63  (#peak 52 #SUP 0.27 #QF 0.27 )
 &rst
  ixpk= 52, nxpk= 0, iat= 147, 418, r1= 1.30, r2= 1.80, r3= 4.63, r4= 5.13,  &end
#
# 590 LYS H 598 GLU H 5.20  (#peak 53 #SUP 0.62 #QF 0.62 )
 &rst
  ixpk= 53, nxpk= 0, iat= 599, 735, r1= 1.30, r2= 1.80, r3= 5.20, r4= 5.70,  &end
#
# 576 GLU H 590 LYS H 3.83  (#peak 55 #SUP 0.74 #QF 0.74 )
 &rst
  ixpk= 55, nxpk= 0, iat= 405, 599, r1= 1.30, r2= 1.80, r3= 3.83, r4= 4.33,  &end
#
# 560 ASP H 561 GLU H 3.92  (#peak 56 #SUP 0.85 #QF 0.85 )
 &rst
  ixpk= 56, nxpk= 0, iat= 134, 147, r1= 1.30, r2= 1.80, r3= 3.92, r4= 4.42,  &end
#
# 589 VAL HA 590 LYS H 2.87  (#peak 57 #SUP 0.80 #QF 0.80 )
 &rst
  ixpk= 57, nxpk= 0, iat= 582, 599, r1= 1.30, r2= 1.80, r3= 2.87, r4= 3.37,  &end
#
# 560 ASP HA 561 GLU H 2.65  (#peak 58 #SUP 0.70 #QF 0.70 )
 &rst
  ixpk= 58, nxpk= 0, iat= 135, 147, r1= 1.30, r2= 1.80, r3= 2.65, r4= 3.15,  &end
#
# 577 VAL HA 590 LYS H 3.96  (#peak 60 #SUP 0.47 #QF 0.47 )
 &rst
  ixpk= 60, nxpk= 0, iat= 419, 599, r1= 1.30, r2= 1.80, r3= 3.96, r4= 4.46,  &end
#
# 560 ASP QB 561 GLU H 3.93  (#peak 63 #SUP 0.81 #QF 0.81 )
 &rst
  ixpk= 63, nxpk= 0, iat=  -1, 147, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,
 igr1= 136, 137,
 &end
#
# 561 GLU H 561 GLU QG 3.53  (#peak 64 #SUP 0.91 #QF 0.91 )
 &rst
  ixpk= 64, nxpk= 0, iat= 147,  -1, r1= 1.30, r2= 1.80, r3= 3.96, r4= 4.46,
 igr2= 151, 152,
 &end
#
# 561 GLU H 561 GLU QB 2.95  (#peak 67 #SUP 0.83 #QF 0.83 )
 &rst
  ixpk= 67, nxpk= 0, iat= 147,  -1, r1= 1.30, r2= 1.80, r3= 3.31, r4= 3.81,
 igr2= 149, 150,
 &end
#
# 561 GLU H 576 GLU QB 5.05  (#peak 68 #SUP 0.47 #QF 0.47 )
 &rst
  ixpk= 68, nxpk= 0, iat= 147,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr2= 407, 408,
 &end
#
# 576 GLU QB 590 LYS H 4.02  (#peak 69 #SUP 0.66 #QF 0.66 )
 &rst
  ixpk= 69, nxpk= 0, iat=  -1, 599, r1= 1.30, r2= 1.80, r3= 4.51, r4= 5.01,
 igr1= 407, 408,
 &end
#
# 589 VAL HB 590 LYS H 3.34  (#peak 71 #SUP 0.81 #QF 0.81 )
 &rst
  ixpk= 71, nxpk= 0, iat= 583, 599, r1= 1.30, r2= 1.80, r3= 3.34, r4= 3.84,  &end
#
# 590 LYS H 590 LYS HB2 3.78  (#peak 73 #SUP 0.84 #QF 0.84 )
 &rst
  ixpk= 73, nxpk= 0, iat= 599, 601, r1= 1.30, r2= 1.80, r3= 3.78, r4= 4.28,  &end
#
# 590 LYS H 590 LYS HG2 4.37  (#peak 79 #SUP 0.77 #QF 0.77 )
 &rst
  ixpk= 79, nxpk= 0, iat= 599, 603, r1= 1.30, r2= 1.80, r3= 4.37, r4= 4.87,  &end
#
# 562 CYS H 575 ALA H 3.64  (#peak 84 #SUP 0.95 #QF 0.95 )
 &rst
  ixpk= 84, nxpk= 0, iat= 159, 391, r1= 1.30, r2= 1.80, r3= 3.64, r4= 4.14,  &end
#
# 561 GLU HA 562 CYS H 2.82  (#peak 87 #SUP 0.94 #QF 0.94 )
 &rst
  ixpk= 87, nxpk= 0, iat= 148, 159, r1= 1.30, r2= 1.80, r3= 2.82, r4= 3.32,  &end
#
# 561 GLU QG 562 CYS H 4.95  (#peak 92 #SUP 0.99 #QF 0.64 )
 &rst
  ixpk= 92, nxpk= 0, iat=  -1, 159, r1= 1.30, r2= 1.80, r3= 5.56, r4= 6.06,
 igr1= 151, 152,
 &end
#
# 561 GLU QB 562 CYS H 3.44  (#peak 94 #SUP 0.80 #QF 0.80 )
 &rst
  ixpk= 94, nxpk= 0, iat=  -1, 159, r1= 1.30, r2= 1.80, r3= 3.86, r4= 4.36,
 igr1= 149, 150,
 &end
#
# 562 CYS H 592 ILE QD1 3.72  (#peak 95 #SUP 0.67 #QF 0.67 )
 &rst
  ixpk= 95, nxpk= 0, iat= 159,  -1, r1= 1.30, r2= 1.80, r3= 4.47, r4= 4.97,
 igr2= 648, 649, 650,
 &end
#
# 563 PHE H 606 LYS H 3.96  (#peak 98 #SUP 0.91 #QF 0.91 )
 &rst
  ixpk= 98, nxpk= 0, iat= 175, 863, r1= 1.30, r2= 1.80, r3= 3.96, r4= 4.46,  &end
#
# 556 TRP HZ2 563 PHE H 4.99  (#peak 100 #SUP 0.89 #QF 0.89 )
 &rst
  ixpk= 100, nxpk= 0, iat=  80, 175, r1= 1.30, r2= 1.80, r3= 4.99, r4= 5.49,  &end
#
# 563 PHE H 563 PHE QD 4.06  (#peak 101 #SUP 0.83 #QF 0.83 )
 &rst
  ixpk= 101, nxpk= 0, iat= 175,  -1, r1= 1.30, r2= 1.80, r3= 4.56, r4= 5.06,
 igr2= 179, 180,
 &end
#
# 562 CYS HA 563 PHE H 2.99  (#peak 104 #SUP 0.91 #QF 0.91 )
 &rst
  ixpk= 104, nxpk= 0, iat= 160, 175, r1= 1.30, r2= 1.80, r3= 2.99, r4= 3.49,  &end
#
# 562 CYS HB2 563 PHE H 3.60  (#peak 105 #SUP 0.98 #QF 0.96 )
 &rst
  ixpk= 105, nxpk= 0, iat= 161, 175, r1= 1.30, r2= 1.80, r3= 3.60, r4= 4.10,  &end
#
# 563 PHE H 563 PHE HB3 4.05  (#peak 105 #SUP 0.98 #QF 0.96 )
 &rst
  ixpk= 105, nxpk= 0, iat= 175, 178, r1= 1.30, r2= 1.80, r3= 4.05, r4= 4.55,  &end
#
# 562 CYS HB3 563 PHE H 3.60  (#peak 106 #SUP 0.82 #QF 0.82 )
 &rst
  ixpk= 106, nxpk= 0, iat= 162, 175, r1= 1.30, r2= 1.80, r3= 3.60, r4= 4.10,  &end
#
# 563 PHE H 605 ILE QG2 4.13  (#peak 110 #SUP 0.84 #QF 0.84 )
 &rst
  ixpk= 110, nxpk= 0, iat= 175,  -1, r1= 1.30, r2= 1.80, r3= 4.96, r4= 5.46,
 igr2= 848, 849, 850,
 &end
#
# 564 ALA H 573 TYR H 3.64  (#peak 112 #SUP 0.84 #QF 0.84 )
 &rst
  ixpk= 112, nxpk= 0, iat= 189, 353, r1= 1.30, r2= 1.80, r3= 3.64, r4= 4.14,  &end
#
# 564 ALA H 573 TYR QD 5.25  (#peak 114 #SUP 0.63 #QF 0.63 )
 &rst
  ixpk= 114, nxpk= 0, iat= 189,  -1, r1= 1.30, r2= 1.80, r3= 5.89, r4= 6.39,
 igr2= 357, 358,
 &end
#
# 563 PHE QD 564 ALA H 3.97  (#peak 116 #SUP 0.47 #QF 0.47 )
 &rst
  ixpk= 116, nxpk= 0, iat=  -1, 189, r1= 1.30, r2= 1.80, r3= 4.46, r4= 4.96,
 igr1= 179, 180,
 &end
#
# 563 PHE HA 564 ALA H 2.91  (#peak 119 #SUP 0.85 #QF 0.85 )
 &rst
  ixpk= 119, nxpk= 0, iat= 176, 189, r1= 1.30, r2= 1.80, r3= 2.91, r4= 3.41,  &end
#
# 564 ALA H 574 ARG HA 4.32  (#peak 121 #SUP 0.32 #QF 0.32 )
 &rst
  ixpk= 121, nxpk= 0, iat= 189, 374, r1= 1.30, r2= 1.80, r3= 4.32, r4= 4.82,  &end
#
# 563 PHE HB3 564 ALA H 3.80  (#peak 122 #SUP 0.82 #QF 0.82 )
 &rst
  ixpk= 122, nxpk= 0, iat= 178, 189, r1= 1.30, r2= 1.80, r3= 3.80, r4= 4.30,  &end
#
# 564 ALA H 575 ALA QB 4.06  (#peak 124 #SUP 0.34 #QF 0.34 )
 &rst
  ixpk= 124, nxpk= 0, iat= 189,  -1, r1= 1.30, r2= 1.80, r3= 4.88, r4= 5.38,
 igr2= 393, 394, 395,
 &end
#
# 564 ALA H 589 VAL QG2 5.16  (#peak 125 #SUP 0.95 #QF 0.50 )
 &rst
  ixpk= 125, nxpk= 0, iat= 189,  -1, r1= 1.30, r2= 1.80, r3= 6.20, r4= 6.70,
 igr2= 587, 588, 589,
 &end
#
# 564 ALA H 605 ILE QG2 5.33  (#peak 125 #SUP 0.95 #QF 0.50 )
 &rst
  ixpk= 125, nxpk= 0, iat= 189,  -1, r1= 1.30, r2= 1.80, r3= 6.40, r4= 6.90,
 igr2= 848, 849, 850,
 &end
#
# 565 LEU H 606 LYS H 4.28  (#peak 126 #SUP 0.75 #QF 0.75 )
 &rst
  ixpk= 126, nxpk= 0, iat= 202, 863, r1= 1.30, r2= 1.80, r3= 4.28, r4= 4.78,  &end
#
# 565 LEU H 572 PHE QD 3.74  (#peak 128 #SUP 0.89 #QF 0.89 )
 &rst
  ixpk= 128, nxpk= 0, iat= 202,  -1, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
 igr2= 336, 337,
 &end
#
# 564 ALA HA 565 LEU H 2.82  (#peak 129 #SUP 0.95 #QF 0.95 )
 &rst
  ixpk= 129, nxpk= 0, iat= 190, 202, r1= 1.30, r2= 1.80, r3= 2.82, r4= 3.32,  &end
#
# 565 LEU H 605 ILE HA 3.68  (#peak 130 #SUP 0.95 #QF 0.95 )
 &rst
  ixpk= 130, nxpk= 0, iat= 202, 844, r1= 1.30, r2= 1.80, r3= 3.68, r4= 4.18,  &end
#
# 565 LEU H 604 ASN HB3 4.48  (#peak 132 #SUP 0.94 #QF 0.94 )
 &rst
  ixpk= 132, nxpk= 0, iat= 202, 832, r1= 1.30, r2= 1.80, r3= 4.48, r4= 4.98,  &end
#
# 565 LEU H 565 LEU HB2 3.08  (#peak 133 #SUP 0.85 #QF 0.85 )
 &rst
  ixpk= 133, nxpk= 0, iat= 202, 204, r1= 1.30, r2= 1.80, r3= 3.08, r4= 3.58,  &end
#
# 565 LEU H 565 LEU HB3 3.11  (#peak 135 #SUP 0.91 #QF 0.91 )
 &rst
  ixpk= 135, nxpk= 0, iat= 202, 205, r1= 1.30, r2= 1.80, r3= 3.11, r4= 3.61,  &end
#
# 565 LEU H 605 ILE QG2 4.22  (#peak 136 #SUP 0.97 #QF 0.97 )
 &rst
  ixpk= 136, nxpk= 0, iat= 202,  -1, r1= 1.30, r2= 1.80, r3= 5.07, r4= 5.57,
 igr2= 848, 849, 850,
 &end
#
# 565 LEU H 565 LEU QD1 4.77  (#peak 137 #SUP 0.78 #QF 0.78 )
 &rst
  ixpk= 137, nxpk= 0, iat= 202,  -1, r1= 1.30, r2= 1.80, r3= 5.73, r4= 6.23,
 igr2= 207, 208, 209,
 &end
#
# 566 TYR H 566 TYR HB3 4.02  (#peak 141 #SUP 0.79 #QF 0.79 )
 &rst
  ixpk= 141, nxpk= 0, iat= 225, 228, r1= 1.30, r2= 1.80, r3= 4.02, r4= 4.52,  &end
#
# 566 TYR HA 567 TRP H 3.19  (#peak 147 #SUP 0.56 #QF 0.56 )
 &rst
  ixpk= 147, nxpk= 0, iat= 226, 248, r1= 1.30, r2= 1.80, r3= 3.19, r4= 3.69,  &end
#
# 567 TRP H 568 GLU H 4.12  (#peak 149 #SUP 0.75 #QF 0.75 )
 &rst
  ixpk= 149, nxpk= 0, iat= 248, 267, r1= 1.30, r2= 1.80, r3= 4.12, r4= 4.62,  &end
#
# 567 TRP H 567 TRP HB2 3.86  (#peak 150 #SUP 0.89 #QF 0.89 )
 &rst
  ixpk= 150, nxpk= 0, iat= 248, 250, r1= 1.30, r2= 1.80, r3= 3.86, r4= 4.36,  &end
#
# 567 TRP H 567 TRP HB3 3.45  (#peak 151 #SUP 0.89 #QF 0.89 )
 &rst
  ixpk= 151, nxpk= 0, iat= 248, 251, r1= 1.30, r2= 1.80, r3= 3.45, r4= 3.95,  &end
#
# 569 ASP H 570 ASN H 2.90  (#peak 153 #SUP 0.92 #QF 0.92 )
 &rst
  ixpk= 153, nxpk= 0, iat= 281, 293, r1= 1.30, r2= 1.80, r3= 2.90, r4= 3.40,  &end
#
# 569 ASP H 571 LYS H 3.83  (#peak 155 #SUP 0.94 #QF 0.94 )
 &rst
  ixpk= 155, nxpk= 0, iat= 281, 308, r1= 1.30, r2= 1.80, r3= 3.83, r4= 4.33,  &end
#
# 568 GLU QG 569 ASP H 3.59  (#peak 171 #SUP 0.99 #QF 0.80 )
 &rst
  ixpk= 171, nxpk= 0, iat=  -1, 281, r1= 1.30, r2= 1.80, r3= 4.03, r4= 4.53,
 igr1= 271, 272,
 &end
#
# 569 ASP H 569 ASP HB2 4.00  (#peak 175 #SUP 0.59 #QF 0.59 )
 &rst
  ixpk= 175, nxpk= 0, iat= 281, 283, r1= 1.30, r2= 1.80, r3= 4.00, r4= 4.50,  &end
#
# 568 GLU HB2 569 ASP H 3.98  (#peak 176 #SUP 0.99 #QF 0.99 )
 &rst
  ixpk= 176, nxpk= 0, iat= 269, 281, r1= 1.30, r2= 1.80, r3= 3.98, r4= 4.48,  &end
#
# 568 GLU HB3 569 ASP H 4.04  (#peak 177 #SUP 0.97 #QF 0.97 )
 &rst
  ixpk= 177, nxpk= 0, iat= 270, 281, r1= 1.30, r2= 1.80, r3= 4.04, r4= 4.54,  &end
#
# 570 ASN H 571 LYS H 3.28  (#peak 180 #SUP 0.98 #QF 0.98 )
 &rst
  ixpk= 180, nxpk= 0, iat= 293, 308, r1= 1.30, r2= 1.80, r3= 3.28, r4= 3.78,  &end
#
# 570 ASN H 573 TYR QE 4.77  (#peak 182 #SUP 0.54 #QF 0.54 )
 &rst
  ixpk= 182, nxpk= 0, iat= 293,  -1, r1= 1.30, r2= 1.80, r3= 5.35, r4= 5.85,
 igr2= 359, 360,
 &end
#
# 570 ASN H 570 ASN HB3 3.91  (#peak 186 #SUP 1.00   )
 &rst
  ixpk= 186, nxpk= 0, iat= 293, 296, r1= 1.30, r2= 1.80, r3= 3.91, r4= 4.41,  &end
#
# 568 GLU QG 570 ASN H 4.92  (#peak 187 #SUP 0.99 #QF 0.84 )
 &rst
  ixpk= 187, nxpk= 0, iat=  -1, 293, r1= 1.30, r2= 1.80, r3= 5.52, r4= 6.02,
 igr1= 271, 272,
 &end
#
# 568 GLU HA 570 ASN H 5.09  (#peak 188 #SUP 0.97 #QF 0.88 )
 &rst
  ixpk= 188, nxpk= 0, iat= 268, 293, r1= 1.30, r2= 1.80, r3= 5.09, r4= 5.59,  &end
#
# 570 ASN H 570 ASN HB2 3.78  (#peak 189 #SUP 0.98 #QF 0.98 )
 &rst
  ixpk= 189, nxpk= 0, iat= 293, 295, r1= 1.30, r2= 1.80, r3= 3.78, r4= 4.28,  &end
#
# 566 TYR H 571 LYS H 4.12  (#peak 192 #SUP 0.95 #QF 0.95 )
 &rst
  ixpk= 192, nxpk= 0, iat= 225, 308, r1= 1.30, r2= 1.80, r3= 4.12, r4= 4.62,  &end
#
# 571 LYS H 573 TYR QE 3.70  (#peak 195 #SUP 0.80 #QF 0.80 )
 &rst
  ixpk= 195, nxpk= 0, iat= 308,  -1, r1= 1.30, r2= 1.80, r3= 4.15, r4= 4.65,
 igr2= 359, 360,
 &end
#
# 566 TYR HB2 571 LYS H 4.56  (#peak 199 #SUP 0.98 #QF 0.98 )
 &rst
  ixpk= 199, nxpk= 0, iat= 227, 308, r1= 1.30, r2= 1.80, r3= 4.56, r4= 5.06,  &end
#
# 566 TYR HB3 571 LYS H 4.56  (#peak 200 #SUP 0.99 #QF 0.89 )
 &rst
  ixpk= 200, nxpk= 0, iat= 228, 308, r1= 1.30, r2= 1.80, r3= 4.56, r4= 5.06,  &end
#
# 573 TYR H 573 TYR QD 4.16  (#peak 209 #SUP 0.99 #QF 0.99 )
 &rst
  ixpk= 209, nxpk= 0, iat= 353,  -1, r1= 1.30, r2= 1.80, r3= 4.67, r4= 5.17,
 igr2= 357, 358,
 &end
#
# 563 PHE QD 573 TYR H 4.58  (#peak 210 #SUP 0.96 #QF 0.96 )
 &rst
  ixpk= 210, nxpk= 0, iat=  -1, 353, r1= 1.30, r2= 1.80, r3= 5.14, r4= 5.64,
 igr1= 179, 180,
 &end
#
# 573 TYR H 573 TYR HB2 4.08  (#peak 214 #SUP 0.99 #QF 0.99 )
 &rst
  ixpk= 214, nxpk= 0, iat= 353, 355, r1= 1.30, r2= 1.80, r3= 4.08, r4= 4.58,  &end
#
# 572 PHE HB2 573 TYR H 4.34  (#peak 215 #SUP 0.99 #QF 0.99 )
 &rst
  ixpk= 215, nxpk= 0, iat= 334, 353, r1= 1.30, r2= 1.80, r3= 4.34, r4= 4.84,  &end
#
# 572 PHE HB3 573 TYR H 4.19  (#peak 216 #SUP 0.94 #QF 0.94 )
 &rst
  ixpk= 216, nxpk= 0, iat= 335, 353, r1= 1.30, r2= 1.80, r3= 4.19, r4= 4.69,  &end
#
# 587 ALA H 602 LEU H 5.01  (#peak 220 #SUP 0.80 #QF 0.80 )
 &rst
  ixpk= 220, nxpk= 0, iat= 553, 799, r1= 1.30, r2= 1.80, r3= 5.01, r4= 5.51,  &end
#
# 573 TYR QD 574 ARG H 4.24  (#peak 222 #SUP 0.94 #QF 0.94 )
 &rst
  ixpk= 222, nxpk= 0, iat=  -1, 373, r1= 1.30, r2= 1.80, r3= 4.76, r4= 5.26,
 igr1= 357, 358,
 &end
#
# 586 THR H 587 ALA H 5.14  (#peak 223 #SUP 0.93 #QF 0.83 )
 &rst
  ixpk= 223, nxpk= 0, iat= 541, 553, r1= 1.30, r2= 1.80, r3= 5.14, r4= 5.64,  &end
#
# 563 PHE QD 574 ARG H 5.21  (#peak 225 #SUP 0.89 #QF 0.74 )
 &rst
  ixpk= 225, nxpk= 0, iat=  -1, 373, r1= 1.30, r2= 1.80, r3= 5.85, r4= 6.35,
 igr1= 179, 180,
 &end
#
# 563 PHE QE 574 ARG H 5.40  (#peak 225 #SUP 0.89 #QF 0.74 )
 &rst
  ixpk= 225, nxpk= 0, iat=  -1, 373, r1= 1.30, r2= 1.80, r3= 6.06, r4= 6.56,
 igr1= 181, 182,
 &end
#
# 587 ALA H 601 LEU HA 4.34  (#peak 229 #SUP 0.93 #QF 0.93 )
 &rst
  ixpk= 229, nxpk= 0, iat= 553, 781, r1= 1.30, r2= 1.80, r3= 4.34, r4= 4.84,  &end
#
# 573 TYR HB3 574 ARG H 3.32  (#peak 233 #SUP 0.87 #QF 0.87 )
 &rst
  ixpk= 233, nxpk= 0, iat= 356, 373, r1= 1.30, r2= 1.80, r3= 3.32, r4= 3.82,  &end
#
# 573 TYR HB2 574 ARG H 4.09  (#peak 234 #SUP 0.91 #QF 0.91 )
 &rst
  ixpk= 234, nxpk= 0, iat= 355, 373, r1= 1.30, r2= 1.80, r3= 4.09, r4= 4.59,  &end
#
# 563 PHE HA 575 ALA H 3.97  (#peak 243 #SUP 0.97 #QF 0.53 )
 &rst
  ixpk= 243, nxpk= 0, iat= 176, 391, r1= 1.30, r2= 1.80, r3= 3.97, r4= 4.47,  &end
#
# 575 ALA H 575 ALA QB 3.85  (#peak 249 #SUP 0.95 #QF 0.76 )
 &rst
  ixpk= 249, nxpk= 0, iat= 391,  -1, r1= 1.30, r2= 1.80, r3= 4.62, r4= 5.12,
 igr2= 393, 394, 395,
 &end
#
# 575 ALA H 592 ILE QD1 4.22  (#peak 249 #SUP 0.95 #QF 0.76 )
 &rst
  ixpk= 249, nxpk= 0, iat= 391,  -1, r1= 1.30, r2= 1.80, r3= 5.07, r4= 5.57,
 igr2= 648, 649, 650,
 &end
#
# 576 GLU H 592 ILE H 4.34  (#peak 252 #SUP 0.88 #QF 0.88 )
 &rst
  ixpk= 252, nxpk= 0, iat= 405, 640, r1= 1.30, r2= 1.80, r3= 4.34, r4= 4.84,  &end
#
# 572 PHE H 573 TYR QE 5.15  (#peak 253 #SUP 0.89 #QF 0.89 )
 &rst
  ixpk= 253, nxpk= 0, iat= 332,  -1, r1= 1.30, r2= 1.80, r3= 5.78, r4= 6.28,
 igr2= 359, 360,
 &end
#
# 575 ALA HA 576 GLU H 3.08  (#peak 255 #SUP 0.88 #QF 0.59 )
 &rst
  ixpk= 255, nxpk= 0, iat= 392, 405, r1= 1.30, r2= 1.80, r3= 3.08, r4= 3.58,  &end
#
# 572 PHE H 572 PHE HB2 3.29  (#peak 257 #SUP 0.93 #QF 0.93 )
 &rst
  ixpk= 257, nxpk= 0, iat= 332, 334, r1= 1.30, r2= 1.80, r3= 3.29, r4= 3.79,  &end
#
# 572 PHE H 572 PHE HB3 3.69  (#peak 258 #SUP 0.99 #QF 0.99 )
 &rst
  ixpk= 258, nxpk= 0, iat= 332, 335, r1= 1.30, r2= 1.80, r3= 3.69, r4= 4.19,  &end
#
# 571 LYS QD 572 PHE H 4.26  (#peak 259 #SUP 0.94 #QF 0.68 )
 &rst
  ixpk= 259, nxpk= 0, iat=  -1, 332, r1= 1.30, r2= 1.80, r3= 4.78, r4= 5.28,
 igr1= 314, 315,
 &end
#
# 576 GLU H 576 GLU QB 3.23  (#peak 260 #SUP 0.88 #QF 0.88 )
 &rst
  ixpk= 260, nxpk= 0, iat= 405,  -1, r1= 1.30, r2= 1.80, r3= 3.63, r4= 4.13,
 igr2= 407, 408,
 &end
#
# 571 LYS HB3 572 PHE H 3.50  (#peak 261 #SUP 0.82 #QF 0.57 )
 &rst
  ixpk= 261, nxpk= 0, iat= 311, 332, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
# 576 GLU H 592 ILE HG13 3.94  (#peak 261 #SUP 0.82 #QF 0.57 )
 &rst
  ixpk= 261, nxpk= 0, iat= 405, 644, r1= 1.30, r2= 1.80, r3= 3.94, r4= 4.44,  &end
#
# 576 GLU H 592 ILE HG12 3.83  (#peak 262 #SUP 0.70 #QF 0.70 )
 &rst
  ixpk= 262, nxpk= 0, iat= 405, 643, r1= 1.30, r2= 1.80, r3= 3.83, r4= 4.33,  &end
#
# 575 ALA QB 576 GLU H 3.49  (#peak 263 #SUP 0.87 #QF 0.59 )
 &rst
  ixpk= 263, nxpk= 0, iat=  -1, 405, r1= 1.30, r2= 1.80, r3= 4.19, r4= 4.69,
 igr1= 393, 394, 395,
 &end
#
# 576 GLU H 592 ILE QD1 3.70  (#peak 263 #SUP 0.87 #QF 0.59 )
 &rst
  ixpk= 263, nxpk= 0, iat= 405,  -1, r1= 1.30, r2= 1.80, r3= 4.44, r4= 4.94,
 igr2= 648, 649, 650,
 &end
#
# 577 VAL H 578 GLU H 4.78  (#peak 264 #SUP 0.88 #QF 0.88 )
 &rst
  ixpk= 264, nxpk= 0, iat= 418, 436, r1= 1.30, r2= 1.80, r3= 4.78, r4= 5.28,  &end
#
# 562 CYS H 577 VAL H 4.24  (#peak 266 #SUP 0.68 #QF 0.68 )
 &rst
  ixpk= 266, nxpk= 0, iat= 159, 418, r1= 1.30, r2= 1.80, r3= 4.24, r4= 4.74,  &end
#
# 576 GLU H 577 VAL H 4.45  (#peak 267 #SUP 0.93 #QF 0.93 )
 &rst
  ixpk= 267, nxpk= 0, iat= 405, 418, r1= 1.30, r2= 1.80, r3= 4.45, r4= 4.95,  &end
#
# 576 GLU HA 577 VAL H 2.89  (#peak 271 #SUP 0.98 #QF 0.98 )
 &rst
  ixpk= 271, nxpk= 0, iat= 406, 418, r1= 1.30, r2= 1.80, r3= 2.89, r4= 3.39,  &end
#
# 559 GLY HA2 577 VAL H 5.43  (#peak 275 #SUP 0.84 #QF 0.84 )
 &rst
  ixpk= 275, nxpk= 0, iat= 124, 418, r1= 1.30, r2= 1.80, r3= 5.43, r4= 5.93,  &end
#
# 577 VAL H 577 VAL HB 3.22  (#peak 277 #SUP 0.93 #QF 0.93 )
 &rst
  ixpk= 277, nxpk= 0, iat= 418, 420, r1= 1.30, r2= 1.80, r3= 3.22, r4= 3.72,  &end
#
# 561 GLU QB 577 VAL H 4.70  (#peak 278 #SUP 0.85 #QF 0.31 )
 &rst
  ixpk= 278, nxpk= 0, iat=  -1, 418, r1= 1.30, r2= 1.80, r3= 5.28, r4= 5.78,
 igr1= 149, 150,
 &end
#
# 578 GLU H 578 GLU QG 4.41  (#peak 289 #SUP 0.84 #QF 0.84 )
 &rst
  ixpk= 289, nxpk= 0, iat= 436,  -1, r1= 1.30, r2= 1.80, r3= 4.95, r4= 5.45,
 igr2= 440, 441,
 &end
#
# 578 GLU H 588 VAL HB 3.89  (#peak 291 #SUP 0.86 #QF 0.86 )
 &rst
  ixpk= 291, nxpk= 0, iat= 436, 567, r1= 1.30, r2= 1.80, r3= 3.89, r4= 4.39,  &end
#
# 578 GLU H 579 ALA H 3.08  (#peak 293 #SUP 0.89 #QF 0.89 )
 &rst
  ixpk= 293, nxpk= 0, iat= 436, 447, r1= 1.30, r2= 1.80, r3= 3.08, r4= 3.58,  &end
#
# 579 ALA H 588 VAL H 3.53  (#peak 295 #SUP 0.99 #QF 0.99 )
 &rst
  ixpk= 295, nxpk= 0, iat= 447, 565, r1= 1.30, r2= 1.80, r3= 3.53, r4= 4.03,  &end
#
# 579 ALA H 589 VAL HA 4.18  (#peak 299 #SUP 0.80 #QF 0.80 )
 &rst
  ixpk= 299, nxpk= 0, iat= 447, 582, r1= 1.30, r2= 1.80, r3= 4.18, r4= 4.68,  &end
#
# 579 ALA H 588 VAL HB 2.92  (#peak 303 #SUP 0.95 #QF 0.95 )
 &rst
  ixpk= 303, nxpk= 0, iat= 447, 567, r1= 1.30, r2= 1.80, r3= 2.92, r4= 3.42,  &end
#
# 579 ALA H 588 VAL QG1 4.32  (#peak 305 #SUP 0.99 #QF 0.39 )
 &rst
  ixpk= 305, nxpk= 0, iat= 447,  -1, r1= 1.30, r2= 1.80, r3= 5.19, r4= 5.69,
 igr2= 568, 569, 570,
 &end
#
# 579 ALA H 588 VAL QG2 4.51  (#peak 305 #SUP 0.99 #QF 0.39 )
 &rst
  ixpk= 305, nxpk= 0, iat= 447,  -1, r1= 1.30, r2= 1.80, r3= 5.42, r4= 5.92,
 igr2= 571, 572, 573,
 &end
#
# 557 LYS HA 580 LEU H 4.19  (#peak 311 #SUP 0.34 #QF 0.34 )
 &rst
  ixpk= 311, nxpk= 0, iat=  93, 460, r1= 1.30, r2= 1.80, r3= 4.19, r4= 4.69,  &end
#
# 580 LEU H 580 LEU QB 3.49  (#peak 314 #SUP 0.88 #QF 0.52 )
 &rst
  ixpk= 314, nxpk= 0, iat= 460,  -1, r1= 1.30, r2= 1.80, r3= 3.92, r4= 4.42,
 igr2= 462, 463,
 &end
#
# 580 LEU H 580 LEU HG 3.68  (#peak 314 #SUP 0.88 #QF 0.52 )
 &rst
  ixpk= 314, nxpk= 0, iat= 460, 464, r1= 1.30, r2= 1.80, r3= 3.68, r4= 4.18,  &end
#
# 580 LEU H 580 LEU QD1 4.63  (#peak 317 #SUP 0.91 #QF 0.62 )
 &rst
  ixpk= 317, nxpk= 0, iat= 460,  -1, r1= 1.30, r2= 1.80, r3= 5.56, r4= 6.06,
 igr2= 465, 466, 467,
 &end
#
# 580 LEU H 580 LEU QD2 4.63  (#peak 318 #SUP 0.68 #QF 0.68 )
 &rst
  ixpk= 318, nxpk= 0, iat= 460,  -1, r1= 1.30, r2= 1.80, r3= 5.56, r4= 6.06,
 igr2= 468, 469, 470,
 &end
#
# 580 LEU HA 581 HIS H 2.82  (#peak 329 #SUP 0.76 #QF 0.76 )
 &rst
  ixpk= 329, nxpk= 0, iat= 461, 481, r1= 1.30, r2= 1.80, r3= 2.82, r4= 3.32,  &end
#
# 580 LEU QB 581 HIS H 3.90  (#peak 334 #SUP 0.84 #QF 0.84 )
 &rst
  ixpk= 334, nxpk= 0, iat=  -1, 481, r1= 1.30, r2= 1.80, r3= 4.38, r4= 4.88,
 igr1= 462, 463,
 &end
#
# 602 LEU H 603 SER H 3.86  (#peak 337 #SUP 0.98 #QF 0.98 )
 &rst
  ixpk= 337, nxpk= 0, iat= 799, 816, r1= 1.30, r2= 1.80, r3= 3.86, r4= 4.36,  &end
#
# 603 SER H 605 ILE H 4.51  (#peak 340 #SUP 0.87 #QF 0.87 )
 &rst
  ixpk= 340, nxpk= 0, iat= 816, 843, r1= 1.30, r2= 1.80, r3= 4.51, r4= 5.01,  &end
#
# 601 LEU HG 603 SER H 3.54  (#peak 345 #SUP 0.87 #QF 0.33 )
 &rst
  ixpk= 345, nxpk= 0, iat= 784, 816, r1= 1.30, r2= 1.80, r3= 3.54, r4= 4.04,  &end
#
# 602 LEU QB 603 SER H 3.43  (#peak 345 #SUP 0.87 #QF 0.33 )
 &rst
  ixpk= 345, nxpk= 0, iat=  -1, 816, r1= 1.30, r2= 1.80, r3= 3.85, r4= 4.35,
 igr1= 801, 802,
 &end
#
# 602 LEU HG 603 SER H 4.48  (#peak 347 #SUP 0.79 #QF 0.79 )
 &rst
  ixpk= 347, nxpk= 0, iat= 803, 816, r1= 1.30, r2= 1.80, r3= 4.48, r4= 4.98,  &end
#
# 601 LEU QQD 603 SER H 3.98  (#peak 348 #SUP 0.72 #QF 0.72 )
 &rst
  ixpk= 348, nxpk= 0, iat= 777, 816, r1= 1.30, r2= 1.80, r3= 6.18, r4= 6.68,  &end
#
# 585 MET H 585 MET QB 3.92  (#peak 361 #SUP 0.97 #QF 0.97 )
 &rst
  ixpk= 361, nxpk= 0, iat= 525,  -1, r1= 1.30, r2= 1.80, r3= 4.40, r4= 4.90,
 igr2= 527, 528,
 &end
#
# 585 MET H 586 THR H 3.83  (#peak 363 #SUP 0.74 #QF 0.74 )
 &rst
  ixpk= 363, nxpk= 0, iat= 525, 541, r1= 1.30, r2= 1.80, r3= 3.83, r4= 4.33,  &end
#
# 585 MET QB 586 THR H 4.23  (#peak 368 #SUP 0.96 #QF 0.91 )
 &rst
  ixpk= 368, nxpk= 0, iat=  -1, 541, r1= 1.30, r2= 1.80, r3= 4.75, r4= 5.25,
 igr1= 527, 528,
 &end
#
# 585 MET QE 586 THR H 4.78  (#peak 368 #SUP 0.96 #QF 0.91 )
 &rst
  ixpk= 368, nxpk= 0, iat=  -1, 541, r1= 1.30, r2= 1.80, r3= 5.74, r4= 6.24,
 igr1= 531, 532, 533,
 &end
#
# 578 GLU H 588 VAL H 4.78  (#peak 371 #SUP 0.84 #QF 0.84 )
 &rst
  ixpk= 371, nxpk= 0, iat= 436, 565, r1= 1.30, r2= 1.80, r3= 4.78, r4= 5.28,  &end
#
# 587 ALA H 588 VAL H 4.92  (#peak 373 #SUP 0.87 #QF 0.53 )
 &rst
  ixpk= 373, nxpk= 0, iat= 553, 565, r1= 1.30, r2= 1.80, r3= 4.92, r4= 5.42,  &end
#
# 588 VAL H 589 VAL H 5.29  (#peak 373 #SUP 0.87 #QF 0.53 )
 &rst
  ixpk= 373, nxpk= 0, iat= 565, 581, r1= 1.30, r2= 1.80, r3= 5.29, r4= 5.79,  &end
#
# 581 HIS H 588 VAL H 4.55  (#peak 374 #SUP 0.63 #QF 0.63 )
 &rst
  ixpk= 374, nxpk= 0, iat= 481, 565, r1= 1.30, r2= 1.80, r3= 4.55, r4= 5.05,  &end
#
# 596 ASN HA 597 TYR H 2.95  (#peak 377 #SUP 0.90 #QF 0.74 )
 &rst
  ixpk= 377, nxpk= 0, iat= 700, 717, r1= 1.30, r2= 1.80, r3= 2.95, r4= 3.45,  &end
#
# 597 TYR H 597 TYR HB2 4.06  (#peak 378 #SUP 0.97 #QF 0.97 )
 &rst
  ixpk= 378, nxpk= 0, iat= 717, 719, r1= 1.30, r2= 1.80, r3= 4.06, r4= 4.56,  &end
#
# 588 VAL H 588 VAL HB 3.38  (#peak 380 #SUP 0.98 #QF 0.98 )
 &rst
  ixpk= 380, nxpk= 0, iat= 565, 567, r1= 1.30, r2= 1.80, r3= 3.38, r4= 3.88,  &end
#
# 577 VAL QG1 588 VAL H 4.87  (#peak 383 #SUP 0.34 #QF 0.34 )
 &rst
  ixpk= 383, nxpk= 0, iat=  -1, 565, r1= 1.30, r2= 1.80, r3= 5.85, r4= 6.35,
 igr1= 421, 422, 423,
 &end
#
# 589 VAL H 598 GLU H 3.69  (#peak 386 #SUP 0.79 #QF 0.79 )
 &rst
  ixpk= 386, nxpk= 0, iat= 581, 735, r1= 1.30, r2= 1.80, r3= 3.69, r4= 4.19,  &end
#
# 589 VAL H 597 TYR HA 4.49  (#peak 389 #SUP 0.59 #QF 0.59 )
 &rst
  ixpk= 389, nxpk= 0, iat= 581, 718, r1= 1.30, r2= 1.80, r3= 4.49, r4= 4.99,  &end
#
# 588 VAL HA 589 VAL H 2.79  (#peak 393 #SUP 0.75 #QF 0.75 )
 &rst
  ixpk= 393, nxpk= 0, iat= 566, 581, r1= 1.30, r2= 1.80, r3= 2.79, r4= 3.29,  &end
#
# 589 VAL H 590 LYS HA 4.86  (#peak 396 #SUP 0.49 #QF 0.49 )
 &rst
  ixpk= 396, nxpk= 0, iat= 581, 600, r1= 1.30, r2= 1.80, r3= 4.86, r4= 5.36,  &end
#
# 578 GLU QB 589 VAL H 4.93  (#peak 398 #SUP 0.54 #QF 0.54 )
 &rst
  ixpk= 398, nxpk= 0, iat=  -1, 581, r1= 1.30, r2= 1.80, r3= 5.53, r4= 6.03,
 igr1= 438, 439,
 &end
#
# 589 VAL H 600 VAL QQG 4.57  (#peak 400 #SUP 0.59 #QF 0.59 )
 &rst
  ixpk= 400, nxpk= 0, iat= 581, 760, r1= 1.30, r2= 1.80, r3= 6.77, r4= 7.27,  &end
#
# 589 VAL H 589 VAL QG2 3.03  (#peak 404 #SUP 0.96 #QF 0.96 )
 &rst
  ixpk= 404, nxpk= 0, iat= 581,  -1, r1= 1.30, r2= 1.80, r3= 3.64, r4= 4.14,
 igr2= 587, 588, 589,
 &end
#
# 591 PHE H 591 PHE QD 3.81  (#peak 408 #SUP 0.53 #QF 0.53 )
 &rst
  ixpk= 408, nxpk= 0, iat= 623,  -1, r1= 1.30, r2= 1.80, r3= 4.28, r4= 4.78,
 igr2= 627, 628,
 &end
#
# 591 PHE H 597 TYR HA 3.73  (#peak 409 #SUP 0.72 #QF 0.72 )
 &rst
  ixpk= 409, nxpk= 0, iat= 623, 718, r1= 1.30, r2= 1.80, r3= 3.73, r4= 4.23,  &end
#
# 590 LYS HA 591 PHE H 2.95  (#peak 410 #SUP 0.65 #QF 0.65 )
 &rst
  ixpk= 410, nxpk= 0, iat= 600, 623, r1= 1.30, r2= 1.80, r3= 2.95, r4= 3.45,  &end
#
# 591 PHE H 591 PHE QB 3.07  (#peak 412 #SUP 0.88 #QF 0.88 )
 &rst
  ixpk= 412, nxpk= 0, iat= 623,  -1, r1= 1.30, r2= 1.80, r3= 3.45, r4= 3.95,
 igr2= 625, 626,
 &end
#
# 590 LYS HG2 591 PHE H 4.32  (#peak 413 #SUP 0.91 #QF 0.91 )
 &rst
  ixpk= 413, nxpk= 0, iat= 603, 623, r1= 1.30, r2= 1.80, r3= 4.32, r4= 4.82,  &end
#
# 590 LYS HG3 591 PHE H 4.01  (#peak 414 #SUP 0.46 #QF 0.46 )
 &rst
  ixpk= 414, nxpk= 0, iat= 604, 623, r1= 1.30, r2= 1.80, r3= 4.01, r4= 4.51,  &end
#
# 556 TRP H 556 TRP HD1 4.16  (#peak 418 #SUP 0.38 #QF 0.38 )
 &rst
  ixpk= 418, nxpk= 0, iat=  73,  77, r1= 1.30, r2= 1.80, r3= 4.16, r4= 4.66,  &end
#
# 591 PHE HA 592 ILE H 2.78  (#peak 423 #SUP 0.69 #QF 0.69 )
 &rst
  ixpk= 423, nxpk= 0, iat= 624, 640, r1= 1.30, r2= 1.80, r3= 2.78, r4= 3.28,  &end
#
# 556 TRP H 556 TRP HB2 3.16  (#peak 424 #SUP 0.37 #QF 0.37 )
 &rst
  ixpk= 424, nxpk= 0, iat=  73,  75, r1= 1.30, r2= 1.80, r3= 3.16, r4= 3.66,  &end
#
# 592 ILE HB 593 ASP H 4.04  (#peak 438 #SUP 0.76 #QF 0.76 )
 &rst
  ixpk= 438, nxpk= 0, iat= 642, 659, r1= 1.30, r2= 1.80, r3= 4.04, r4= 4.54,  &end
#
# 591 PHE QB 595 GLY H 4.39  (#peak 448 #SUP 0.85 #QF 0.85 )
 &rst
  ixpk= 448, nxpk= 0, iat=  -1, 688, r1= 1.30, r2= 1.80, r3= 4.93, r4= 5.43,
 igr1= 625, 626,
 &end
#
# 595 GLY H 596 ASN H 3.47  (#peak 455 #SUP 0.92 #QF 0.92 )
 &rst
  ixpk= 455, nxpk= 0, iat= 688, 699, r1= 1.30, r2= 1.80, r3= 3.47, r4= 3.97,  &end
#
# 591 PHE QD 596 ASN H 4.58  (#peak 456 #SUP 0.74 #QF 0.74 )
 &rst
  ixpk= 456, nxpk= 0, iat=  -1, 699, r1= 1.30, r2= 1.80, r3= 5.14, r4= 5.64,
 igr1= 627, 628,
 &end
#
# 591 PHE QB 596 ASN H 3.40  (#peak 461 #SUP 0.58 #QF 0.58 )
 &rst
  ixpk= 461, nxpk= 0, iat=  -1, 699, r1= 1.30, r2= 1.80, r3= 3.82, r4= 4.32,
 igr1= 625, 626,
 &end
#
# 597 TYR H 598 GLU H 4.57  (#peak 466 #SUP 0.77 #QF 0.77 )
 &rst
  ixpk= 466, nxpk= 0, iat= 717, 735, r1= 1.30, r2= 1.80, r3= 4.57, r4= 5.07,  &end
#
# 588 VAL HA 598 GLU H 4.50  (#peak 469 #SUP 0.55 #QF 0.55 )
 &rst
  ixpk= 469, nxpk= 0, iat= 566, 735, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
# 590 LYS HA 598 GLU H 4.18  (#peak 470 #SUP 0.81 #QF 0.81 )
 &rst
  ixpk= 470, nxpk= 0, iat= 600, 735, r1= 1.30, r2= 1.80, r3= 4.18, r4= 4.68,  &end
#
# 597 TYR HB2 598 GLU H 4.22  (#peak 471 #SUP 0.91 #QF 0.91 )
 &rst
  ixpk= 471, nxpk= 0, iat= 719, 735, r1= 1.30, r2= 1.80, r3= 4.22, r4= 4.72,  &end
#
# 598 GLU H 598 GLU QG 4.22  (#peak 473 #SUP 0.89 #QF 0.89 )
 &rst
  ixpk= 473, nxpk= 0, iat= 735,  -1, r1= 1.30, r2= 1.80, r3= 4.74, r4= 5.24,
 igr2= 739, 740,
 &end
#
# 598 GLU HA 599 GLU H 2.81  (#peak 479 #SUP 0.98 #QF 0.98 )
 &rst
  ixpk= 479, nxpk= 0, iat= 736, 750, r1= 1.30, r2= 1.80, r3= 2.81, r4= 3.31,  &end
#
# 598 GLU QB 599 GLU H 3.39  (#peak 480 #SUP 0.93 #QF 0.93 )
 &rst
  ixpk= 480, nxpk= 0, iat=  -1, 750, r1= 1.30, r2= 1.80, r3= 3.81, r4= 4.31,
 igr1= 737, 738,
 &end
#
# 599 GLU H 599 GLU QB 2.88  (#peak 481 #SUP 0.70 #QF 0.70 )
 &rst
  ixpk= 481, nxpk= 0, iat= 750,  -1, r1= 1.30, r2= 1.80, r3= 3.23, r4= 3.73,
 igr2= 752, 753,
 &end
#
# 588 VAL QG1 599 GLU H 4.37  (#peak 482 #SUP 0.54 #QF 0.54 )
 &rst
  ixpk= 482, nxpk= 0, iat=  -1, 750, r1= 1.30, r2= 1.80, r3= 5.25, r4= 5.75,
 igr1= 568, 569, 570,
 &end
#
# 599 GLU QB 600 VAL H 3.33  (#peak 489 #SUP 0.65 #QF 0.65 )
 &rst
  ixpk= 489, nxpk= 0, iat=  -1, 763, r1= 1.30, r2= 1.80, r3= 3.74, r4= 4.24,
 igr1= 752, 753,
 &end
#
# 600 VAL H 601 LEU H 4.34  (#peak 493 #SUP 0.97 #QF 0.97 )
 &rst
  ixpk= 493, nxpk= 0, iat= 763, 780, r1= 1.30, r2= 1.80, r3= 4.34, r4= 4.84,  &end
#
# 601 LEU H 602 LEU H 4.77  (#peak 494 #SUP 0.78 #QF 0.78 )
 &rst
  ixpk= 494, nxpk= 0, iat= 780, 799, r1= 1.30, r2= 1.80, r3= 4.77, r4= 5.27,  &end
#
# 601 LEU H 604 ASN HB2 4.73  (#peak 498 #SUP 0.38 #QF 0.38 )
 &rst
  ixpk= 498, nxpk= 0, iat= 780, 831, r1= 1.30, r2= 1.80, r3= 4.73, r4= 5.23,  &end
#
# 601 LEU H 604 ASN HB3 4.73  (#peak 500 #SUP 0.67 #QF 0.67 )
 &rst
  ixpk= 500, nxpk= 0, iat= 780, 832, r1= 1.30, r2= 1.80, r3= 4.73, r4= 5.23,  &end
#
# 600 VAL HB 601 LEU H 4.26  (#peak 501 #SUP 0.98 #QF 0.98 )
 &rst
  ixpk= 501, nxpk= 0, iat= 765, 780, r1= 1.30, r2= 1.80, r3= 4.26, r4= 4.76,  &end
#
# 601 LEU H 601 LEU QB 2.89  (#peak 502 #SUP 0.83 #QF 0.83 )
 &rst
  ixpk= 502, nxpk= 0, iat= 780,  -1, r1= 1.30, r2= 1.80, r3= 3.24, r4= 3.74,
 igr2= 782, 783,
 &end
#
# 600 VAL QQG 601 LEU H 3.73  (#peak 504 #SUP 0.92 #QF 0.92 )
 &rst
  ixpk= 504, nxpk= 0, iat= 760, 780, r1= 1.30, r2= 1.80, r3= 5.93, r4= 6.43,  &end
#
# 601 LEU H 601 LEU QQD 3.69  (#peak 505 #SUP 0.74 #QF 0.74 )
 &rst
  ixpk= 505, nxpk= 0, iat= 780, 777, r1= 1.30, r2= 1.80, r3= 5.89, r4= 6.39,  &end
#
# 602 LEU H 604 ASN H 4.43  (#peak 506 #SUP 0.84 #QF 0.84 )
 &rst
  ixpk= 506, nxpk= 0, iat= 799, 829, r1= 1.30, r2= 1.80, r3= 4.43, r4= 4.93,  &end
#
# 602 LEU H 602 LEU QB 3.06  (#peak 513 #SUP 0.98 #QF 0.98 )
 &rst
  ixpk= 513, nxpk= 0, iat= 799,  -1, r1= 1.30, r2= 1.80, r3= 3.43, r4= 3.93,
 igr2= 801, 802,
 &end
#
# 602 LEU H 602 LEU HG 3.47  (#peak 514 #SUP 0.64 #QF 0.64 )
 &rst
  ixpk= 514, nxpk= 0, iat= 799, 803, r1= 1.30, r2= 1.80, r3= 3.47, r4= 3.97,  &end
#
# 601 LEU QQD 602 LEU H 3.47  (#peak 515 #SUP 0.63 #QF 0.63 )
 &rst
  ixpk= 515, nxpk= 0, iat= 777, 799, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,  &end
#
# 601 LEU H 604 ASN H 5.29  (#peak 517 #SUP 0.78 #QF 0.78 )
 &rst
  ixpk= 517, nxpk= 0, iat= 780, 829, r1= 1.30, r2= 1.80, r3= 5.29, r4= 5.79,  &end
#
# 603 SER H 604 ASN H 3.46  (#peak 519 #SUP 0.96 #QF 0.96 )
 &rst
  ixpk= 519, nxpk= 0, iat= 816, 829, r1= 1.30, r2= 1.80, r3= 3.46, r4= 3.96,  &end
#
# 604 ASN H 605 ILE H 3.12  (#peak 521 #SUP 0.97 #QF 0.97 )
 &rst
  ixpk= 521, nxpk= 0, iat= 829, 843, r1= 1.30, r2= 1.80, r3= 3.12, r4= 3.62,  &end
#
# 602 LEU HA 604 ASN H 4.10  (#peak 527 #SUP 0.95 #QF 0.95 )
 &rst
  ixpk= 527, nxpk= 0, iat= 800, 829, r1= 1.30, r2= 1.80, r3= 4.10, r4= 4.60,  &end
#
# 604 ASN H 604 ASN HB2 3.63  (#peak 529 #SUP 0.83 #QF 0.83 )
 &rst
  ixpk= 529, nxpk= 0, iat= 829, 831, r1= 1.30, r2= 1.80, r3= 3.63, r4= 4.13,  &end
#
# 604 ASN H 604 ASN HB3 3.63  (#peak 530 #SUP 0.88 #QF 0.88 )
 &rst
  ixpk= 530, nxpk= 0, iat= 829, 832, r1= 1.30, r2= 1.80, r3= 3.63, r4= 4.13,  &end
#
# 601 LEU QB 604 ASN H 3.31  (#peak 531 #SUP 0.89 #QF 0.89 )
 &rst
  ixpk= 531, nxpk= 0, iat=  -1, 829, r1= 1.30, r2= 1.80, r3= 3.72, r4= 4.22,
 igr1= 782, 783,
 &end
#
# 601 LEU QQD 604 ASN H 4.11  (#peak 536 #SUP 0.54 #QF 0.54 )
 &rst
  ixpk= 536, nxpk= 0, iat= 777, 829, r1= 1.30, r2= 1.80, r3= 6.31, r4= 6.81,  &end
#
# 605 ILE H 606 LYS H 4.51  (#peak 538 #SUP 0.96 #QF 0.96 )
 &rst
  ixpk= 538, nxpk= 0, iat= 843, 863, r1= 1.30, r2= 1.80, r3= 4.51, r4= 5.01,  &end
#
# 603 SER HA 605 ILE H 4.34  (#peak 544 #SUP 0.79 #QF 0.79 )
 &rst
  ixpk= 544, nxpk= 0, iat= 817, 843, r1= 1.30, r2= 1.80, r3= 4.34, r4= 4.84,  &end
#
# 602 LEU HA 605 ILE H 4.45  (#peak 545 #SUP 0.95 #QF 0.95 )
 &rst
  ixpk= 545, nxpk= 0, iat= 800, 843, r1= 1.30, r2= 1.80, r3= 4.45, r4= 4.95,  &end
#
# 604 ASN HB3 605 ILE H 4.09  (#peak 546 #SUP 0.50 #QF 0.50 )
 &rst
  ixpk= 546, nxpk= 0, iat= 832, 843, r1= 1.30, r2= 1.80, r3= 4.09, r4= 4.59,  &end
#
# 601 LEU QB 605 ILE H 5.11  (#peak 547 #SUP 0.98 #QF 0.95 )
 &rst
  ixpk= 547, nxpk= 0, iat=  -1, 843, r1= 1.30, r2= 1.80, r3= 5.74, r4= 6.24,
 igr1= 782, 783,
 &end
#
# 602 LEU QB 605 ILE H 5.50  (#peak 547 #SUP 0.98 #QF 0.95 )
 &rst
  ixpk= 547, nxpk= 0, iat=  -1, 843, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 801, 802,
 &end
#
# 605 ILE H 605 ILE QD1 3.87  (#peak 552 #SUP 0.98 #QF 0.98 )
 &rst
  ixpk= 552, nxpk= 0, iat= 843,  -1, r1= 1.30, r2= 1.80, r3= 4.65, r4= 5.15,
 igr2= 851, 852, 853,
 &end
#
# 564 ALA HA 606 LYS H 4.02  (#peak 560 #SUP 0.98 #QF 0.98 )
 &rst
  ixpk= 560, nxpk= 0, iat= 190, 863, r1= 1.30, r2= 1.80, r3= 4.02, r4= 4.52,  &end
#
# 605 ILE HA 606 LYS H 2.99  (#peak 561 #SUP 0.92 #QF 0.92 )
 &rst
  ixpk= 561, nxpk= 0, iat= 844, 863, r1= 1.30, r2= 1.80, r3= 2.99, r4= 3.49,  &end
#
# 563 PHE HB3 606 LYS H 4.41  (#peak 563 #SUP 0.74 #QF 0.74 )
 &rst
  ixpk= 563, nxpk= 0, iat= 178, 863, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,  &end
#
# 565 LEU HB2 606 LYS H 5.10  (#peak 567 #SUP 0.59 #QF 0.59 )
 &rst
  ixpk= 567, nxpk= 0, iat= 204, 863, r1= 1.30, r2= 1.80, r3= 5.10, r4= 5.60,  &end
#
# 564 ALA QB 606 LYS H 4.65  (#peak 570 #SUP 0.93 #QF 0.93 )
 &rst
  ixpk= 570, nxpk= 0, iat=  -1, 863, r1= 1.30, r2= 1.80, r3= 5.58, r4= 6.08,
 igr1= 191, 192, 193,
 &end
#
# 563 PHE H 608 ILE H 4.73  (#peak 573 #SUP 0.62 #QF 0.62 )
 &rst
  ixpk= 573, nxpk= 0, iat= 175, 898, r1= 1.30, r2= 1.80, r3= 4.73, r4= 5.23,  &end
#
# 556 TRP HH2 608 ILE H 4.86  (#peak 576 #SUP 0.86 #QF 0.86 )
 &rst
  ixpk= 576, nxpk= 0, iat=  82, 898, r1= 1.30, r2= 1.80, r3= 4.86, r4= 5.36,  &end
#
# 607 PRO HA 608 ILE H 2.75  (#peak 577 #SUP 0.94 #QF 0.94 )
 &rst
  ixpk= 577, nxpk= 0, iat= 883, 898, r1= 1.30, r2= 1.80, r3= 2.75, r4= 3.25,  &end
#
# 607 PRO HB2 608 ILE H 3.46  (#peak 579 #SUP 0.98 #QF 0.98 )
 &rst
  ixpk= 579, nxpk= 0, iat= 884, 898, r1= 1.30, r2= 1.80, r3= 3.46, r4= 3.96,  &end
#
# 608 ILE H 608 ILE HB 3.04  (#peak 580 #SUP 0.98 #QF 0.98 )
 &rst
  ixpk= 580, nxpk= 0, iat= 898, 900, r1= 1.30, r2= 1.80, r3= 3.04, r4= 3.54,  &end
#
# 608 ILE H 608 ILE QG1 3.66  (#peak 582 #SUP 0.73 #QF 0.73 )
 &rst
  ixpk= 582, nxpk= 0, iat= 898,  -1, r1= 1.30, r2= 1.80, r3= 4.11, r4= 4.61,
 igr2= 901, 902,
 &end
#
# 608 ILE H 608 ILE QD1 4.48  (#peak 584 #SUP 0.85 #QF 0.85 )
 &rst
  ixpk= 584, nxpk= 0, iat= 898,  -1, r1= 1.30, r2= 1.80, r3= 5.38, r4= 5.88,
 igr2= 906, 907, 908,
 &end
#
# 566 TYR QD 567 TRP HE1 4.44  (#peak 588     )
 &rst
  ixpk= 588, nxpk= 0, iat=  -1, 253, r1= 1.30, r2= 1.80, r3= 4.98, r4= 5.48,
 igr1= 229, 230,
 &end
#
# 556 TRP HB2 556 TRP HE1 4.80  (#peak 597 #SUP 0.54 #QF 0.54 )
 &rst
  ixpk= 597, nxpk= 0, iat=  75,  78, r1= 1.30, r2= 1.80, r3= 4.80, r4= 5.30,  &end
#
# 556 TRP HE1 602 LEU QB 4.23  (#peak 598 #SUP 0.88 #QF 0.88 )
 &rst
  ixpk= 598, nxpk= 0, iat=  78,  -1, r1= 1.30, r2= 1.80, r3= 4.75, r4= 5.25,
 igr2= 801, 802,
 &end
#
# 556 TRP HE1 605 ILE QG2 3.67  (#peak 601 #SUP 0.77 #QF 0.77 )
 &rst
  ixpk= 601, nxpk= 0, iat=  78,  -1, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,
 igr2= 848, 849, 850,
 &end
#
# 556 TRP HE1 605 ILE QD1 3.64  (#peak 602 #SUP 0.97 #QF 0.97 )
 &rst
  ixpk= 602, nxpk= 0, iat=  78,  -1, r1= 1.30, r2= 1.80, r3= 4.37, r4= 4.87,
 igr2= 851, 852, 853,
 &end
#
# 608 ILE H 609 LEU H 4.27  (#peak 603 #SUP 0.96 #QF 0.96 )
 &rst
  ixpk= 603, nxpk= 0, iat= 898, 917, r1= 1.30, r2= 1.80, r3= 4.27, r4= 4.77,  &end
#
# 607 PRO HB3 609 LEU H 4.52  (#peak 607 #SUP 0.62 #QF 0.62 )
 &rst
  ixpk= 607, nxpk= 0, iat= 885, 917, r1= 1.30, r2= 1.80, r3= 4.52, r4= 5.02,  &end
#
# 608 ILE HB 609 LEU H 4.00  (#peak 609 #SUP 0.95 #QF 0.95 )
 &rst
  ixpk= 609, nxpk= 0, iat= 900, 917, r1= 1.30, r2= 1.80, r3= 4.00, r4= 4.50,  &end
#
# 609 LEU H 609 LEU QB 3.28  (#peak 610 #SUP 0.96 #QF 0.96 )
 &rst
  ixpk= 610, nxpk= 0, iat= 917,  -1, r1= 1.30, r2= 1.80, r3= 3.68, r4= 4.18,
 igr2= 919, 920,
 &end
#
# 558 PRO HB3 559 GLY H 4.50  (#peak 624 #SUP 0.81 #QF 0.81 )
 &rst
  ixpk= 624, nxpk= 0, iat= 114, 123, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
# 599 GLU H 599 GLU QG 4.47  (#peak 629 #SUP 0.87 #QF 0.87 )
 &rst
  ixpk= 629, nxpk= 0, iat= 750,  -1, r1= 1.30, r2= 1.80, r3= 5.02, r4= 5.52,
 igr2= 754, 755,
 &end
#
# 556 TRP H 557 LYS H 4.63  (#peak 637 #SUP 0.60 #QF 0.60 )
 &rst
  ixpk= 637, nxpk= 0, iat=  73,  92, r1= 1.30, r2= 1.80, r3= 4.63, r4= 5.13,  &end
#
# 556 TRP HB2 557 LYS H 4.17  (#peak 638 #SUP 0.92 #QF 0.92 )
 &rst
  ixpk= 638, nxpk= 0, iat=  75,  92, r1= 1.30, r2= 1.80, r3= 4.17, r4= 4.67,  &end
#
# 559 GLY H 580 LEU HG 5.21  (#peak 641 #SUP 0.86 #QF 0.86 )
 &rst
  ixpk= 641, nxpk= 0, iat= 123, 464, r1= 1.30, r2= 1.80, r3= 5.21, r4= 5.71,  &end
#
# 561 GLU H 577 VAL HB 4.80  (#peak 644 #SUP 0.94 #QF 0.94 )
 &rst
  ixpk= 644, nxpk= 0, iat= 147, 420, r1= 1.30, r2= 1.80, r3= 4.80, r4= 5.30,  &end
#
# 562 CYS H 577 VAL HB 5.03  (#peak 645 #SUP 0.98 #QF 0.98 )
 &rst
  ixpk= 645, nxpk= 0, iat= 159, 420, r1= 1.30, r2= 1.80, r3= 5.03, r4= 5.53,  &end
#
# 565 LEU HB2 566 TYR H 4.73  (#peak 649 #SUP 0.84 #QF 0.84 )
 &rst
  ixpk= 649, nxpk= 0, iat= 204, 225, r1= 1.30, r2= 1.80, r3= 4.73, r4= 5.23,  &end
#
# 566 TYR H 567 TRP H 4.61  (#peak 650 #SUP 0.93 #QF 0.93 )
 &rst
  ixpk= 650, nxpk= 0, iat= 225, 248, r1= 1.30, r2= 1.80, r3= 4.61, r4= 5.11,  &end
#
# 561 GLU HA 576 GLU H 4.55  (#peak 657 #SUP 0.79 #QF 0.79 )
 &rst
  ixpk= 657, nxpk= 0, iat= 148, 405, r1= 1.30, r2= 1.80, r3= 4.55, r4= 5.05,  &end
#
# 587 ALA H 600 VAL H 3.10  (#peak 658 #SUP 0.52 #QF 0.52 )
 &rst
  ixpk= 658, nxpk= 0, iat= 553, 763, r1= 1.30, r2= 1.80, r3= 3.10, r4= 3.60,  &end
#
# 556 TRP H 556 TRP HB3 3.77  (#peak 663 #SUP 0.97 #QF 0.57 )
 &rst
  ixpk= 663, nxpk= 0, iat=  73,  76, r1= 1.30, r2= 1.80, r3= 3.77, r4= 4.27,  &end
#
# 591 PHE QB 592 ILE H 3.94  (#peak 663 #SUP 0.97 #QF 0.57 )
 &rst
  ixpk= 663, nxpk= 0, iat=  -1, 640, r1= 1.30, r2= 1.80, r3= 4.42, r4= 4.92,
 igr1= 625, 626,
 &end
#
# 580 LEU HA 588 VAL H 3.41  (#peak 665 #SUP 0.33 #QF 0.33 )
 &rst
  ixpk= 665, nxpk= 0, iat= 461, 565, r1= 1.30, r2= 1.80, r3= 3.41, r4= 3.91,  &end
#
# 588 VAL HA 599 GLU H 4.69  (#peak 667 #SUP 0.59 #QF 0.59 )
 &rst
  ixpk= 667, nxpk= 0, iat= 566, 750, r1= 1.30, r2= 1.80, r3= 4.69, r4= 5.19,  &end
#
# 600 VAL QQG 605 ILE H 4.06  (#peak 670 #SUP 0.94 #QF 0.94 )
 &rst
  ixpk= 670, nxpk= 0, iat= 760, 843, r1= 1.30, r2= 1.80, r3= 6.26, r4= 6.76,  &end
#
# 568 GLU H 568 GLU HB2 3.34  (#peak 678 #SUP 0.53 #QF 0.53 )
 &rst
  ixpk= 678, nxpk= 0, iat= 267, 269, r1= 1.30, r2= 1.80, r3= 3.34, r4= 3.84,  &end
#
# 568 GLU H 568 GLU HB3 3.21  (#peak 679 #SUP 0.49 #QF 0.49 )
 &rst
  ixpk= 679, nxpk= 0, iat= 267, 270, r1= 1.30, r2= 1.80, r3= 3.21, r4= 3.71,  &end
#
# 568 GLU H 569 ASP H 3.65  (#peak 683     )
 &rst
  ixpk= 683, nxpk= 0, iat= 267, 281, r1= 1.30, r2= 1.80, r3= 3.65, r4= 4.15,  &end
#
# 556 TRP HA 556 TRP HD1 4.57  (#peak 20 #SUP 0.68 #QF 0.68 )
 &rst
  ixpk= 20, nxpk= 0, iat=  74,  77, r1= 1.30, r2= 1.80, r3= 4.57, r4= 5.07,  &end
#
# 556 TRP HD1 602 LEU QB 3.80  (#peak 25 #SUP 0.70 #QF 0.23 )
 &rst
  ixpk= 25, nxpk= 0, iat=  77,  -1, r1= 1.30, r2= 1.80, r3= 4.27, r4= 4.77,
 igr2= 801, 802,
 &end
#
# 556 TRP HD1 605 ILE HB 4.03  (#peak 26 #SUP 0.93 #QF 0.93 )
 &rst
  ixpk= 26, nxpk= 0, iat=  77, 845, r1= 1.30, r2= 1.80, r3= 4.03, r4= 4.53,  &end
#
# 556 TRP HD1 605 ILE QD1 4.06  (#peak 28 #SUP 0.91 #QF 0.91 )
 &rst
  ixpk= 28, nxpk= 0, iat=  77,  -1, r1= 1.30, r2= 1.80, r3= 4.88, r4= 5.38,
 igr2= 851, 852, 853,
 &end
#
# 556 TRP HD1 604 ASN H 5.50  (#peak 34 #SUP 0.74 #QF 0.74 )
 &rst
  ixpk= 34, nxpk= 0, iat=  77, 829, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
# 556 TRP HZ2 607 PRO HA 3.89  (#peak 49 #SUP 0.86 #QF 0.86 )
 &rst
  ixpk= 49, nxpk= 0, iat=  80, 883, r1= 1.30, r2= 1.80, r3= 3.89, r4= 4.39,  &end
#
# 556 TRP HH2 607 PRO HA 2.98  (#peak 66 #SUP 0.60 #QF 0.60 )
 &rst
  ixpk= 66, nxpk= 0, iat=  82, 883, r1= 1.30, r2= 1.80, r3= 2.98, r4= 3.48,  &end
#
# 556 TRP HH2 560 ASP QB 4.86  (#peak 70 #SUP 0.55 #QF 0.55 )
 &rst
  ixpk= 70, nxpk= 0, iat=  82,  -1, r1= 1.30, r2= 1.80, r3= 5.46, r4= 5.96,
 igr2= 136, 137,
 &end
#
# 556 TRP HH2 562 CYS HB2 4.43  (#peak 71 #SUP 0.91 #QF 0.91 )
 &rst
  ixpk= 71, nxpk= 0, iat=  82, 161, r1= 1.30, r2= 1.80, r3= 4.43, r4= 4.93,  &end
#
# 567 TRP HB3 567 TRP HD1 3.31  (#peak 78 #SUP 0.42 #QF 0.42 )
 &rst
  ixpk= 78, nxpk= 0, iat= 251, 252, r1= 1.30, r2= 1.80, r3= 3.31, r4= 3.81,  &end
#
# 567 TRP H 567 TRP HD1 3.04  (#peak 79 #SUP 0.32 #QF 0.32 )
 &rst
  ixpk= 79, nxpk= 0, iat= 248, 252, r1= 1.30, r2= 1.80, r3= 3.04, r4= 3.54,  &end
#
# 567 TRP HA 567 TRP HD1 4.59  (#peak 90 #SUP 0.75 #QF 0.75 )
 &rst
  ixpk= 90, nxpk= 0, iat= 249, 252, r1= 1.30, r2= 1.80, r3= 4.59, r4= 5.09,  &end
#
# 567 TRP HB2 567 TRP HD1 3.88  (#peak 91 #SUP 0.51 #QF 0.51 )
 &rst
  ixpk= 91, nxpk= 0, iat= 250, 252, r1= 1.30, r2= 1.80, r3= 3.88, r4= 4.38,  &end
#
# 567 TRP HD1 568 GLU HB3 5.50  (#peak 97 #SUP 0.56 #QF 0.56 )
 &rst
  ixpk= 97, nxpk= 0, iat= 252, 270, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
# 566 TYR QD 567 TRP H 3.51  (#peak 98     )
 &rst
  ixpk= 98, nxpk= 0, iat=  -1, 248, r1= 1.30, r2= 1.80, r3= 3.94, r4= 4.44,
 igr1= 229, 230,
 &end
#
# 566 TYR HA 566 TYR QD 3.11  (#peak 101     )
 &rst
  ixpk= 101, nxpk= 0, iat= 226,  -1, r1= 1.30, r2= 1.80, r3= 3.49, r4= 3.99,
 igr2= 229, 230,
 &end
#
# 566 TYR QD 568 GLU H 4.34  (#peak 102     )
 &rst
  ixpk= 102, nxpk= 0, iat=  -1, 267, r1= 1.30, r2= 1.80, r3= 4.87, r4= 5.37,
 igr1= 229, 230,
 &end
#
# 566 TYR QD 568 GLU QG 3.71  (#peak 104     )
 &rst
  ixpk= 104, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.67, r4= 5.17,
 igr1= 229, 230,
 igr2= 271, 272,
 &end
#
# 566 TYR QD 567 TRP HD1 3.55  (#peak 114 #SUP 0.93 #QF 0.80 )
 &rst
  ixpk= 114, nxpk= 0, iat=  -1, 252, r1= 1.30, r2= 1.80, r3= 3.98, r4= 4.48,
 igr1= 229, 230,
 &end
#
# 566 TYR H 566 TYR QD 4.13  (#peak 115     )
 &rst
  ixpk= 115, nxpk= 0, iat= 225,  -1, r1= 1.30, r2= 1.80, r3= 4.64, r4= 5.14,
 igr2= 229, 230,
 &end
#
# 597 TYR HA 597 TYR QD 3.76  (#peak 117 #SUP 0.75 #QF 0.75 )
 &rst
  ixpk= 117, nxpk= 0, iat= 718,  -1, r1= 1.30, r2= 1.80, r3= 4.22, r4= 4.72,
 igr2= 721, 722,
 &end
#
# 596 ASN HA 597 TYR QD 3.66  (#peak 119 #SUP 0.72 #QF 0.72 )
 &rst
  ixpk= 119, nxpk= 0, iat= 700,  -1, r1= 1.30, r2= 1.80, r3= 4.11, r4= 4.61,
 igr2= 721, 722,
 &end
#
# 588 VAL HB 597 TYR QD 4.14  (#peak 124 #SUP 0.89 #QF 0.89 )
 &rst
  ixpk= 124, nxpk= 0, iat= 567,  -1, r1= 1.30, r2= 1.80, r3= 4.65, r4= 5.15,
 igr2= 721, 722,
 &end
#
# 590 LYS HB3 597 TYR QD 4.02  (#peak 125 #SUP 0.60 #QF 0.60 )
 &rst
  ixpk= 125, nxpk= 0, iat= 602,  -1, r1= 1.30, r2= 1.80, r3= 4.51, r4= 5.01,
 igr2= 721, 722,
 &end
#
# 590 LYS HD3 597 TYR QD 4.13  (#peak 126 #SUP 0.89 #QF 0.89 )
 &rst
  ixpk= 126, nxpk= 0, iat= 606,  -1, r1= 1.30, r2= 1.80, r3= 4.64, r4= 5.14,
 igr2= 721, 722,
 &end
#
# 590 LYS HB2 597 TYR QD 3.80  (#peak 127 #SUP 0.85 #QF 0.85 )
 &rst
  ixpk= 127, nxpk= 0, iat= 601,  -1, r1= 1.30, r2= 1.80, r3= 4.27, r4= 4.77,
 igr2= 721, 722,
 &end
#
# 588 VAL QG1 597 TYR QD 3.07  (#peak 128 #SUP 0.93 #QF 0.93 )
 &rst
  ixpk= 128, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.14, r4= 4.64,
 igr1= 568, 569, 570,
 igr2= 721, 722,
 &end
#
# 590 LYS HG3 597 TYR QD 4.85  (#peak 130 #SUP 0.53 #QF 0.53 )
 &rst
  ixpk= 130, nxpk= 0, iat= 604,  -1, r1= 1.30, r2= 1.80, r3= 5.44, r4= 5.94,
 igr2= 721, 722,
 &end
#
# 597 TYR H 597 TYR QD 3.30  (#peak 131 #SUP 0.59 #QF 0.59 )
 &rst
  ixpk= 131, nxpk= 0, iat= 717,  -1, r1= 1.30, r2= 1.80, r3= 3.70, r4= 4.20,
 igr2= 721, 722,
 &end
#
# 597 TYR HA 597 TYR QE 5.50  (#peak 134 #SUP 0.46 #QF 0.46 )
 &rst
  ixpk= 134, nxpk= 0, iat= 718,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2= 723, 724,
 &end
#
# 596 ASN QB 597 TYR QE 4.77  (#peak 140 #SUP 0.91 #QF 0.91 )
 &rst
  ixpk= 140, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.01, r4= 6.51,
 igr1= 701, 702,
 igr2= 723, 724,
 &end
#
# 590 LYS HD2 597 TYR QE 3.32  (#peak 142 #SUP 0.40 #QF 0.40 )
 &rst
  ixpk= 142, nxpk= 0, iat= 605,  -1, r1= 1.30, r2= 1.80, r3= 3.73, r4= 4.23,
 igr2= 723, 724,
 &end
#
# 588 VAL QG1 597 TYR QE 3.70  (#peak 144 #SUP 0.97 #QF 0.97 )
 &rst
  ixpk= 144, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.99, r4= 5.49,
 igr1= 568, 569, 570,
 igr2= 723, 724,
 &end
#
# 597 TYR H 597 TYR QE 3.83  (#peak 147 #SUP 0.89 #QF 0.89 )
 &rst
  ixpk= 147, nxpk= 0, iat= 717,  -1, r1= 1.30, r2= 1.80, r3= 4.30, r4= 4.80,
 igr2= 723, 724,
 &end
#
# 566 TYR QD 573 TYR QD 4.10  (#peak 150 #SUP 0.67 #QF 0.67 )
 &rst
  ixpk= 150, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.17, r4= 5.67,
 igr1= 229, 230,
 igr2= 357, 358,
 &end
#
# 571 LYS H 573 TYR QD 4.50  (#peak 151 #SUP 0.98 #QF 0.98 )
 &rst
  ixpk= 151, nxpk= 0, iat= 308,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2= 357, 358,
 &end
#
# 572 PHE H 573 TYR QD 4.96  (#peak 153 #SUP 0.75 #QF 0.75 )
 &rst
  ixpk= 153, nxpk= 0, iat= 332,  -1, r1= 1.30, r2= 1.80, r3= 5.57, r4= 6.07,
 igr2= 357, 358,
 &end
#
# 566 TYR H 573 TYR QD 3.74  (#peak 155 #SUP 0.93 #QF 0.93 )
 &rst
  ixpk= 155, nxpk= 0, iat= 225,  -1, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
 igr2= 357, 358,
 &end
#
# 573 TYR HA 573 TYR QD 3.29  (#peak 158 #SUP 0.92 #QF 0.92 )
 &rst
  ixpk= 158, nxpk= 0, iat= 354,  -1, r1= 1.30, r2= 1.80, r3= 3.69, r4= 4.19,
 igr2= 357, 358,
 &end
#
# 571 LYS HA 573 TYR QD 5.50  (#peak 160 #SUP 0.34 #QF 0.34 )
 &rst
  ixpk= 160, nxpk= 0, iat= 309,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2= 357, 358,
 &end
#
# 571 LYS HB2 573 TYR QD 4.76  (#peak 165 #SUP 0.97 #QF 0.97 )
 &rst
  ixpk= 165, nxpk= 0, iat= 310,  -1, r1= 1.30, r2= 1.80, r3= 5.34, r4= 5.84,
 igr2= 357, 358,
 &end
#
# 571 LYS HB3 573 TYR QD 4.21  (#peak 166 #SUP 0.76 #QF 0.76 )
 &rst
  ixpk= 166, nxpk= 0, iat= 311,  -1, r1= 1.30, r2= 1.80, r3= 4.73, r4= 5.23,
 igr2= 357, 358,
 &end
#
# 566 TYR QD 573 TYR QE 3.30  (#peak 174 #SUP 0.91 #QF 0.91 )
 &rst
  ixpk= 174, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.16, r4= 4.66,
 igr1= 229, 230,
 igr2= 359, 360,
 &end
#
# 567 TRP H 573 TYR QE 4.93  (#peak 175 #SUP 0.90 #QF 0.90 )
 &rst
  ixpk= 175, nxpk= 0, iat= 248,  -1, r1= 1.30, r2= 1.80, r3= 5.53, r4= 6.03,
 igr2= 359, 360,
 &end
#
# 566 TYR H 573 TYR QE 4.38  (#peak 177 #SUP 0.95 #QF 0.95 )
 &rst
  ixpk= 177, nxpk= 0, iat= 225,  -1, r1= 1.30, r2= 1.80, r3= 4.92, r4= 5.42,
 igr2= 359, 360,
 &end
#
# 566 TYR HB2 573 TYR QE 3.51  (#peak 181 #SUP 0.85 #QF 0.85 )
 &rst
  ixpk= 181, nxpk= 0, iat= 227,  -1, r1= 1.30, r2= 1.80, r3= 3.94, r4= 4.44,
 igr2= 359, 360,
 &end
#
# 566 TYR HB3 573 TYR QE 3.51  (#peak 183 #SUP 0.99 #QF 0.99 )
 &rst
  ixpk= 183, nxpk= 0, iat= 228,  -1, r1= 1.30, r2= 1.80, r3= 3.94, r4= 4.44,
 igr2= 359, 360,
 &end
#
# 571 LYS HB2 573 TYR QE 3.25  (#peak 184 #SUP 0.94 #QF 0.94 )
 &rst
  ixpk= 184, nxpk= 0, iat= 310,  -1, r1= 1.30, r2= 1.80, r3= 3.65, r4= 4.15,
 igr2= 359, 360,
 &end
#
# 571 LYS HB3 573 TYR QE 3.50  (#peak 185 #SUP 0.98 #QF 0.98 )
 &rst
  ixpk= 185, nxpk= 0, iat= 311,  -1, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr2= 359, 360,
 &end
#
# 567 TRP HZ2 568 GLU HB2 4.71  (#peak 194 #SUP 0.82 #QF 0.82 )
 &rst
  ixpk= 194, nxpk= 0, iat= 255, 269, r1= 1.30, r2= 1.80, r3= 4.71, r4= 5.21,  &end
#
# 567 TRP HZ2 568 GLU HB3 5.41  (#peak 195 #SUP 0.37 #QF 0.37 )
 &rst
  ixpk= 195, nxpk= 0, iat= 255, 270, r1= 1.30, r2= 1.80, r3= 5.41, r4= 5.91,  &end
#
# 567 TRP HH2 568 GLU HB2 4.33  (#peak 197 #SUP 0.83 #QF 0.83 )
 &rst
  ixpk= 197, nxpk= 0, iat= 257, 269, r1= 1.30, r2= 1.80, r3= 4.33, r4= 4.83,  &end
#
# 563 PHE HA 563 PHE QD 3.52  (#peak 205 #SUP 0.93 #QF 0.93 )
 &rst
  ixpk= 205, nxpk= 0, iat= 176,  -1, r1= 1.30, r2= 1.80, r3= 3.95, r4= 4.45,
 igr2= 179, 180,
 &end
#
# 563 PHE QD 572 PHE HB2 3.58  (#peak 211 #SUP 0.71 #QF 0.71 )
 &rst
  ixpk= 211, nxpk= 0, iat=  -1, 334, r1= 1.30, r2= 1.80, r3= 4.02, r4= 4.52,
 igr1= 179, 180,
 &end
#
# 563 PHE QE 574 ARG QB 4.34  (#peak 212 #SUP 0.55 #QF 0.25 )
 &rst
  ixpk= 212, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.47, r4= 5.97,
 igr1= 181, 182,
 igr2= 375, 376,
 &end
#
# 563 PHE QD 608 ILE QD1 4.59  (#peak 216 #SUP 0.81 #QF 0.59 )
 &rst
  ixpk= 216, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.19, r4= 6.69,
 igr1= 179, 180,
 igr2= 906, 907, 908,
 &end
#
# 563 PHE QE 608 ILE QD1 4.81  (#peak 216 #SUP 0.81 #QF 0.59 )
 &rst
  ixpk= 216, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.48, r4= 6.98,
 igr1= 181, 182,
 igr2= 906, 907, 908,
 &end
#
# 572 PHE H 572 PHE QD 3.58  (#peak 217 #SUP 0.69 #QF 0.69 )
 &rst
  ixpk= 217, nxpk= 0, iat= 332,  -1, r1= 1.30, r2= 1.80, r3= 4.02, r4= 4.52,
 igr2= 336, 337,
 &end
#
# 572 PHE QD 606 LYS H 4.07  (#peak 219 #SUP 0.63 #QF 0.63 )
 &rst
  ixpk= 219, nxpk= 0, iat=  -1, 863, r1= 1.30, r2= 1.80, r3= 4.57, r4= 5.07,
 igr1= 336, 337,
 &end
#
# 572 PHE QD 573 TYR H 4.76  (#peak 220 #SUP 0.75 #QF 0.75 )
 &rst
  ixpk= 220, nxpk= 0, iat=  -1, 353, r1= 1.30, r2= 1.80, r3= 5.34, r4= 5.84,
 igr1= 336, 337,
 &end
#
# 572 PHE QD 605 ILE HA 4.17  (#peak 223 #SUP 0.42 #QF 0.42 )
 &rst
  ixpk= 223, nxpk= 0, iat=  -1, 844, r1= 1.30, r2= 1.80, r3= 4.68, r4= 5.18,
 igr1= 336, 337,
 &end
#
# 563 PHE HB3 572 PHE QD 3.94  (#peak 226 #SUP 0.54 #QF 0.54 )
 &rst
  ixpk= 226, nxpk= 0, iat= 178,  -1, r1= 1.30, r2= 1.80, r3= 4.42, r4= 4.92,
 igr2= 336, 337,
 &end
#
# 565 LEU HB2 572 PHE QD 5.35  (#peak 228 #SUP 0.91 #QF 0.75 )
 &rst
  ixpk= 228, nxpk= 0, iat= 204,  -1, r1= 1.30, r2= 1.80, r3= 6.01, r4= 6.51,
 igr2= 336, 337,
 &end
#
# 565 LEU HB2 572 PHE QE 5.50  (#peak 228 #SUP 0.91 #QF 0.75 )
 &rst
  ixpk= 228, nxpk= 0, iat= 204,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2= 338, 339,
 &end
#
# 591 PHE QD 592 ILE H 4.74  (#peak 230 #SUP 0.83 #QF 0.83 )
 &rst
  ixpk= 230, nxpk= 0, iat=  -1, 640, r1= 1.30, r2= 1.80, r3= 5.32, r4= 5.82,
 igr1= 627, 628,
 &end
#
# 573 TYR HB3 591 PHE QD 4.16  (#peak 235 #SUP 0.36 #QF 0.36 )
 &rst
  ixpk= 235, nxpk= 0, iat= 356,  -1, r1= 1.30, r2= 1.80, r3= 4.67, r4= 5.17,
 igr2= 627, 628,
 &end
#
# 575 ALA QB 591 PHE QD 4.26  (#peak 240 #SUP 0.75 #QF 0.64 )
 &rst
  ixpk= 240, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.74, r4= 6.24,
 igr1= 393, 394, 395,
 igr2= 627, 628,
 &end
#
# 573 TYR HB2 591 PHE QD 4.11  (#peak 243 #SUP 0.75 #QF 0.59 )
 &rst
  ixpk= 243, nxpk= 0, iat= 355,  -1, r1= 1.30, r2= 1.80, r3= 4.61, r4= 5.11,
 igr2= 627, 628,
 &end
#
# 573 TYR HB2 591 PHE QE 4.46  (#peak 243 #SUP 0.75 #QF 0.59 )
 &rst
  ixpk= 243, nxpk= 0, iat= 355,  -1, r1= 1.30, r2= 1.80, r3= 5.01, r4= 5.51,
 igr2= 629, 630,
 &end
#
# 566 TYR QE 567 TRP HD1 3.45  (#peak 249     )
 &rst
  ixpk= 249, nxpk= 0, iat=  -1, 252, r1= 1.30, r2= 1.80, r3= 3.87, r4= 4.37,
 igr1= 231, 232,
 &end
#
# 566 TYR QE 567 TRP HZ2 4.51  (#peak 250 #SUP 0.94 #QF 0.94 )
 &rst
  ixpk= 250, nxpk= 0, iat=  -1, 255, r1= 1.30, r2= 1.80, r3= 5.06, r4= 5.56,
 igr1= 231, 232,
 &end
#
# 566 TYR QE 568 GLU H 4.02  (#peak 251     )
 &rst
  ixpk= 251, nxpk= 0, iat=  -1, 267, r1= 1.30, r2= 1.80, r3= 4.51, r4= 5.01,
 igr1= 231, 232,
 &end
#
# 566 TYR QE 568 GLU QG 3.39  (#peak 254     )
 &rst
  ixpk= 254, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.27, r4= 4.77,
 igr1= 231, 232,
 igr2= 271, 272,
 &end
#
# 566 TYR QE 568 GLU HB2 3.09  (#peak 256     )
 &rst
  ixpk= 256, nxpk= 0, iat=  -1, 269, r1= 1.30, r2= 1.80, r3= 3.47, r4= 3.97,
 igr1= 231, 232,
 &end
#
# 566 TYR QE 568 GLU HB3 3.42  (#peak 257     )
 &rst
  ixpk= 257, nxpk= 0, iat=  -1, 270, r1= 1.30, r2= 1.80, r3= 3.84, r4= 4.34,
 igr1= 231, 232,
 &end
#
# 566 TYR QE 567 TRP H 4.30  (#peak 258     )
 &rst
  ixpk= 258, nxpk= 0, iat=  -1, 248, r1= 1.30, r2= 1.80, r3= 4.83, r4= 5.33,
 igr1= 231, 232,
 &end
#
# 566 TYR QE 567 TRP HE1 3.47  (#peak 259     )
 &rst
  ixpk= 259, nxpk= 0, iat=  -1, 253, r1= 1.30, r2= 1.80, r3= 3.89, r4= 4.39,
 igr1= 231, 232,
 &end
#
# 573 TYR HA 594 TYR QE 5.50  (#peak 266 #SUP 0.84 #QF 0.84 )
 &rst
  ixpk= 266, nxpk= 0, iat= 354,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2= 681, 682,
 &end
#
# 573 TYR QD 594 TYR QE 3.69  (#peak 268 #SUP 0.96 #QF 0.96 )
 &rst
  ixpk= 268, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.65, r4= 5.15,
 igr1= 357, 358,
 igr2= 681, 682,
 &end
#
# 591 PHE QB 594 TYR QE 3.61  (#peak 272 #SUP 0.79 #QF 0.79 )
 &rst
  ixpk= 272, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.55, r4= 5.05,
 igr1= 625, 626,
 igr2= 681, 682,
 &end
#
# 591 PHE QB 594 TYR QD 2.78  (#peak 277 #SUP 0.66 #QF 0.66 )
 &rst
  ixpk= 277, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,
 igr1= 625, 626,
 igr2= 679, 680,
 &end
#
# 566 TYR QD 568 GLU HB2 4.09  (#peak 280     )
 &rst
  ixpk= 280, nxpk= 0, iat=  -1, 269, r1= 1.30, r2= 1.80, r3= 4.59, r4= 5.09,
 igr1= 229, 230,
 &end
#
# 566 TYR QD 568 GLU HB3 4.54  (#peak 281     )
 &rst
  ixpk= 281, nxpk= 0, iat=  -1, 270, r1= 1.30, r2= 1.80, r3= 5.10, r4= 5.60,
 igr1= 229, 230,
 &end
#
# 556 TRP HB2 580 LEU QQD 4.63  (#peak 1443     )
 &rst
  ixpk= 1443, nxpk= 0, iat=  75, 457, r1= 1.30, r2= 1.80, r3= 6.83, r4= 7.33,  &end
#
# 556 TRP HB3 580 LEU QQD 3.91  (#peak 2312     )
 &rst
  ixpk= 2312, nxpk= 0, iat=  76, 457, r1= 1.30, r2= 1.80, r3= 6.11, r4= 6.61,  &end
#
# 556 TRP HE1 580 LEU QQD 4.36  (#peak 1436     )
 &rst
  ixpk= 1436, nxpk= 0, iat=  78, 457, r1= 1.30, r2= 1.80, r3= 6.56, r4= 7.06,  &end
#
# 556 TRP HZ2 562 CYS QB 3.83  (#peak 2420     )
 &rst
  ixpk= 2420, nxpk= 0, iat=  80,  -1, r1= 1.30, r2= 1.80, r3= 4.30, r4= 4.80,
 igr2= 161, 162,
 &end
#
# 556 TRP HH2 562 CYS QB 3.73  (#peak 71     )
 &rst
  ixpk= 71, nxpk= 0, iat=  82,  -1, r1= 1.30, r2= 1.80, r3= 4.19, r4= 4.69,
 igr2= 161, 162,
 &end
#
# 557 LYS H 580 LEU QQD 4.55  (#peak 30     )
 &rst
  ixpk= 30, nxpk= 0, iat=  92, 457, r1= 1.30, r2= 1.80, r3= 6.75, r4= 7.25,  &end
#
# 558 PRO HA 580 LEU QQD 3.51  (#peak 1442     )
 &rst
  ixpk= 1442, nxpk= 0, iat= 112, 457, r1= 1.30, r2= 1.80, r3= 5.71, r4= 6.21,  &end
#
# 562 CYS QB 563 PHE H 2.89  (#peak 106     )
 &rst
  ixpk= 106, nxpk= 0, iat=  -1, 175, r1= 1.30, r2= 1.80, r3= 3.24, r4= 3.74,
 igr1= 161, 162,
 &end
#
# 562 CYS QB 577 VAL QG2 4.44  (#peak 1500     )
 &rst
  ixpk= 1500, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.99, r4= 6.49,
 igr1= 161, 162,
 igr2= 424, 425, 426,
 &end
#
# 562 CYS QB 589 VAL QG1 5.13  (#peak 2697     )
 &rst
  ixpk= 2697, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.92, r4= 7.42,
 igr1= 161, 162,
 igr2= 584, 585, 586,
 &end
#
# 562 CYS QB 605 ILE HB 4.44  (#peak 632     )
 &rst
  ixpk= 632, nxpk= 0, iat=  -1, 845, r1= 1.30, r2= 1.80, r3= 4.98, r4= 5.48,
 igr1= 161, 162,
 &end
#
# 562 CYS QB 605 ILE QG2 3.06  (#peak 827     )
 &rst
  ixpk= 827, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.12, r4= 4.62,
 igr1= 161, 162,
 igr2= 848, 849, 850,
 &end
#
# 562 CYS QB 605 ILE QD1 4.82  (#peak 2682     )
 &rst
  ixpk= 2682, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.50, r4= 7.00,
 igr1= 161, 162,
 igr2= 851, 852, 853,
 &end
#
# 562 CYS QB 606 LYS H 4.67  (#peak 564     )
 &rst
  ixpk= 564, nxpk= 0, iat=  -1, 863, r1= 1.30, r2= 1.80, r3= 5.24, r4= 5.74,
 igr1= 161, 162,
 &end
#
# 562 CYS QB 608 ILE QG1 5.34  (#peak 1709     )
 &rst
  ixpk= 1709, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.73, r4= 7.23,
 igr1= 161, 162,
 igr2= 901, 902,
 &end
#
# 565 LEU H 565 LEU QQD 3.78  (#peak 137     )
 &rst
  ixpk= 137, nxpk= 0, iat= 202, 199, r1= 1.30, r2= 1.80, r3= 5.98, r4= 6.48,  &end
#
# 565 LEU H 604 ASN QB 3.94  (#peak 679     )
 &rst
  ixpk= 679, nxpk= 0, iat= 202,  -1, r1= 1.30, r2= 1.80, r3= 4.42, r4= 4.92,
 igr2= 831, 832,
 &end
#
# 565 LEU HA 565 LEU QQD 2.93  (#peak 1335     )
 &rst
  ixpk= 1335, nxpk= 0, iat= 203, 199, r1= 1.30, r2= 1.80, r3= 5.13, r4= 5.63,  &end
#
# 565 LEU HB2 604 ASN QB 3.52  (#peak 684     )
 &rst
  ixpk= 684, nxpk= 0, iat= 204,  -1, r1= 1.30, r2= 1.80, r3= 3.95, r4= 4.45,
 igr2= 831, 832,
 &end
#
# 565 LEU HB3 604 ASN QB 3.68  (#peak 686     )
 &rst
  ixpk= 686, nxpk= 0, iat= 205,  -1, r1= 1.30, r2= 1.80, r3= 4.13, r4= 4.63,
 igr2= 831, 832,
 &end
#
# 565 LEU HG 566 TYR QB 5.34  (#peak 2167     )
 &rst
  ixpk= 2167, nxpk= 0, iat= 206,  -1, r1= 1.30, r2= 1.80, r3= 5.99, r4= 6.49,
 igr2= 227, 228,
 &end
#
# 565 LEU HG 604 ASN QB 4.05  (#peak 1698     )
 &rst
  ixpk= 1698, nxpk= 0, iat= 206,  -1, r1= 1.30, r2= 1.80, r3= 4.55, r4= 5.05,
 igr2= 831, 832,
 &end
#
# 565 LEU QQD 566 TYR H 3.30  (#peak 1325     )
 &rst
  ixpk= 1325, nxpk= 0, iat= 199, 225, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
# 565 LEU QQD 566 TYR QB 4.13  (#peak 1337     )
 &rst
  ixpk= 1337, nxpk= 0, iat= 199,  -1, r1= 1.30, r2= 1.80, r3= 6.84, r4= 7.34,
 igr2= 227, 228,
 &end
#
# 565 LEU QQD 567 TRP HA 5.16  (#peak 1098     )
 &rst
  ixpk= 1098, nxpk= 0, iat= 199, 249, r1= 1.30, r2= 1.80, r3= 7.36, r4= 7.86,  &end
#
# 565 LEU QQD 570 ASN H 4.29  (#peak 1327     )
 &rst
  ixpk= 1327, nxpk= 0, iat= 199, 293, r1= 1.30, r2= 1.80, r3= 6.49, r4= 6.99,  &end
#
# 565 LEU QQD 570 ASN HA 2.90  (#peak 1334     )
 &rst
  ixpk= 1334, nxpk= 0, iat= 199, 294, r1= 1.30, r2= 1.80, r3= 5.10, r4= 5.60,  &end
#
# 565 LEU QQD 570 ASN HB2 4.40  (#peak 626     )
 &rst
  ixpk= 626, nxpk= 0, iat= 199, 295, r1= 1.30, r2= 1.80, r3= 6.60, r4= 7.10,  &end
#
# 565 LEU QQD 570 ASN HB3 3.71  (#peak 1336     )
 &rst
  ixpk= 1336, nxpk= 0, iat= 199, 296, r1= 1.30, r2= 1.80, r3= 5.91, r4= 6.41,  &end
#
# 565 LEU QQD 571 LYS H 3.67  (#peak 1328     )
 &rst
  ixpk= 1328, nxpk= 0, iat= 199, 308, r1= 1.30, r2= 1.80, r3= 5.87, r4= 6.37,  &end
#
# 565 LEU QQD 571 LYS HA 3.74  (#peak 1333     )
 &rst
  ixpk= 1333, nxpk= 0, iat= 199, 309, r1= 1.30, r2= 1.80, r3= 5.94, r4= 6.44,  &end
#
# 565 LEU QQD 572 PHE H 4.30  (#peak 1326     )
 &rst
  ixpk= 1326, nxpk= 0, iat= 199, 332, r1= 1.30, r2= 1.80, r3= 6.50, r4= 7.00,  &end
#
# 565 LEU QQD 572 PHE HA 3.80  (#peak 1332     )
 &rst
  ixpk= 1332, nxpk= 0, iat= 199, 333, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,  &end
#
# 565 LEU QQD 572 PHE QE 3.92  (#peak 1331     )
 &rst
  ixpk= 1331, nxpk= 0, iat= 199,  -1, r1= 1.30, r2= 1.80, r3= 6.60, r4= 7.10,
 igr2= 338, 339,
 &end
#
# 565 LEU QQD 600 VAL QQG 4.74  (#peak 1339     )
 &rst
  ixpk= 1339, nxpk= 0, iat= 199, 760, r1= 1.30, r2= 1.80, r3= 9.14, r4= 9.64,  &end
#
# 565 LEU QQD 604 ASN QB 4.90  (#peak 2607     )
 &rst
  ixpk= 2607, nxpk= 0, iat= 199,  -1, r1= 1.30, r2= 1.80, r3= 7.70, r4= 8.20,
 igr2= 831, 832,
 &end
#
# 566 TYR H 566 TYR QB 3.52  (#peak 612     )
 &rst
  ixpk= 612, nxpk= 0, iat= 225,  -1, r1= 1.30, r2= 1.80, r3= 3.95, r4= 4.45,
 igr2= 227, 228,
 &end
#
# 566 TYR QB 567 TRP H 3.97  (#peak 152     )
 &rst
  ixpk= 152, nxpk= 0, iat=  -1, 248, r1= 1.30, r2= 1.80, r3= 4.46, r4= 4.96,
 igr1= 227, 228,
 &end
#
# 566 TYR QB 568 GLU QG 5.00  (#peak 2475     )
 &rst
  ixpk= 2475, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.30, r4= 6.80,
 igr1= 227, 228,
 igr2= 271, 272,
 &end
#
# 566 TYR QB 569 ASP H 4.04  (#peak 169     )
 &rst
  ixpk= 169, nxpk= 0, iat=  -1, 281, r1= 1.30, r2= 1.80, r3= 4.53, r4= 5.03,
 igr1= 227, 228,
 &end
#
# 566 TYR QB 571 LYS H 3.99  (#peak 199     )
 &rst
  ixpk= 199, nxpk= 0, iat=  -1, 308, r1= 1.30, r2= 1.80, r3= 4.48, r4= 4.98,
 igr1= 227, 228,
 &end
#
# 566 TYR QB 573 TYR QD 3.03  (#peak 163     )
 &rst
  ixpk= 163, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 3.82, r4= 4.32,
 igr1= 227, 228,
 igr2= 357, 358,
 &end
#
# 566 TYR QB 573 TYR QE 3.01  (#peak 181     )
 &rst
  ixpk= 181, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 3.79, r4= 4.29,
 igr1= 227, 228,
 igr2= 359, 360,
 &end
#
# 577 VAL HB 580 LEU QQD 5.01  (#peak 2440     )
 &rst
  ixpk= 2440, nxpk= 0, iat= 420, 457, r1= 1.30, r2= 1.80, r3= 7.21, r4= 7.71,  &end
#
# 577 VAL QG1 580 LEU QQD 2.86  (#peak 1522     )
 &rst
  ixpk= 1522, nxpk= 0, iat=  -1, 457, r1= 1.30, r2= 1.80, r3= 5.63, r4= 6.13,
 igr1= 421, 422, 423,
 &end
#
# 579 ALA HA 580 LEU QQD 4.15  (#peak 249     )
 &rst
  ixpk= 249, nxpk= 0, iat= 448, 457, r1= 1.30, r2= 1.80, r3= 6.35, r4= 6.85,  &end
#
# 580 LEU H 580 LEU QQD 3.87  (#peak 318     )
 &rst
  ixpk= 318, nxpk= 0, iat= 460, 457, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,  &end
#
# 580 LEU HA 580 LEU QQD 3.85  (#peak 57     )
 &rst
  ixpk= 57, nxpk= 0, iat= 461, 457, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55,  &end
#
# 580 LEU QB 580 LEU QQD 2.76  (#peak 1975     )
 &rst
  ixpk= 1975, nxpk= 0, iat=  -1, 457, r1= 1.30, r2= 1.80, r3= 5.30, r4= 5.80,
 igr1= 462, 463,
 &end
#
# 580 LEU QQD 581 HIS H 4.18  (#peak 336     )
 &rst
  ixpk= 336, nxpk= 0, iat= 457, 481, r1= 1.30, r2= 1.80, r3= 6.38, r4= 6.88,  &end
#
# 580 LEU QQD 587 ALA H 4.97  (#peak 1437     )
 &rst
  ixpk= 1437, nxpk= 0, iat= 457, 553, r1= 1.30, r2= 1.80, r3= 7.17, r4= 7.67,  &end
#
# 580 LEU QQD 587 ALA HA 3.52  (#peak 2364     )
 &rst
  ixpk= 2364, nxpk= 0, iat= 457, 554, r1= 1.30, r2= 1.80, r3= 5.72, r4= 6.22,  &end
#
# 580 LEU QQD 587 ALA QB 2.84  (#peak 1446     )
 &rst
  ixpk= 1446, nxpk= 0, iat= 457,  -1, r1= 1.30, r2= 1.80, r3= 5.61, r4= 6.11,
 igr2= 555, 556, 557,
 &end
#
# 580 LEU QQD 589 VAL H 5.24  (#peak 1437     )
 &rst
  ixpk= 1437, nxpk= 0, iat= 457, 581, r1= 1.30, r2= 1.80, r3= 7.44, r4= 7.94,  &end
#
# 580 LEU QQD 605 ILE QD1 3.70  (#peak 1448     )
 &rst
  ixpk= 1448, nxpk= 0, iat= 457,  -1, r1= 1.30, r2= 1.80, r3= 6.64, r4= 7.14,
 igr2= 851, 852, 853,
 &end
#
# 588 VAL HA 597 TYR QB 5.34  (#peak 2575     )
 &rst
  ixpk= 2575, nxpk= 0, iat= 566,  -1, r1= 1.30, r2= 1.80, r3= 5.99, r4= 6.49,
 igr2= 719, 720,
 &end
#
# 588 VAL QG1 597 TYR QB 3.09  (#peak 1984     )
 &rst
  ixpk= 1984, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.17, r4= 4.67,
 igr1= 568, 569, 570,
 igr2= 719, 720,
 &end
#
# 590 LYS HA 597 TYR QB 4.52  (#peak 46     )
 &rst
  ixpk= 46, nxpk= 0, iat= 600,  -1, r1= 1.30, r2= 1.80, r3= 5.07, r4= 5.57,
 igr2= 719, 720,
 &end
#
# 590 LYS HB2 590 LYS QE 4.12  (#peak 99     )
 &rst
  ixpk= 99, nxpk= 0, iat= 601,  -1, r1= 1.30, r2= 1.80, r3= 4.62, r4= 5.12,
 igr2= 607, 608,
 &end
#
# 590 LYS HB3 590 LYS QE 5.14  (#peak 478     )
 &rst
  ixpk= 478, nxpk= 0, iat= 602,  -1, r1= 1.30, r2= 1.80, r3= 5.77, r4= 6.27,
 igr2= 607, 608,
 &end
#
# 590 LYS QE 592 ILE HA 5.08  (#peak 1216     )
 &rst
  ixpk= 1216, nxpk= 0, iat=  -1, 641, r1= 1.30, r2= 1.80, r3= 5.70, r4= 6.20,
 igr1= 607, 608,
 &end
#
# 590 LYS QE 595 GLY H 4.41  (#peak 450     )
 &rst
  ixpk= 450, nxpk= 0, iat=  -1, 688, r1= 1.30, r2= 1.80, r3= 4.95, r4= 5.45,
 igr1= 607, 608,
 &end
#
# 590 LYS QE 595 GLY HA2 4.48  (#peak 1753     )
 &rst
  ixpk= 1753, nxpk= 0, iat=  -1, 689, r1= 1.30, r2= 1.80, r3= 5.03, r4= 5.53,
 igr1= 607, 608,
 &end
#
# 590 LYS QE 596 ASN H 4.14  (#peak 664     )
 &rst
  ixpk= 664, nxpk= 0, iat=  -1, 699, r1= 1.30, r2= 1.80, r3= 4.65, r4= 5.15,
 igr1= 607, 608,
 &end
#
# 596 ASN HA 597 TYR QB 5.34  (#peak 2575     )
 &rst
  ixpk= 2575, nxpk= 0, iat= 700,  -1, r1= 1.30, r2= 1.80, r3= 5.99, r4= 6.49,
 igr2= 719, 720,
 &end
#
# 597 TYR H 597 TYR QB 3.39  (#peak 378     )
 &rst
  ixpk= 378, nxpk= 0, iat= 717,  -1, r1= 1.30, r2= 1.80, r3= 3.81, r4= 4.31,
 igr2= 719, 720,
 &end
#
# 597 TYR QB 598 GLU H 3.63  (#peak 471     )
 &rst
  ixpk= 471, nxpk= 0, iat=  -1, 735, r1= 1.30, r2= 1.80, r3= 4.07, r4= 4.57,
 igr1= 719, 720,
 &end
#
# 600 VAL HA 604 ASN QB 5.02  (#peak 173     )
 &rst
  ixpk= 173, nxpk= 0, iat= 764,  -1, r1= 1.30, r2= 1.80, r3= 5.63, r4= 6.13,
 igr2= 831, 832,
 &end
#
# 600 VAL HB 604 ASN QB 4.70  (#peak 2611     )
 &rst
  ixpk= 2611, nxpk= 0, iat= 765,  -1, r1= 1.30, r2= 1.80, r3= 5.28, r4= 5.78,
 igr2= 831, 832,
 &end
#
# 600 VAL QQG 604 ASN QB 3.20  (#peak 1393     )
 &rst
  ixpk= 1393, nxpk= 0, iat= 760,  -1, r1= 1.30, r2= 1.80, r3= 5.79, r4= 6.29,
 igr2= 831, 832,
 &end
#
# 601 LEU H 604 ASN QB 3.89  (#peak 500     )
 &rst
  ixpk= 500, nxpk= 0, iat= 780,  -1, r1= 1.30, r2= 1.80, r3= 4.37, r4= 4.87,
 igr2= 831, 832,
 &end
#
# 601 LEU QB 603 SER QB 4.41  (#peak 1252     )
 &rst
  ixpk= 1252, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.56, r4= 6.06,
 igr1= 782, 783,
 igr2= 818, 819,
 &end
#
# 601 LEU QB 604 ASN QB 4.57  (#peak 1011     )
 &rst
  ixpk= 1011, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.76, r4= 6.26,
 igr1= 782, 783,
 igr2= 831, 832,
 &end
#
# 601 LEU HG 603 SER QB 5.34  (#peak 2604     )
 &rst
  ixpk= 2604, nxpk= 0, iat= 784,  -1, r1= 1.30, r2= 1.80, r3= 5.99, r4= 6.49,
 igr2= 818, 819,
 &end
#
# 601 LEU HG 604 ASN QB 4.88  (#peak 551     )
 &rst
  ixpk= 551, nxpk= 0, iat= 784,  -1, r1= 1.30, r2= 1.80, r3= 5.48, r4= 5.98,
 igr2= 831, 832,
 &end
#
# 601 LEU QQD 603 SER QB 4.16  (#peak 2605     )
 &rst
  ixpk= 2605, nxpk= 0, iat= 777,  -1, r1= 1.30, r2= 1.80, r3= 6.87, r4= 7.37,
 igr2= 818, 819,
 &end
#
# 602 LEU QB 603 SER QB 5.34  (#peak 2604     )
 &rst
  ixpk= 2604, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.73, r4= 7.23,
 igr1= 801, 802,
 igr2= 818, 819,
 &end
#
# 603 SER H 603 SER QB 3.63  (#peak 2601     )
 &rst
  ixpk= 2601, nxpk= 0, iat= 816,  -1, r1= 1.30, r2= 1.80, r3= 4.07, r4= 4.57,
 igr2= 818, 819,
 &end
#
# 603 SER QB 604 ASN HA 5.16  (#peak 2592     )
 &rst
  ixpk= 2592, nxpk= 0, iat=  -1, 830, r1= 1.30, r2= 1.80, r3= 5.79, r4= 6.29,
 igr1= 818, 819,
 &end
#
# 603 SER QB 605 ILE H 5.34  (#peak 2593     )
 &rst
  ixpk= 2593, nxpk= 0, iat=  -1, 843, r1= 1.30, r2= 1.80, r3= 5.99, r4= 6.49,
 igr1= 818, 819,
 &end
#
# 604 ASN H 604 ASN QB 3.01  (#peak 530)
 &rst
  ixpk= 530, nxpk= 0, iat= 829,  -1, r1= 1.30, r2= 1.80, r3= 3.38, r4= 3.88,
 igr2= 831, 832,
 &end
#
# 617 DA2 QHC1 573 TYR QD 5.0  (#peak 9999)
 &rst
  ixpk= 9999, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.74, r4= 7.24,
 igr1=1055,1056,1057,
 igr2= 357, 358,
 &end
#
# 617 DA2 QHC2 573 TYR QE 4.0  (#peak 9999)
 &rst
  ixpk= 9999, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.39, r4= 5.89,
 igr1=1052,1053,1054,
 igr2= 359, 360,
 &end
#
# 617 DA2 QHC2 594 TYR HE1 4.0  (#peak 9999)
 &rst
  ixpk= 9999, nxpk= 0, iat=  -1, 681, r1= 1.30, r2= 1.80, r3= 4.80, r4= 5.30,
 igr1=1052,1053,1054,
 &end
#
# 617 DA2 QHC1 594 TYR HD1 4.0  (#peak 9999)
 &rst
  ixpk= 9999, nxpk= 0, iat=  -1, 679, r1= 1.30, r2= 1.80, r3= 4.80, r4= 5.30,
 igr1=1055,1056,1057,
 &end
#
# 617 DA2 HCD1 566 TYR HE1 5.0  (#peak 9999)
 &rst
  ixpk= 9999, nxpk= 0, iat=1048, 231, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50,  &end
#
# 617 DA2 HCD1 566 TYR HE2 5.0  (#peak 9999)
 &rst
  ixpk= 9999, nxpk= 0, iat=1048, 232, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50,  &end
#
# 617 DA2 HCD2 594 TYR HE2 5.0  (#peak 9999)
 &rst
  ixpk= 9999, nxpk= 0, iat=1047, 682, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50,  &end
#
# 617 DA2 HCD2 594 TYR HD2 4.0  (#peak 9999)
 &rst
  ixpk= 9999, nxpk= 0, iat=1047, 680, r1= 1.30, r2= 1.80, r3= 4.00, r4= 4.50,  &end
#
# 617 DA2 QHC2 566 TYR HE2 4.0  (#peak 9999)
 &rst
  ixpk= 9999, nxpk= 0, iat=  -1, 232, r1= 1.30, r2= 1.80, r3= 4.80, r4= 5.30,
 igr1=1052,1053,1054,
 &end
#
# 617 DA2 QHC1 566 TYR HE1 4.5  (#peak 9999)
 &rst
  ixpk= 9999, nxpk= 0, iat=  -1, 231, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr1=1055,1056,1057,
 &end
#
# 618 TYR HH 568 GLU CD 6.0  (#peak 9999)
 &rst
  ixpk= 9999, nxpk= 0, iat=1078, 264, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,  &end

  Entry H atom name         Submitted Coord H atom name
  Start of MODEL    1
    1    H1   MET 553           H1       MET 553  20.500  39.602  23.291
    2    H2   MET 553           H2       MET 553  20.827  39.706  24.877
    3    H3   MET 553           H3       MET 553  21.544  38.548  23.984
    4    HA   MET 553           HA       MET 553  21.985  41.387  23.484
    5    HB2  MET 553           HB2      MET 553  24.322  40.835  24.301
    6    HB3  MET 553           HB3      MET 553  23.125  41.311  25.437
    7    HG2  MET 553           HG2      MET 553  24.134  38.437  24.998
    8    HG3  MET 553           HG3      MET 553  24.502  39.479  26.346
    9    HE1  MET 553           HE1      MET 553  24.106  37.051  27.604
   10    HE2  MET 553           HE2      MET 553  22.568  36.188  27.556
   11    HE3  MET 553           HE3      MET 553  23.511  36.384  26.070
   12    H    LYS 554           H        LYS 554  23.125  41.850  21.753
   13    HA   LYS 554           HA       LYS 554  24.415  39.761  20.073
   14    HB2  LYS 554           HB2      LYS 554  21.794  40.157  19.543
   15    HB3  LYS 554           HB3      LYS 554  22.424  41.597  18.770
   16    HG2  LYS 554           HG2      LYS 554  22.385  40.029  17.044
   17    HG3  LYS 554           HG3      LYS 554  24.074  39.994  17.552
   18    HD2  LYS 554           HD2      LYS 554  23.735  37.927  18.797
   19    HD3  LYS 554           HD3      LYS 554  21.990  37.937  18.418
   20    HE2  LYS 554           HE2      LYS 554  22.352  37.757  16.109
   21    HE3  LYS 554           HE3      LYS 554  24.054  38.139  16.219
   22    HZ1  LYS 554           HZ1      LYS 554  23.921  35.808  15.940
   23    HZ2  LYS 554           HZ2      LYS 554  24.367  36.042  17.472
   24    HZ3  LYS 554           HZ3      LYS 554  22.832  35.589  17.115
   25    H    MET 555           H        MET 555  26.051  40.579  18.837
   26    HA   MET 555           HA       MET 555  27.784  41.856  18.280
   27    HB2  MET 555           HB2      MET 555  25.538  43.810  17.671
   28    HB3  MET 555           HB3      MET 555  27.188  43.980  17.073
   29    HG2  MET 555           HG2      MET 555  27.073  41.844  15.961
   30    HG3  MET 555           HG3      MET 555  25.368  41.644  16.396
   31    HE1  MET 555           HE1      MET 555  28.047  43.306  14.514
   32    HE2  MET 555           HE2      MET 555  27.275  44.319  13.270
   33    HE3  MET 555           HE3      MET 555  27.379  44.880  14.976
   34    H    TRP 556           H        TRP 556  28.337  41.905  20.810
   35    HA   TRP 556           HA       TRP 556  28.511  44.264  22.275
   36    HB2  TRP 556           HB2      TRP 556  30.218  41.828  21.980
   37    HB3  TRP 556           HB3      TRP 556  30.819  43.165  22.943
   38    HD1  TRP 556           HD1      TRP 556  29.720  40.086  23.791
   39    HE1  TRP 556           HE1      TRP 556  28.321  39.951  25.930
   40    HE3  TRP 556           HE3      TRP 556  28.278  44.987  24.178
   41    HZ2  TRP 556           HZ2      TRP 556  26.734  41.620  27.521
   42    HZ3  TRP 556           HZ3      TRP 556  26.761  45.667  25.992
   43    HH2  TRP 556           HH2      TRP 556  26.019  44.055  27.712
   44    H    LYS 557           H        LYS 557  30.251  45.718  22.671
   45    HA   LYS 557           HA       LYS 557  32.231  46.555  20.633
   46    HB2  LYS 557           HB2      LYS 557  29.634  47.991  21.280
   47    HB3  LYS 557           HB3      LYS 557  31.048  48.916  20.781
   48    HG2  LYS 557           HG2      LYS 557  31.208  47.449  18.734
   49    HG3  LYS 557           HG3      LYS 557  29.648  46.759  19.192
   50    HD2  LYS 557           HD2      LYS 557  28.634  49.087  19.128
   51    HD3  LYS 557           HD3      LYS 557  30.160  49.741  18.552
   52    HE2  LYS 557           HE2      LYS 557  28.529  47.602  17.163
   53    HE3  LYS 557           HE3      LYS 557  28.576  49.321  16.771
   54    HZ1  LYS 557           HZ1      LYS 557  30.218  47.571  15.616
   55    HZ2  LYS 557           HZ2      LYS 557  30.561  49.148  15.806
   56    HZ3  LYS 557           HZ3      LYS 557  31.179  48.009  16.822
   57    HA   PRO 558           HA       PRO 558  34.218  48.087  24.251
   58    HB2  PRO 558           HB2      PRO 558  35.796  50.134  23.383
   59    HB3  PRO 558           HB3      PRO 558  36.037  48.450  22.934
   60    HG2  PRO 558           HG2      PRO 558  34.529  50.558  21.359
   61    HG3  PRO 558           HG3      PRO 558  35.839  49.484  20.759
   62    HD2  PRO 558           HD2      PRO 558  33.250  48.811  20.346
   63    HD3  PRO 558           HD3      PRO 558  34.478  47.597  20.776
   64    H    GLY 559           H        GLY 559  34.108  49.479  25.964
   65    HA2  GLY 559           HA2      GLY 559  33.772  51.367  27.163
   66    HA3  GLY 559           HA3      GLY 559  33.321  52.231  25.675
   67    H    ASP 560           H        ASP 560  32.079  49.550  27.670
   68    HA   ASP 560           HA       ASP 560  29.567  50.955  28.412
   69    HB2  ASP 560           HB2      ASP 560  29.846  48.760  26.402
   70    HB3  ASP 560           HB3      ASP 560  28.632  48.453  27.619
   71    H    GLU 561           H        GLU 561  29.487  50.771  30.493
   72    HA   GLU 561           HA       GLU 561  30.250  48.543  31.957
   73    HB2  GLU 561           HB2      GLU 561  28.582  49.130  33.656
   74    HB3  GLU 561           HB3      GLU 561  29.499  50.529  33.093
   75    HG2  GLU 561           HG2      GLU 561  26.670  49.885  32.125
   76    HG3  GLU 561           HG3      GLU 561  27.025  50.796  33.572
   77    H    CYS 562           H        CYS 562  29.588  46.327  32.168
   78    HA   CYS 562           HA       CYS 562  26.914  45.410  31.428
   79    HB2  CYS 562           HB2      CYS 562  29.423  44.190  30.157
   80    HB3  CYS 562           HB3      CYS 562  27.785  43.731  29.818
   81    HG   CYS 562           HG       CYS 562  28.954  46.773  29.330
   82    H    PHE 563           H        PHE 563  27.158  42.682  31.737
   83    HA   PHE 563           HA       PHE 563  28.630  42.211  34.301
   84    HB2  PHE 563           HB2      PHE 563  25.781  41.666  33.552
   85    HB3  PHE 563           HB3      PHE 563  26.670  40.334  34.272
   86    HD1  PHE 563           HD1      PHE 563  27.561  40.521  36.641
   87    HD2  PHE 563           HD2      PHE 563  25.007  43.476  34.821
   88    HE1  PHE 563           HE1      PHE 563  27.152  41.547  38.860
   89    HE2  PHE 563           HE2      PHE 563  24.485  44.404  37.054
   90    HZ   PHE 563           HZ       PHE 563  25.676  43.569  39.044
   91    H    ALA 564           H        ALA 564  30.140  40.863  34.070
   92    HA   ALA 564           HA       ALA 564  30.265  38.875  31.817
   93    HB1  ALA 564           HB1      ALA 564  31.917  40.558  31.553
   94    HB2  ALA 564           HB2      ALA 564  32.450  40.402  33.249
   95    HB3  ALA 564           HB3      ALA 564  32.689  39.046  32.133
   96    H    LEU 565           H        LEU 565  30.393  36.901  32.239
   97    HA   LEU 565           HA       LEU 565  30.141  35.737  34.809
   98    HB2  LEU 565           HB2      LEU 565  29.189  34.966  32.566
   99    HB3  LEU 565           HB3      LEU 565  30.854  34.523  32.115
  100    HG   LEU 565           HG       LEU 565  30.878  32.806  33.784
  101   HD11  LEU 565          HD11      LEU 565  27.881  33.366  34.156
  102   HD12  LEU 565          HD12      LEU 565  28.852  32.177  35.026
  103   HD13  LEU 565          HD13      LEU 565  29.126  33.914  35.297
  104   HD21  LEU 565          HD21      LEU 565  28.984  31.394  32.604
  105   HD22  LEU 565          HD22      LEU 565  28.683  32.846  31.660
  106   HD23  LEU 565          HD23      LEU 565  30.270  32.085  31.579
  107    H    TYR 566           H        TYR 566  31.863  35.461  36.240
  108    HA   TYR 566           HA       TYR 566  34.613  35.157  35.369
  109    HB2  TYR 566           HB2      TYR 566  33.617  36.366  37.422
  110    HB3  TYR 566           HB3      TYR 566  33.391  34.779  38.136
  111    HD1  TYR 566           HD1      TYR 566  36.038  36.618  36.231
  112    HD2  TYR 566           HD2      TYR 566  35.030  34.267  39.662
  113    HE1  TYR 566           HE1      TYR 566  38.397  36.788  37.002
  114    HE2  TYR 566           HE2      TYR 566  37.373  34.503  40.528
  115    HH   TYR 566           HH       TYR 566  39.883  36.146  38.601
  116    H    TRP 567           H        TRP 567  35.780  33.318  36.925
  117    HA   TRP 567           HA       TRP 567  34.932  30.763  35.594
  118    HB2  TRP 567           HB2      TRP 567  37.364  30.245  35.555
  119    HB3  TRP 567           HB3      TRP 567  36.979  31.658  34.646
  120    HD1  TRP 567           HD1      TRP 567  38.110  33.877  35.291
  121    HE1  TRP 567           HE1      TRP 567  39.930  34.551  36.952
  122    HE3  TRP 567           HE3      TRP 567  38.081  29.737  38.291
  123    HZ2  TRP 567           HZ2      TRP 567  41.096  33.541  39.401
  124    HZ3  TRP 567           HZ3      TRP 567  39.572  29.628  40.282
  125    HH2  TRP 567           HH2      TRP 567  41.087  31.494  40.819
  126    H    GLU 568           H        GLU 568  35.800  32.152  38.735
  127    HA   GLU 568           HA       GLU 568  36.611  29.741  40.054
  128    HB2  GLU 568           HB2      GLU 568  37.427  31.384  41.397
  129    HB3  GLU 568           HB3      GLU 568  36.525  32.563  40.457
  130    HG2  GLU 568           HG2      GLU 568  34.658  32.539  41.980
  131    HG3  GLU 568           HG3      GLU 568  35.363  31.221  42.941
  132    H    ASP 569           H        ASP 569  33.594  31.499  39.989
  133    HA   ASP 569           HA       ASP 569  32.239  29.184  41.248
  134    HB2  ASP 569           HB2      ASP 569  30.997  30.493  42.582
  135    HB3  ASP 569           HB3      ASP 569  32.648  31.187  42.816
  136    H    ASN 570           H        ASN 570  32.572  30.817  38.582
  137    HA   ASN 570           HA       ASN 570  31.385  31.541  36.819
  138    HB2  ASN 570           HB2      ASN 570  31.422  28.950  36.967
  139    HB3  ASN 570           HB3      ASN 570  29.719  29.077  37.382
  140   HD21  ASN 570          HD22      ASN 570  31.877  30.711  34.923
  141   HD22  ASN 570          HD21      ASN 570  30.913  30.146  33.561
  142    H    LYS 571           H        LYS 571  30.668  33.325  38.193
  143    HA   LYS 571           HA       LYS 571  27.746  33.706  37.943
  144    HB2  LYS 571           HB2      LYS 571  29.385  33.915  40.416
  145    HB3  LYS 571           HB3      LYS 571  28.686  35.447  40.022
  146    HG2  LYS 571           HG2      LYS 571  27.094  32.874  40.265
  147    HG3  LYS 571           HG3      LYS 571  27.253  34.120  41.515
  148    HD2  LYS 571           HD2      LYS 571  26.147  35.758  40.068
  149    HD3  LYS 571           HD3      LYS 571  25.957  34.546  38.777
  150    HE2  LYS 571           HE2      LYS 571  24.774  34.565  41.558
  151    HE3  LYS 571           HE3      LYS 571  23.869  34.760  40.033
  152    HZ1  LYS 571           HZ1      LYS 571  23.587  32.510  40.763
  153    HZ2  LYS 571           HZ2      LYS 571  24.776  32.387  39.628
  154    HZ3  LYS 571           HZ3      LYS 571  25.152  32.430  41.200
  155    H    PHE 572           H        PHE 572  27.171  35.817  37.400
  156    HA   PHE 572           HA       PHE 572  29.153  37.314  35.819
  157    HB2  PHE 572           HB2      PHE 572  26.320  37.971  36.667
  158    HB3  PHE 572           HB3      PHE 572  27.182  38.650  35.288
  159    HD1  PHE 572           HD2      PHE 572  27.816  37.073  33.359
  160    HD2  PHE 572           HD1      PHE 572  24.876  36.033  36.328
  161    HE1  PHE 572           HE2      PHE 572  26.732  35.445  31.759
  162    HE2  PHE 572           HE1      PHE 572  23.741  34.563  34.682
  163    HZ   PHE 572           HZ       PHE 572  24.749  34.180  32.454
  164    H    TYR 573           H        TYR 573  30.123  39.133  36.367
  165    HA   TYR 573           HA       TYR 573  29.388  40.550  38.878
  166    HB2  TYR 573           HB2      TYR 573  32.197  39.973  37.832
  167    HB3  TYR 573           HB3      TYR 573  31.836  40.996  39.216
  168    HD1  TYR 573           HD2      TYR 573  31.794  37.530  37.911
  169    HD2  TYR 573           HD1      TYR 573  31.306  40.017  41.395
  170    HE1  TYR 573           HE2      TYR 573  31.872  35.501  39.370
  171    HE2  TYR 573           HE1      TYR 573  31.379  37.957  42.841
  172    HH   TYR 573           HH       TYR 573  31.718  34.753  41.523
  173    H    ARG 574           H        ARG 574  29.744  42.908  38.719
  174    HA   ARG 574           HA       ARG 574  29.355  44.078  36.123
  175    HB2  ARG 574           HB2      ARG 574  29.336  46.175  37.270
  176    HB3  ARG 574           HB3      ARG 574  28.472  44.915  38.172
  177    HG2  ARG 574           HG2      ARG 574  30.501  44.836  39.714
  178    HG3  ARG 574           HG3      ARG 574  31.028  46.354  38.977
  179    HD2  ARG 574           HD2      ARG 574  28.228  45.888  40.068
  180    HD3  ARG 574           HD3      ARG 574  29.515  46.635  41.009
  181    HE   ARG 574           HE       ARG 574  27.875  47.778  38.798
  182   HH11  ARG 574          HH11      ARG 574  30.708  48.368  40.901
  183   HH12  ARG 574          HH12      ARG 574  30.556  50.082  40.648
  184   HH21  ARG 574          HH21      ARG 574  28.092  50.008  38.372
  185   HH22  ARG 574          HH22      ARG 574  29.395  50.890  39.149
  186    H    ALA 575           H        ALA 575  30.701  44.387  34.571
  187    HA   ALA 575           HA       ALA 575  33.306  45.596  35.194
  188    HB1  ALA 575           HB1      ALA 575  32.852  43.375  33.097
  189    HB2  ALA 575           HB2      ALA 575  34.373  44.218  33.331
  190    HB3  ALA 575           HB3      ALA 575  33.773  43.133  34.590
  191    H    GLU 576           H        GLU 576  33.904  47.239  33.964
  192    HA   GLU 576           HA       GLU 576  32.186  48.316  31.849
  193    HB2  GLU 576           HB2      GLU 576  34.750  49.168  33.236
  194    HB3  GLU 576           HB3      GLU 576  34.105  50.048  31.829
  195    HG2  GLU 576           HG2      GLU 576  31.881  50.062  33.264
  196    HG3  GLU 576           HG3      GLU 576  33.021  49.775  34.604
  197    H    VAL 577           H        VAL 577  32.347  47.660  29.874
  198    HA   VAL 577           HA       VAL 577  34.224  45.752  28.882
  199    HB   VAL 577           HB       VAL 577  32.027  47.556  27.848
  200   HG11  VAL 577          HG11      VAL 577  33.981  46.009  26.155
  201   HG12  VAL 577          HG12      VAL 577  32.314  46.358  25.603
  202   HG13  VAL 577          HG13      VAL 577  33.421  47.689  26.011
  203   HG21  VAL 577          HG21      VAL 577  31.265  45.465  28.868
  204   HG22  VAL 577          HG22      VAL 577  30.994  45.448  27.123
  205   HG23  VAL 577          HG23      VAL 577  32.370  44.535  27.808
  206    H    GLU 578           H        GLU 578  36.108  45.973  27.911
  207    HA   GLU 578           HA       GLU 578  37.115  48.714  27.405
  208    HB2  GLU 578           HB2      GLU 578  38.489  47.725  29.041
  209    HB3  GLU 578           HB3      GLU 578  38.146  46.114  28.492
  210    HG2  GLU 578           HG2      GLU 578  40.395  46.205  28.067
  211    HG3  GLU 578           HG3      GLU 578  39.664  46.378  26.529
  212    H    ALA 579           H        ALA 579  37.169  45.452  25.968
  213    HA   ALA 579           HA       ALA 579  37.119  46.539  23.271
  214    HB1  ALA 579           HB1      ALA 579  39.608  45.185  24.401
  215    HB2  ALA 579           HB2      ALA 579  39.373  45.490  22.664
  216    HB3  ALA 579           HB3      ALA 579  39.495  46.854  23.780
  217    H    LEU 580           H        LEU 580  35.573  45.227  22.478
  218    HA   LEU 580           HA       LEU 580  35.657  42.267  22.976
  219    HB2  LEU 580           HB2      LEU 580  33.217  43.981  22.403
  220    HB3  LEU 580           HB3      LEU 580  33.197  42.314  22.893
  221    HG   LEU 580           HG       LEU 580  33.304  44.835  24.371
  222   HD11  LEU 580          HD11      LEU 580  31.977  42.157  24.870
  223   HD12  LEU 580          HD12      LEU 580  32.246  43.144  26.274
  224   HD13  LEU 580          HD13      LEU 580  31.290  43.792  24.974
  225   HD21  LEU 580          HD21      LEU 580  35.227  44.501  25.440
  226   HD22  LEU 580          HD22      LEU 580  34.271  43.521  26.517
  227   HD23  LEU 580          HD23      LEU 580  35.218  42.739  25.228
  228    H    HIS 581           H        HIS 581  37.165  42.937  21.080
  229    HA   HIS 581           HA       HIS 581  35.884  42.490  18.443
  230    HB2  HIS 581           HB2      HIS 581  36.318  44.728  17.555
  231    HB3  HIS 581           HB3      HIS 581  35.275  44.828  18.953
  232    HD2  HIS 581           HD2      HIS 581  38.906  45.732  17.928
  233    HE1  HIS 581           HE1      HIS 581  38.190  47.612  21.647
  234    HE2  HIS 581           HE2      HIS 581  39.835  47.304  19.772
  235    H    SER 582           H        SER 582  38.480  42.058  20.235
  236    HA   SER 582           HA       SER 582  40.546  41.910  18.103
  237    HB2  SER 582           HB2      SER 582  42.123  43.082  19.591
  238    HB3  SER 582           HB3      SER 582  40.710  44.086  19.235
  239    HG   SER 582           HG       SER 582  41.355  43.899  21.469
  240    H    SER 583           H        SER 583  38.989  39.832  19.881
  241    HA   SER 583           HA       SER 583  41.316  38.327  20.956
  242    HB2  SER 583           HB2      SER 583  40.281  39.885  22.755
  243    HB3  SER 583           HB3      SER 583  38.852  38.865  22.646
  244    HG   SER 583           HG       SER 583  40.070  37.240  23.458
  245    H    GLY 584           H        GLY 584  39.030  38.142  18.812
  246    HA2  GLY 584           HA2      GLY 584  37.848  36.604  17.689
  247    HA3  GLY 584           HA3      GLY 584  38.621  35.323  18.629
  248    H    MET 585           H        MET 585  37.135  34.132  19.454
  249    HA   MET 585           HA       MET 585  34.476  34.847  20.189
  250    HB2  MET 585           HB2      MET 585  34.181  32.675  20.978
  251    HB3  MET 585           HB3      MET 585  35.212  32.585  19.550
  252    HG2  MET 585           HG2      MET 585  36.239  32.540  22.411
  253    HG3  MET 585           HG3      MET 585  35.923  31.097  21.455
  254    HE1  MET 585           HE1      MET 585  38.704  31.835  22.857
  255    HE2  MET 585           HE2      MET 585  39.958  32.409  21.748
  256    HE3  MET 585           HE3      MET 585  38.786  33.573  22.411
  257    H    THR 586           H        THR 586  37.369  35.537  22.106
  258    HA   THR 586           HA       THR 586  35.518  36.174  24.391
  259    HB   THR 586           HB       THR 586  37.508  36.587  25.741
  260    HG1  THR 586           HG1      THR 586  39.323  35.379  24.556
  261   HG21  THR 586          HG21      THR 586  37.483  34.334  26.340
  262   HG22  THR 586          HG22      THR 586  36.383  34.131  24.956
  263   HG23  THR 586          HG23      THR 586  38.097  33.830  24.762
  264    H    ALA 587           H        ALA 587  36.379  38.121  25.673
  265    HA   ALA 587           HA       ALA 587  36.469  40.522  24.063
  266    HB1  ALA 587           HB1      ALA 587  34.242  40.912  25.783
  267    HB2  ALA 587           HB2      ALA 587  34.186  40.777  24.027
  268    HB3  ALA 587           HB3      ALA 587  33.915  39.349  25.111
  269    H    VAL 588           H        VAL 588  37.360  42.119  25.380
  270    HA   VAL 588           HA       VAL 588  38.297  41.245  28.072
  271    HB   VAL 588           HB       VAL 588  39.187  43.694  26.532
  272   HG11  VAL 588          HG11      VAL 588  40.598  41.882  28.527
  273   HG12  VAL 588          HG12      VAL 588  41.147  43.479  27.948
  274   HG13  VAL 588          HG13      VAL 588  39.723  43.349  28.996
  275   HG21  VAL 588          HG21      VAL 588  41.182  42.149  25.803
  276   HG22  VAL 588          HG22      VAL 588  40.132  40.806  26.329
  277   HG23  VAL 588          HG23      VAL 588  39.700  41.883  24.952
  278    H    VAL 589           H        VAL 589  37.702  42.238  29.939
  279    HA   VAL 589           HA       VAL 589  36.152  44.746  29.840
  280    HB   VAL 589           HB       VAL 589  34.391  43.711  31.223
  281   HG11  VAL 589          HG11      VAL 589  34.231  43.873  28.624
  282   HG12  VAL 589          HG12      VAL 589  34.361  42.132  28.622
  283   HG13  VAL 589          HG13      VAL 589  33.057  42.849  29.543
  284   HG21  VAL 589          HG21      VAL 589  35.574  41.543  31.954
  285   HG22  VAL 589          HG22      VAL 589  34.000  41.258  31.171
  286   HG23  VAL 589          HG23      VAL 589  35.503  41.012  30.279
  287    H    LYS 590           H        LYS 590  36.339  45.997  31.733
  288    HA   LYS 590           HA       LYS 590  38.238  45.014  33.775
  289    HB2  LYS 590           HB2      LYS 590  39.028  46.944  32.941
  290    HB3  LYS 590           HB3      LYS 590  37.486  47.801  32.889
  291    HG2  LYS 590           HG2      LYS 590  37.558  48.282  35.270
  292    HG3  LYS 590           HG3      LYS 590  38.804  47.040  35.528
  293    HD2  LYS 590           HD2      LYS 590  40.439  48.221  34.477
  294    HD3  LYS 590           HD3      LYS 590  39.313  49.299  33.600
  295    HE2  LYS 590           HE2      LYS 590  39.690  49.481  36.603
  296    HE3  LYS 590           HE3      LYS 590  40.878  50.129  35.468
  297    HZ1  LYS 590           HZ1      LYS 590  39.097  51.500  34.491
  298    HZ2  LYS 590           HZ2      LYS 590  38.064  50.991  35.653
  299    HZ3  LYS 590           HZ3      LYS 590  39.347  51.831  36.054
  300    H    PHE 591           H        PHE 591  37.414  44.162  35.506
  301    HA   PHE 591           HA       PHE 591  34.657  44.289  36.332
  302    HB2  PHE 591           HB2      PHE 591  37.123  43.252  37.742
  303    HB3  PHE 591           HB3      PHE 591  35.476  43.137  38.342
  304    HD1  PHE 591           HD2      PHE 591  33.646  42.065  37.008
  305    HD2  PHE 591           HD1      PHE 591  37.798  41.668  35.840
  306    HE1  PHE 591           HE2      PHE 591  33.085  40.108  35.597
  307    HE2  PHE 591           HE1      PHE 591  37.233  39.569  34.663
  308    HZ   PHE 591           HZ       PHE 591  34.887  38.761  34.586
  309    H    ILE 592           H        ILE 592  33.668  46.017  37.066
  310    HA   ILE 592           HA       ILE 592  35.008  48.416  37.733
  311    HB   ILE 592           HB       ILE 592  32.243  48.218  38.799
  312   HG12  ILE 592          HG12      ILE 592  32.941  47.882  35.899
  313   HG13  ILE 592          HG13      ILE 592  31.794  46.955  36.903
  314   HG21  ILE 592          HG21      ILE 592  33.667  50.279  38.842
  315   HG22  ILE 592          HG22      ILE 592  33.660  50.288  37.073
  316   HG23  ILE 592          HG23      ILE 592  32.144  50.477  38.004
  317   HD11  ILE 592          HD11      ILE 592  31.350  49.775  35.886
  318   HD12  ILE 592          HD12      ILE 592  30.584  48.300  35.287
  319   HD13  ILE 592          HD13      ILE 592  30.230  48.850  36.930
  320    H    ASP 593           H        ASP 593  33.715  45.954  39.901
  321    HA   ASP 593           HA       ASP 593  34.299  47.579  42.306
  322    HB2  ASP 593           HB2      ASP 593  33.416  44.671  42.213
  323    HB3  ASP 593           HB3      ASP 593  33.506  45.735  43.610
  324    H    TYR 594           H        TYR 594  36.290  45.787  40.305
  325    HA   TYR 594           HA       TYR 594  38.215  44.949  42.480
  326    HB2  TYR 594           HB2      TYR 594  37.826  43.862  39.695
  327    HB3  TYR 594           HB3      TYR 594  38.954  43.247  40.899
  328    HD1  TYR 594           HD1      TYR 594  35.291  43.714  40.220
  329    HD2  TYR 594           HD2      TYR 594  38.306  41.736  42.599
  330    HE1  TYR 594           HE1      TYR 594  33.606  42.130  41.002
  331    HE2  TYR 594           HE2      TYR 594  36.522  40.295  43.607
  332    HH   TYR 594           HH       TYR 594  33.156  40.600  42.618
  333    H    GLY 595           H        GLY 595  38.010  46.465  39.236
  334    HA2  GLY 595           HA2      GLY 595  39.234  48.493  38.893
  335    HA3  GLY 595           HA3      GLY 595  40.436  47.940  40.037
  336    H    ASN 596           H        ASN 596  39.808  45.365  37.789
  337    HA   ASN 596           HA       ASN 596  41.942  46.272  35.968
  338    HB2  ASN 596           HB2      ASN 596  43.301  44.372  36.205
  339    HB3  ASN 596           HB3      ASN 596  43.100  45.176  37.762
  340   HD21  ASN 596          HD22      ASN 596  44.099  43.180  38.504
  341   HD22  ASN 596          HD21      ASN 596  43.085  41.807  38.886
  342    H    TYR 597           H        TYR 597  42.238  44.633  34.130
  343    HA   TYR 597           HA       TYR 597  39.577  43.506  33.396
  344    HB2  TYR 597           HB2      TYR 597  40.582  43.857  30.983
  345    HB3  TYR 597           HB3      TYR 597  39.466  44.929  31.770
  346    HD1  TYR 597           HD2      TYR 597  41.321  46.679  33.432
  347    HD2  TYR 597           HD1      TYR 597  41.749  45.045  29.472
  348    HE1  TYR 597           HE2      TYR 597  42.746  48.522  32.858
  349    HE2  TYR 597           HE1      TYR 597  43.045  46.995  28.777
  350    HH   TYR 597           HH       TYR 597  43.609  49.310  29.506
  351    H    GLU 598           H        GLU 598  39.333  41.734  32.303
  352    HA   GLU 598           HA       GLU 598  41.603  40.280  31.172
  353    HB2  GLU 598           HB2      GLU 598  40.800  38.104  32.214
  354    HB3  GLU 598           HB3      GLU 598  41.552  39.232  33.362
  355    HG2  GLU 598           HG2      GLU 598  39.103  39.944  33.860
  356    HG3  GLU 598           HG3      GLU 598  38.667  38.526  32.877
  357    H    GLU 599           H        GLU 599  40.875  38.479  29.798
  358    HA   GLU 599           HA       GLU 599  38.521  39.178  28.229
  359    HB2  GLU 599           HB2      GLU 599  39.272  37.787  26.646
  360    HB3  GLU 599           HB3      GLU 599  40.710  38.573  27.249
  361    HG2  GLU 599           HG2      GLU 599  39.753  35.747  27.819
  362    HG3  GLU 599           HG3      GLU 599  41.043  36.189  26.701
  363    H    VAL 600           H        VAL 600  36.707  38.218  28.089
  364    HA   VAL 600           HA       VAL 600  36.078  35.641  29.401
  365    HB   VAL 600           HB       VAL 600  34.338  38.174  29.571
  366   HG11  VAL 600          HG11      VAL 600  32.907  36.137  29.331
  367   HG12  VAL 600          HG12      VAL 600  33.576  35.602  30.915
  368   HG13  VAL 600          HG13      VAL 600  32.678  37.109  30.768
  369   HG21  VAL 600          HG21      VAL 600  36.036  38.284  31.294
  370   HG22  VAL 600          HG22      VAL 600  34.588  37.656  32.107
  371   HG23  VAL 600          HG23      VAL 600  35.887  36.551  31.643
  372    H    LEU 601           H        LEU 601  34.634  34.368  28.143
  373    HA   LEU 601           HA       LEU 601  34.477  34.748  25.314
  374    HB2  LEU 601           HB2      LEU 601  34.126  32.573  26.768
  375    HB3  LEU 601           HB3      LEU 601  32.477  33.147  26.939
  376    HG   LEU 601           HG       LEU 601  32.650  33.255  24.221
  377   HD11  LEU 601          HD11      LEU 601  33.995  31.454  23.351
  378   HD12  LEU 601          HD12      LEU 601  35.080  32.424  24.374
  379   HD13  LEU 601          HD13      LEU 601  34.396  30.893  24.978
  380   HD21  LEU 601          HD21      LEU 601  31.070  31.873  25.726
  381   HD22  LEU 601          HD22      LEU 601  31.551  31.132  24.175
  382   HD23  LEU 601          HD23      LEU 601  32.319  30.623  25.703
  383    H    LEU 602           H        LEU 602  32.981  35.771  23.928
  384    HA   LEU 602           HA       LEU 602  31.560  37.957  24.975
  385    HB2  LEU 602           HB2      LEU 602  31.102  36.510  22.308
  386    HB3  LEU 602           HB3      LEU 602  30.537  38.100  22.706
  387    HG   LEU 602           HG       LEU 602  33.520  37.739  22.976
  388   HD11  LEU 602          HD11      LEU 602  34.096  38.065  20.741
  389   HD12  LEU 602          HD12      LEU 602  33.053  36.638  20.704
  390   HD13  LEU 602          HD13      LEU 602  32.444  38.242  20.184
  391   HD21  LEU 602          HD21      LEU 602  32.212  39.830  23.363
  392   HD22  LEU 602          HD22      LEU 602  33.439  40.000  22.050
  393   HD23  LEU 602          HD23      LEU 602  31.728  39.797  21.646
  394    H    SER 603           H        SER 603  30.437  34.791  24.029
  395    HA   SER 603           HA       SER 603  27.658  34.905  24.638
  396    HB2  SER 603           HB2      SER 603  29.559  32.549  24.492
  397    HB3  SER 603           HB3      SER 603  27.764  32.477  24.616
  398    HG   SER 603           HG       SER 603  29.406  33.335  22.603
  399    H    ASN 604           H        ASN 604  30.000  35.309  26.896
  400    HA   ASN 604           HA       ASN 604  28.464  34.244  29.229
  401    HB2  ASN 604           HB2      ASN 604  31.473  34.301  28.646
  402    HB3  ASN 604           HB3      ASN 604  30.816  33.952  30.211
  403   HD21  ASN 604          HD22      ASN 604  32.476  32.115  28.992
  404   HD22  ASN 604          HD21      ASN 604  31.513  30.722  28.547
  405    H    ILE 605           H        ILE 605  28.989  36.952  27.685
  406    HA   ILE 605           HA       ILE 605  28.911  38.508  30.229
  407    HB   ILE 605           HB       ILE 605  29.410  39.713  27.492
  408   HG12  ILE 605          HG12      ILE 605  31.595  38.854  29.456
  409   HG13  ILE 605          HG13      ILE 605  31.255  38.008  27.946
  410   HG21  ILE 605          HG21      ILE 605  30.044  40.626  30.292
  411   HG22  ILE 605          HG22      ILE 605  30.287  41.574  28.796
  412   HG23  ILE 605          HG23      ILE 605  28.650  41.142  29.295
  413   HD11  ILE 605          HD11      ILE 605  33.177  39.393  27.655
  414   HD12  ILE 605          HD12      ILE 605  31.880  40.063  26.660
  415   HD13  ILE 605          HD13      ILE 605  32.299  40.844  28.199
  416    H    LYS 606           H        LYS 606  26.926  39.206  30.661
  417    HA   LYS 606           HA       LYS 606  24.855  39.571  28.541
  418    HB2  LYS 606           HB2      LYS 606  23.159  38.714  29.940
  419    HB3  LYS 606           HB3      LYS 606  24.474  37.583  29.955
  420    HG2  LYS 606           HG2      LYS 606  23.834  37.580  32.197
  421    HG3  LYS 606           HG3      LYS 606  25.303  38.521  32.126
  422    HD2  LYS 606           HD2      LYS 606  23.691  39.399  33.682
  423    HD3  LYS 606           HD3      LYS 606  24.010  40.589  32.402
  424    HE2  LYS 606           HE2      LYS 606  21.899  40.024  31.307
  425    HE3  LYS 606           HE3      LYS 606  21.628  38.678  32.414
  426    HZ1  LYS 606           HZ1      LYS 606  21.889  41.442  33.348
  427    HZ2  LYS 606           HZ2      LYS 606  20.440  40.847  32.898
  428    HZ3  LYS 606           HZ3      LYS 606  21.283  40.238  34.196
  429    HA   PRO 607           HA       PRO 607  24.709  43.684  29.719
  430    HB2  PRO 607           HB2      PRO 607  22.127  44.554  29.296
  431    HB3  PRO 607           HB3      PRO 607  23.175  43.964  27.954
  432    HG2  PRO 607           HG2      PRO 607  21.057  42.476  29.513
  433    HG3  PRO 607           HG3      PRO 607  21.311  42.535  27.739
  434    HD2  PRO 607           HD2      PRO 607  22.210  40.490  29.372
  435    HD3  PRO 607           HD3      PRO 607  23.131  40.963  27.910
  436    H    ILE 608           H        ILE 608  24.039  45.426  31.074
  437    HA   ILE 608           HA       ILE 608  23.770  44.600  33.759
  438    HB   ILE 608           HB       ILE 608  24.175  47.108  32.170
  439   HG12  ILE 608          HG12      ILE 608  25.873  45.371  33.205
  440   HG13  ILE 608          HG13      ILE 608  26.284  47.082  32.956
  441   HG21  ILE 608          HG21      ILE 608  23.711  47.630  35.094
  442   HG22  ILE 608          HG22      ILE 608  24.524  48.652  33.891
  443   HG23  ILE 608          HG23      ILE 608  22.809  48.284  33.690
  444   HD11  ILE 608          HD11      ILE 608  25.319  46.152  35.673
  445   HD12  ILE 608          HD12      ILE 608  26.962  45.758  35.111
  446   HD13  ILE 608          HD13      ILE 608  26.484  47.437  35.287
  447    H    LEU 609           H        LEU 609  21.210  45.303  31.643
  448    HA   LEU 609           HA       LEU 609  19.277  45.588  33.782
  449    HB2  LEU 609           HB2      LEU 609  18.520  47.855  33.209
  450    HB3  LEU 609           HB3      LEU 609  20.189  47.836  33.701
  451    HG   LEU 609           HG       LEU 609  20.905  47.984  31.293
  452   HD11  LEU 609          HD11      LEU 609  19.297  48.987  29.704
  453   HD12  LEU 609          HD12      LEU 609  19.087  47.259  29.972
  454   HD13  LEU 609          HD13      LEU 609  17.957  48.435  30.726
  455   HD21  LEU 609          HD21      LEU 609  20.774  49.894  32.801
  456   HD22  LEU 609          HD22      LEU 609  20.485  50.316  31.101
  457   HD23  LEU 609          HD23      LEU 609  19.109  50.228  32.234
  458    H    GLU 610           H        GLU 610  17.048  46.387  32.498
  459    HA   GLU 610           HA       GLU 610  16.866  45.101  29.877
  460    HB2  GLU 610           HB2      GLU 610  15.006  43.632  30.527
  461    HB3  GLU 610           HB3      GLU 610  16.460  43.241  31.408
  462    HG2  GLU 610           HG2      GLU 610  15.295  44.878  33.249
  463    HG3  GLU 610           HG3      GLU 610  13.849  44.381  32.389
  464    H1   TYR 611           H1       TYR 611  45.709  27.004  28.482
  465    H2   TYR 611           H2       TYR 611  44.174  26.792  29.022
  466    H3   TYR 611           H3       TYR 611  45.398  25.984  29.718
  467    HA   TYR 611           HA       TYR 611  46.334  28.194  30.438
  468    HB2  TYR 611           HB2      TYR 611  43.522  28.990  29.648
  469    HB3  TYR 611           HB3      TYR 611  44.622  29.955  30.634
  470    HD1  TYR 611           HD2      TYR 611  47.166  30.103  29.387
  471    HD2  TYR 611           HD1      TYR 611  43.294  29.603  27.503
  472    HE1  TYR 611           HE2      TYR 611  48.126  30.763  27.214
  473    HE2  TYR 611           HE1      TYR 611  44.198  30.467  25.398
  474    HH   TYR 611           HH       TYR 611  45.963  31.096  24.364
  475    H    SER 612           H        SER 612  46.089  28.422  32.716
  476    HA   SER 612           HA       SER 612  43.443  27.764  33.822
  477    HB2  SER 612           HB2      SER 612  44.597  25.638  33.622
  478    HB3  SER 612           HB3      SER 612  45.953  26.236  34.583
  479    HG   SER 612           HG       SER 612  44.757  25.287  35.941
  480    HA   PRO 613           HA       PRO 613  44.723  30.977  36.753
  481    HB2  PRO 613           HB2      PRO 613  42.448  31.433  38.006
  482    HB3  PRO 613           HB3      PRO 613  42.625  31.726  36.260
  483    HG2  PRO 613           HG2      PRO 613  41.416  29.242  37.531
  484    HG3  PRO 613           HG3      PRO 613  40.718  30.300  36.241
  485    HD2  PRO 613           HD2      PRO 613  42.076  28.031  35.731
  486    HD3  PRO 613           HD3      PRO 613  42.085  29.454  34.638
  487    H    SER 614           H        SER 614  44.786  31.197  39.172
  488    HA   SER 614           HA       SER 614  44.896  28.658  40.709
  489    HB2  SER 614           HB2      SER 614  47.304  28.846  41.140
  490    HB3  SER 614           HB3      SER 614  46.994  28.704  39.404
  491    HG   SER 614           HG       SER 614  47.638  30.597  39.110
  492    H    SER 615           H        SER 615  44.876  32.163  40.757
  493    HA   SER 615           HA       SER 615  43.817  32.028  43.475
  494    HB2  SER 615           HB2      SER 615  45.960  34.105  42.964
  495    HB3  SER 615           HB3      SER 615  45.257  33.602  44.508
  496    HG   SER 615           HG       SER 615  46.301  31.529  44.002
  497    HA   PRO 616           HA       PRO 616  41.493  35.065  40.966
  498    HB2  PRO 616           HB2      PRO 616  39.343  35.459  42.595
  499    HB3  PRO 616           HB3      PRO 616  39.663  34.032  41.580
  500    HG2  PRO 616           HG2      PRO 616  40.240  34.318  44.564
  501    HG3  PRO 616           HG3      PRO 616  39.391  32.983  43.695
  502    HD2  PRO 616           HD2      PRO 616  42.060  32.941  44.362
  503    HD3  PRO 616           HD3      PRO 616  41.352  32.116  42.920
  504   HC11  DA2 617          HC11      DA2 617  36.988  40.639  38.722
  505   HC12  DA2 617          HC12      DA2 617  37.470  39.097  37.996
  506   HC13  DA2 617          HC13      DA2 617  35.805  39.655  37.824
  507   HC21  DA2 617          HC21      DA2 617  34.352  38.961  39.136
  508   HC22  DA2 617          HC22      DA2 617  34.587  38.516  40.836
  509   HC23  DA2 617          HC23      DA2 617  34.980  37.346  39.550
  510    H2   DA2 617           H        DA2 617  42.652  36.900  40.830
  511    HA   DA2 617           HA       DA2 617  43.612  38.909  41.121
  512   HCB1  DA2 617          HCB1      DA2 617  42.417  40.633  42.198
  513   HCB2  DA2 617          HCB2      DA2 617  41.517  39.485  43.168
  514   HCG1  DA2 617          HCG1      DA2 617  40.751  40.677  40.734
  515   HCG2  DA2 617          HCG2      DA2 617  41.201  39.060  40.211
  516   HCD1  DA2 617          HCD1      DA2 617  39.652  38.030  41.742
  517   HCD2  DA2 617          HCD2      DA2 617  39.220  39.643  42.434
  518    HNE  DA2 617           HNE      DA2 617  38.751  39.698  39.660
  519   HNH2  DA2 617          HNH2      DA2 617  37.672  37.907  42.553
  520   HNH1  DA2 617          HNH1      DA2 617  36.062  37.671  41.961
  521    H    TYR 618           H        TYR 618  42.895  37.843  44.527
  522    HA   TYR 618           HA       TYR 618  45.217  39.086  45.738
  523    HB2  TYR 618           HB2      TYR 618  44.550  37.934  47.716
  524    HB3  TYR 618           HB3      TYR 618  43.173  38.696  46.949
  525    HD1  TYR 618           HD2      TYR 618  44.860  35.363  47.599
  526    HD2  TYR 618           HD1      TYR 618  41.139  37.336  46.620
  527    HE1  TYR 618           HE2      TYR 618  43.581  33.249  48.007
  528    HE2  TYR 618           HE1      TYR 618  39.968  35.148  46.761
  529    HH   TYR 618           HH       TYR 618  40.229  32.901  47.504
  530    H    THR 619           H        THR 619  46.690  37.643  47.121
  531    HA   THR 619           HA       THR 619  47.681  35.300  45.552
  532    HB   THR 619           HB       THR 619  49.203  37.310  47.271
  533    HG1  THR 619           HG1      THR 619  48.322  37.868  45.088
  534   HG21  THR 619          HG21      THR 619  50.345  35.279  45.334
  535   HG22  THR 619          HG22      THR 619  51.186  36.285  46.578
  536   HG23  THR 619          HG23      THR 619  50.181  34.926  47.059
  537    HA   PRO 620           HA       PRO 620  47.241  32.971  49.401
  538    HB2  PRO 620           HB2      PRO 620  49.729  31.763  48.220
  539    HB3  PRO 620           HB3      PRO 620  48.351  30.930  49.033
  540    HG2  PRO 620           HG2      PRO 620  48.561  30.941  46.271
  541    HG3  PRO 620           HG3      PRO 620  46.988  31.137  47.044
  542    HD2  PRO 620           HD2      PRO 620  48.878  33.175  45.939
  543    HD3  PRO 620           HD3      PRO 620  47.066  33.158  45.894
  544    H    GLN 621           H        GLN 621  48.284  32.974  51.405
  545    HA   GLN 621           HA       GLN 621  50.872  34.375  51.818
  546    HB2  GLN 621           HB2      GLN 621  49.794  35.990  53.349
  547    HB3  GLN 621           HB3      GLN 621  48.811  35.910  51.884
  548    HG2  GLN 621           HG2      GLN 621  47.523  34.029  53.171
  549    HG3  GLN 621           HG3      GLN 621  48.423  34.643  54.586
  550   HE21  GLN 621          HE22      GLN 621  45.632  35.263  52.542
  551   HE22  GLN 621          HE21      GLN 621  45.092  36.668  53.463
  552    H    SER 622           H        SER 622  49.194  31.566  52.636
  553    HA   SER 622           HA       SER 622  50.212  31.116  55.301
  554    HB2  SER 622           HB2      SER 622  49.196  29.138  53.164
  555    HB3  SER 622           HB3      SER 622  49.352  28.810  54.895
  556    HG   SER 622           HG       SER 622  47.758  30.383  55.196
  557    HA   PRO 623           HA       PRO 623  54.409  29.602  54.694
  558    HB2  PRO 623           HB2      PRO 623  53.311  27.069  55.936
  559    HB3  PRO 623           HB3      PRO 623  54.884  27.881  56.261
  560    HG2  PRO 623           HG2      PRO 623  52.932  28.363  57.969
  561    HG3  PRO 623           HG3      PRO 623  53.866  29.725  57.257
  562    HD2  PRO 623           HD2      PRO 623  51.095  28.791  56.432
  563    HD3  PRO 623           HD3      PRO 623  51.707  30.436  56.756
  Start of MODEL    2
    1    H1   MET 553           H1       MET 553  21.379  45.848  13.249
    2    H2   MET 553           H2       MET 553  21.992  46.871  14.370
    3    H3   MET 553           H3       MET 553  20.660  45.987  14.724
    4    HA   MET 553           HA       MET 553  21.820  43.974  14.745
    5    HB2  MET 553           HB2      MET 553  24.232  45.639  13.856
    6    HB3  MET 553           HB3      MET 553  24.307  43.977  14.386
    7    HG2  MET 553           HG2      MET 553  24.395  43.761  12.133
    8    HG3  MET 553           HG3      MET 553  22.700  43.429  12.413
    9    HE1  MET 553           HE1      MET 553  24.587  44.265   9.744
   10    HE2  MET 553           HE2      MET 553  22.898  43.777   9.419
   11    HE3  MET 553           HE3      MET 553  23.532  45.300   8.791
   12    H    LYS 554           H        LYS 554  23.439  43.261  16.510
   13    HA   LYS 554           HA       LYS 554  23.631  45.292  18.659
   14    HB2  LYS 554           HB2      LYS 554  22.073  42.697  18.909
   15    HB3  LYS 554           HB3      LYS 554  22.580  43.694  20.285
   16    HG2  LYS 554           HG2      LYS 554  21.336  45.631  19.164
   17    HG3  LYS 554           HG3      LYS 554  20.737  44.436  18.006
   18    HD2  LYS 554           HD2      LYS 554  19.616  43.207  19.832
   19    HD3  LYS 554           HD3      LYS 554  20.269  44.333  21.031
   20    HE2  LYS 554           HE2      LYS 554  19.094  46.192  19.635
   21    HE3  LYS 554           HE3      LYS 554  18.040  44.892  19.050
   22    HZ1  LYS 554           HZ1      LYS 554  17.823  44.551  21.640
   23    HZ2  LYS 554           HZ2      LYS 554  18.411  46.094  21.639
   24    HZ3  LYS 554           HZ3      LYS 554  17.005  45.734  20.893
   25    H    MET 555           H        MET 555  25.776  44.183  17.090
   26    HA   MET 555           HA       MET 555  27.157  42.049  18.431
   27    HB2  MET 555           HB2      MET 555  27.532  42.783  16.049
   28    HB3  MET 555           HB3      MET 555  28.309  44.233  16.644
   29    HG2  MET 555           HG2      MET 555  30.155  42.873  17.516
   30    HG3  MET 555           HG3      MET 555  29.211  41.401  17.359
   31    HE1  MET 555           HE1      MET 555  31.938  40.949  14.362
   32    HE2  MET 555           HE2      MET 555  32.005  41.181  16.128
   33    HE3  MET 555           HE3      MET 555  30.996  39.901  15.383
   34    H    TRP 556           H        TRP 556  29.171  42.226  19.701
   35    HA   TRP 556           HA       TRP 556  29.110  44.288  21.705
   36    HB2  TRP 556           HB2      TRP 556  30.773  41.790  21.216
   37    HB3  TRP 556           HB3      TRP 556  31.383  43.003  22.326
   38    HD1  TRP 556           HD1      TRP 556  30.200  39.917  22.905
   39    HE1  TRP 556           HE1      TRP 556  28.912  39.729  25.063
   40    HE3  TRP 556           HE3      TRP 556  28.665  44.855  23.460
   41    HZ2  TRP 556           HZ2      TRP 556  27.395  41.396  26.804
   42    HZ3  TRP 556           HZ3      TRP 556  27.241  45.441  25.342
   43    HH2  TRP 556           HH2      TRP 556  26.481  43.750  26.943
   44    H    LYS 557           H        LYS 557  30.570  45.919  22.109
   45    HA   LYS 557           HA       LYS 557  32.936  46.453  20.520
   46    HB2  LYS 557           HB2      LYS 557  32.291  48.418  19.334
   47    HB3  LYS 557           HB3      LYS 557  30.962  47.327  19.062
   48    HG2  LYS 557           HG2      LYS 557  29.675  48.423  20.859
   49    HG3  LYS 557           HG3      LYS 557  30.990  49.575  21.149
   50    HD2  LYS 557           HD2      LYS 557  30.574  50.007  18.471
   51    HD3  LYS 557           HD3      LYS 557  28.957  49.507  18.975
   52    HE2  LYS 557           HE2      LYS 557  30.530  51.824  20.185
   53    HE3  LYS 557           HE3      LYS 557  29.326  51.951  18.956
   54    HZ1  LYS 557           HZ1      LYS 557  27.718  50.908  20.551
   55    HZ2  LYS 557           HZ2      LYS 557  28.863  51.037  21.713
   56    HZ3  LYS 557           HZ3      LYS 557  28.319  52.380  20.970
   57    HA   PRO 558           HA       PRO 558  34.388  48.081  24.058
   58    HB2  PRO 558           HB2      PRO 558  36.108  50.070  23.536
   59    HB3  PRO 558           HB3      PRO 558  36.302  48.364  23.009
   60    HG2  PRO 558           HG2      PRO 558  35.121  50.675  21.459
   61    HG3  PRO 558           HG3      PRO 558  36.472  49.584  20.949
   62    HD2  PRO 558           HD2      PRO 558  33.875  49.306  20.212
   63    HD3  PRO 558           HD3      PRO 558  34.846  47.837  20.498
   64    H    GLY 559           H        GLY 559  34.682  49.761  25.679
   65    HA2  GLY 559           HA2      GLY 559  33.965  51.505  27.047
   66    HA3  GLY 559           HA3      GLY 559  33.354  52.325  25.626
   67    H    ASP 560           H        ASP 560  32.549  49.343  27.598
   68    HA   ASP 560           HA       ASP 560  29.791  50.359  27.822
   69    HB2  ASP 560           HB2      ASP 560  30.570  48.384  25.835
   70    HB3  ASP 560           HB3      ASP 560  29.463  47.641  26.950
   71    H    GLU 561           H        GLU 561  29.567  50.373  30.042
   72    HA   GLU 561           HA       GLU 561  30.310  48.077  31.587
   73    HB2  GLU 561           HB2      GLU 561  29.054  48.892  33.387
   74    HB3  GLU 561           HB3      GLU 561  29.836  50.261  32.587
   75    HG2  GLU 561           HG2      GLU 561  27.559  50.704  31.467
   76    HG3  GLU 561           HG3      GLU 561  26.889  49.450  32.498
   77    H    CYS 562           H        CYS 562  29.643  46.209  31.651
   78    HA   CYS 562           HA       CYS 562  26.925  45.358  30.980
   79    HB2  CYS 562           HB2      CYS 562  29.434  44.014  29.846
   80    HB3  CYS 562           HB3      CYS 562  27.766  43.570  29.555
   81    HG   CYS 562           HG       CYS 562  29.188  46.474  28.640
   82    H    PHE 563           H        PHE 563  27.440  42.642  31.264
   83    HA   PHE 563           HA       PHE 563  28.405  42.260  34.075
   84    HB2  PHE 563           HB2      PHE 563  25.813  41.290  32.818
   85    HB3  PHE 563           HB3      PHE 563  26.711  40.295  33.923
   86    HD1  PHE 563           HD1      PHE 563  27.323  41.023  36.229
   87    HD2  PHE 563           HD2      PHE 563  24.334  42.967  33.828
   88    HE1  PHE 563           HE1      PHE 563  26.429  42.144  38.262
   89    HE2  PHE 563           HE2      PHE 563  23.451  44.106  35.846
   90    HZ   PHE 563           HZ       PHE 563  24.496  43.693  38.073
   91    H    ALA 564           H        ALA 564  30.158  40.862  33.879
   92    HA   ALA 564           HA       ALA 564  30.286  39.120  31.463
   93    HB1  ALA 564           HB1      ALA 564  32.599  40.248  33.068
   94    HB2  ALA 564           HB2      ALA 564  32.703  39.407  31.543
   95    HB3  ALA 564           HB3      ALA 564  31.920  41.028  31.592
   96    H    LEU 565           H        LEU 565  30.938  37.114  31.762
   97    HA   LEU 565           HA       LEU 565  30.260  35.973  34.317
   98    HB2  LEU 565           HB2      LEU 565  29.504  35.228  32.009
   99    HB3  LEU 565           HB3      LEU 565  31.155  34.692  31.700
  100    HG   LEU 565           HG       LEU 565  31.025  32.967  33.415
  101   HD11  LEU 565          HD11      LEU 565  28.110  33.734  33.727
  102   HD12  LEU 565          HD12      LEU 565  28.960  32.429  34.554
  103   HD13  LEU 565          HD13      LEU 565  29.402  34.118  34.914
  104   HD21  LEU 565          HD21      LEU 565  30.370  32.177  31.239
  105   HD22  LEU 565          HD22      LEU 565  29.126  31.576  32.344
  106   HD23  LEU 565          HD23      LEU 565  28.787  32.976  31.335
  107    H    TYR 566           H        TYR 566  31.643  34.900  35.701
  108    HA   TYR 566           HA       TYR 566  34.511  34.917  35.191
  109    HB2  TYR 566           HB2      TYR 566  33.035  35.564  37.373
  110    HB3  TYR 566           HB3      TYR 566  33.382  33.874  37.707
  111    HD1  TYR 566           HD1      TYR 566  35.592  36.545  36.098
  112    HD2  TYR 566           HD2      TYR 566  34.865  34.029  39.508
  113    HE1  TYR 566           HE1      TYR 566  37.945  36.830  36.804
  114    HE2  TYR 566           HE2      TYR 566  37.090  34.605  40.410
  115    HH   TYR 566           HH       TYR 566  39.488  36.389  38.525
  116    H    TRP 567           H        TRP 567  35.258  32.858  36.830
  117    HA   TRP 567           HA       TRP 567  34.769  30.362  35.227
  118    HB2  TRP 567           HB2      TRP 567  37.277  30.140  34.999
  119    HB3  TRP 567           HB3      TRP 567  36.601  31.497  34.083
  120    HD1  TRP 567           HD1      TRP 567  37.040  33.916  35.011
  121    HE1  TRP 567           HE1      TRP 567  38.927  34.883  36.479
  122    HE3  TRP 567           HE3      TRP 567  38.885  29.594  37.040
  123    HZ2  TRP 567           HZ2      TRP 567  40.546  34.000  38.642
  124    HZ3  TRP 567           HZ3      TRP 567  40.362  29.711  39.028
  125    HH2  TRP 567           HH2      TRP 567  41.127  31.901  39.900
  126    H    GLU 568           H        GLU 568  36.078  31.847  38.145
  127    HA   GLU 568           HA       GLU 568  36.757  29.538  39.744
  128    HB2  GLU 568           HB2      GLU 568  37.356  31.971  40.159
  129    HB3  GLU 568           HB3      GLU 568  35.673  32.322  40.239
  130    HG2  GLU 568           HG2      GLU 568  36.488  32.400  42.382
  131    HG3  GLU 568           HG3      GLU 568  35.397  31.020  42.301
  132    H    ASP 569           H        ASP 569  33.790  31.371  39.289
  133    HA   ASP 569           HA       ASP 569  32.234  29.295  40.714
  134    HB2  ASP 569           HB2      ASP 569  30.808  31.366  41.495
  135    HB3  ASP 569           HB3      ASP 569  32.325  30.988  42.296
  136    H    ASN 570           H        ASN 570  32.590  31.129  37.877
  137    HA   ASN 570           HA       ASN 570  31.285  31.445  35.987
  138    HB2  ASN 570           HB2      ASN 570  31.180  28.868  36.427
  139    HB3  ASN 570           HB3      ASN 570  29.538  29.213  36.986
  140   HD21  ASN 570          HD22      ASN 570  31.591  29.914  34.008
  141   HD22  ASN 570          HD21      ASN 570  30.184  29.668  32.985
  142    H    LYS 571           H        LYS 571  30.824  33.155  38.006
  143    HA   LYS 571           HA       LYS 571  27.895  33.684  37.749
  144    HB2  LYS 571           HB2      LYS 571  29.945  34.258  39.878
  145    HB3  LYS 571           HB3      LYS 571  28.739  35.500  39.568
  146    HG2  LYS 571           HG2      LYS 571  27.977  32.599  40.046
  147    HG3  LYS 571           HG3      LYS 571  28.204  33.731  41.384
  148    HD2  LYS 571           HD2      LYS 571  26.533  35.231  39.863
  149    HD3  LYS 571           HD3      LYS 571  26.099  33.683  39.232
  150    HE2  LYS 571           HE2      LYS 571  24.512  34.250  40.983
  151    HE3  LYS 571           HE3      LYS 571  25.456  32.888  41.556
  152    HZ1  LYS 571           HZ1      LYS 571  24.992  34.749  43.112
  153    HZ2  LYS 571           HZ2      LYS 571  26.551  34.337  43.072
  154    HZ3  LYS 571           HZ3      LYS 571  26.059  35.677  42.277
  155    H    PHE 572           H        PHE 572  27.168  35.752  37.126
  156    HA   PHE 572           HA       PHE 572  29.078  37.364  35.616
  157    HB2  PHE 572           HB2      PHE 572  26.131  37.631  36.213
  158    HB3  PHE 572           HB3      PHE 572  27.021  38.746  35.212
  159    HD1  PHE 572           HD2      PHE 572  27.866  38.143  32.956
  160    HD2  PHE 572           HD1      PHE 572  25.599  35.276  35.285
  161    HE1  PHE 572           HE2      PHE 572  27.391  36.831  30.922
  162    HE2  PHE 572           HE1      PHE 572  25.267  33.928  33.314
  163    HZ   PHE 572           HZ       PHE 572  26.061  34.744  31.060
  164    H    TYR 573           H        TYR 573  30.146  38.860  36.420
  165    HA   TYR 573           HA       TYR 573  29.207  40.597  38.689
  166    HB2  TYR 573           HB2      TYR 573  32.025  40.061  37.675
  167    HB3  TYR 573           HB3      TYR 573  31.596  41.126  39.004
  168    HD1  TYR 573           HD1      TYR 573  30.703  40.217  41.117
  169    HD2  TYR 573           HD2      TYR 573  31.961  37.604  37.920
  170    HE1  TYR 573           HE1      TYR 573  30.849  38.312  42.714
  171    HE2  TYR 573           HE2      TYR 573  31.973  35.696  39.449
  172    HH   TYR 573           HH       TYR 573  31.636  35.030  41.667
  173    H    ARG 574           H        ARG 574  29.418  42.856  38.366
  174    HA   ARG 574           HA       ARG 574  29.026  43.813  35.676
  175    HB2  ARG 574           HB2      ARG 574  29.813  45.367  38.186
  176    HB3  ARG 574           HB3      ARG 574  29.434  46.062  36.629
  177    HG2  ARG 574           HG2      ARG 574  27.139  45.009  36.703
  178    HG3  ARG 574           HG3      ARG 574  27.414  44.530  38.368
  179    HD2  ARG 574           HD2      ARG 574  27.525  47.260  37.080
  180    HD3  ARG 574           HD3      ARG 574  26.188  46.704  38.094
  181    HE   ARG 574           HE       ARG 574  28.090  46.702  39.962
  182   HH11  ARG 574          HH11      ARG 574  27.451  49.046  37.435
  183   HH12  ARG 574          HH12      ARG 574  28.534  50.232  38.097
  184   HH21  ARG 574          HH21      ARG 574  29.488  48.369  40.784
  185   HH22  ARG 574          HH22      ARG 574  29.537  49.886  39.891
  186    H    ALA 575           H        ALA 575  30.470  44.859  34.206
  187    HA   ALA 575           HA       ALA 575  33.225  45.384  34.901
  188    HB1  ALA 575           HB1      ALA 575  32.596  43.042  33.041
  189    HB2  ALA 575           HB2      ALA 575  34.163  43.870  33.118
  190    HB3  ALA 575           HB3      ALA 575  33.556  43.004  34.534
  191    H    GLU 576           H        GLU 576  34.145  46.870  33.570
  192    HA   GLU 576           HA       GLU 576  32.464  48.099  31.516
  193    HB2  GLU 576           HB2      GLU 576  34.697  49.039  33.281
  194    HB3  GLU 576           HB3      GLU 576  34.700  49.646  31.608
  195    HG2  GLU 576           HG2      GLU 576  32.161  50.072  32.050
  196    HG3  GLU 576           HG3      GLU 576  32.612  49.942  33.758
  197    H    VAL 577           H        VAL 577  32.481  47.014  29.727
  198    HA   VAL 577           HA       VAL 577  34.359  45.489  28.388
  199    HB   VAL 577           HB       VAL 577  32.168  47.352  27.464
  200   HG11  VAL 577          HG11      VAL 577  34.306  46.283  25.717
  201   HG12  VAL 577          HG12      VAL 577  32.615  46.178  25.138
  202   HG13  VAL 577          HG13      VAL 577  33.251  47.730  25.625
  203   HG21  VAL 577          HG21      VAL 577  31.442  45.271  28.374
  204   HG22  VAL 577          HG22      VAL 577  31.293  45.194  26.597
  205   HG23  VAL 577          HG23      VAL 577  32.627  44.344  27.448
  206    H    GLU 578           H        GLU 578  36.448  45.973  27.818
  207    HA   GLU 578           HA       GLU 578  37.076  48.809  27.314
  208    HB2  GLU 578           HB2      GLU 578  38.552  47.721  28.962
  209    HB3  GLU 578           HB3      GLU 578  38.860  46.385  27.864
  210    HG2  GLU 578           HG2      GLU 578  40.785  47.880  27.983
  211    HG3  GLU 578           HG3      GLU 578  40.157  47.918  26.365
  212    H    ALA 579           H        ALA 579  37.418  45.578  25.819
  213    HA   ALA 579           HA       ALA 579  37.588  46.758  23.150
  214    HB1  ALA 579           HB1      ALA 579  39.926  46.967  23.796
  215    HB2  ALA 579           HB2      ALA 579  39.934  45.275  24.409
  216    HB3  ALA 579           HB3      ALA 579  39.829  45.603  22.680
  217    H    LEU 580           H        LEU 580  36.094  45.462  22.163
  218    HA   LEU 580           HA       LEU 580  36.115  42.512  22.777
  219    HB2  LEU 580           HB2      LEU 580  33.602  43.997  22.134
  220    HB3  LEU 580           HB3      LEU 580  33.866  42.327  22.672
  221    HG   LEU 580           HG       LEU 580  33.791  44.899  24.079
  222   HD11  LEU 580          HD11      LEU 580  32.252  42.339  24.161
  223   HD12  LEU 580          HD12      LEU 580  32.538  42.911  25.750
  224   HD13  LEU 580          HD13      LEU 580  31.758  44.000  24.611
  225   HD21  LEU 580          HD21      LEU 580  35.529  44.553  25.388
  226   HD22  LEU 580          HD22      LEU 580  34.519  43.371  26.240
  227   HD23  LEU 580          HD23      LEU 580  35.694  42.867  24.995
  228    H    HIS 581           H        HIS 581  37.676  42.806  21.045
  229    HA   HIS 581           HA       HIS 581  36.592  41.964  18.519
  230    HB2  HIS 581           HB2      HIS 581  36.325  44.574  18.578
  231    HB3  HIS 581           HB3      HIS 581  38.080  44.641  18.528
  232    HD2  HIS 581           HD2      HIS 581  34.965  43.914  16.583
  233    HE1  HIS 581           HE1      HIS 581  38.094  43.817  13.708
  234    HE2  HIS 581           HE2      HIS 581  35.577  43.588  14.056
  235    H    SER 582           H        SER 582  39.392  43.131  20.336
  236    HA   SER 582           HA       SER 582  41.523  42.584  18.634
  237    HB2  SER 582           HB2      SER 582  42.877  42.843  20.739
  238    HB3  SER 582           HB3      SER 582  41.653  44.063  20.559
  239    HG   SER 582           HG       SER 582  41.678  43.220  22.542
  240    H    SER 583           H        SER 583  39.626  40.104  20.010
  241    HA   SER 583           HA       SER 583  41.738  38.151  19.231
  242    HB2  SER 583           HB2      SER 583  39.866  37.719  21.587
  243    HB3  SER 583           HB3      SER 583  41.067  36.599  20.931
  244    HG   SER 583           HG       SER 583  42.646  38.199  21.431
  245    H    GLY 584           H        GLY 584  40.768  35.842  18.717
  246    HA2  GLY 584           HA2      GLY 584  38.601  35.962  16.802
  247    HA3  GLY 584           HA3      GLY 584  39.447  34.545  17.417
  248    H    MET 585           H        MET 585  38.634  34.786  20.110
  249    HA   MET 585           HA       MET 585  35.688  34.457  19.972
  250    HB2  MET 585           HB2      MET 585  35.729  32.370  21.180
  251    HB3  MET 585           HB3      MET 585  36.582  32.262  19.655
  252    HG2  MET 585           HG2      MET 585  38.725  32.093  20.768
  253    HG3  MET 585           HG3      MET 585  38.052  32.778  22.258
  254    HE1  MET 585           HE1      MET 585  38.808  29.665  24.147
  255    HE2  MET 585           HE2      MET 585  39.817  30.847  23.324
  256    HE3  MET 585           HE3      MET 585  38.392  31.391  24.212
  257    H    THR 586           H        THR 586  38.312  35.546  22.067
  258    HA   THR 586           HA       THR 586  36.347  36.041  24.268
  259    HB   THR 586           HB       THR 586  38.185  36.532  25.703
  260    HG1  THR 586           HG1      THR 586  40.209  35.983  24.854
  261   HG21  THR 586          HG21      THR 586  39.097  34.367  25.931
  262   HG22  THR 586          HG22      THR 586  37.427  34.158  25.364
  263   HG23  THR 586          HG23      THR 586  38.773  33.964  24.220
  264    H    ALA 587           H        ALA 587  36.523  38.121  25.351
  265    HA   ALA 587           HA       ALA 587  37.106  40.492  23.718
  266    HB1  ALA 587           HB1      ALA 587  34.748  40.355  23.490
  267    HB2  ALA 587           HB2      ALA 587  34.574  39.387  24.971
  268    HB3  ALA 587           HB3      ALA 587  34.796  41.090  25.136
  269    H    VAL 588           H        VAL 588  37.794  42.283  25.075
  270    HA   VAL 588           HA       VAL 588  38.830  41.440  27.692
  271    HB   VAL 588           HB       VAL 588  39.521  44.043  26.301
  272   HG11  VAL 588          HG11      VAL 588  41.531  43.737  27.787
  273   HG12  VAL 588          HG12      VAL 588  39.999  43.981  28.637
  274   HG13  VAL 588          HG13      VAL 588  40.688  42.336  28.497
  275   HG21  VAL 588          HG21      VAL 588  41.010  41.363  26.311
  276   HG22  VAL 588          HG22      VAL 588  40.113  41.925  24.895
  277   HG23  VAL 588          HG23      VAL 588  41.525  42.834  25.431
  278    H    VAL 589           H        VAL 589  38.148  42.331  29.568
  279    HA   VAL 589           HA       VAL 589  36.173  44.501  29.542
  280    HB   VAL 589           HB       VAL 589  34.523  43.139  30.837
  281   HG11  VAL 589          HG11      VAL 589  34.422  43.435  28.367
  282   HG12  VAL 589          HG12      VAL 589  35.141  41.822  28.189
  283   HG13  VAL 589          HG13      VAL 589  33.556  42.024  28.975
  284   HG21  VAL 589          HG21      VAL 589  36.353  40.752  30.277
  285   HG22  VAL 589          HG22      VAL 589  35.790  41.350  31.842
  286   HG23  VAL 589          HG23      VAL 589  34.651  40.612  30.697
  287    H    LYS 590           H        LYS 590  36.431  45.826  31.339
  288    HA   LYS 590           HA       LYS 590  38.238  44.986  33.537
  289    HB2  LYS 590           HB2      LYS 590  38.839  47.060  32.381
  290    HB3  LYS 590           HB3      LYS 590  37.231  47.700  32.529
  291    HG2  LYS 590           HG2      LYS 590  37.503  47.963  34.956
  292    HG3  LYS 590           HG3      LYS 590  39.019  47.043  34.896
  293    HD2  LYS 590           HD2      LYS 590  40.213  48.731  33.976
  294    HD3  LYS 590           HD3      LYS 590  38.854  49.474  33.132
  295    HE2  LYS 590           HE2      LYS 590  39.143  49.420  36.172
  296    HE3  LYS 590           HE3      LYS 590  40.041  50.552  35.166
  297    HZ1  LYS 590           HZ1      LYS 590  38.168  51.733  35.763
  298    HZ2  LYS 590           HZ2      LYS 590  37.657  51.172  34.340
  299    HZ3  LYS 590           HZ3      LYS 590  37.131  50.491  35.728
  300    H    PHE 591           H        PHE 591  37.150  43.748  35.037
  301    HA   PHE 591           HA       PHE 591  34.728  44.114  36.239
  302    HB2  PHE 591           HB2      PHE 591  37.422  43.437  37.444
  303    HB3  PHE 591           HB3      PHE 591  35.949  43.241  38.351
  304    HD1  PHE 591           HD2      PHE 591  34.032  41.837  37.453
  305    HD2  PHE 591           HD1      PHE 591  38.016  41.692  35.828
  306    HE1  PHE 591           HE2      PHE 591  33.440  39.765  36.188
  307    HE2  PHE 591           HE1      PHE 591  37.483  39.466  34.790
  308    HZ   PHE 591           HZ       PHE 591  35.189  38.589  34.875
  309    H    ILE 592           H        ILE 592  33.735  45.831  37.018
  310    HA   ILE 592           HA       ILE 592  35.186  48.254  37.260
  311    HB   ILE 592           HB       ILE 592  32.481  48.292  38.427
  312   HG12  ILE 592          HG12      ILE 592  32.902  47.384  35.573
  313   HG13  ILE 592          HG13      ILE 592  31.829  46.744  36.806
  314   HG21  ILE 592          HG21      ILE 592  33.805  49.916  36.180
  315   HG22  ILE 592          HG22      ILE 592  32.589  50.498  37.340
  316   HG23  ILE 592          HG23      ILE 592  34.233  50.205  37.860
  317   HD11  ILE 592          HD11      ILE 592  31.408  49.531  35.708
  318   HD12  ILE 592          HD12      ILE 592  30.830  48.071  34.877
  319   HD13  ILE 592          HD13      ILE 592  30.241  48.459  36.510
  320    H    ASP 593           H        ASP 593  33.954  46.129  39.816
  321    HA   ASP 593           HA       ASP 593  34.729  48.054  41.886
  322    HB2  ASP 593           HB2      ASP 593  32.655  46.471  41.961
  323    HB3  ASP 593           HB3      ASP 593  33.821  45.334  42.677
  324    H    TYR 594           H        TYR 594  36.716  46.270  40.219
  325    HA   TYR 594           HA       TYR 594  38.501  45.340  42.449
  326    HB2  TYR 594           HB2      TYR 594  38.325  43.698  39.920
  327    HB3  TYR 594           HB3      TYR 594  39.155  43.429  41.392
  328    HD1  TYR 594           HD1      TYR 594  35.481  43.861  40.370
  329    HD2  TYR 594           HD2      TYR 594  38.391  41.950  42.892
  330    HE1  TYR 594           HE1      TYR 594  33.741  42.222  41.157
  331    HE2  TYR 594           HE2      TYR 594  36.629  40.409  43.751
  332    HH   TYR 594           HH       TYR 594  33.318  40.515  42.809
  333    H    GLY 595           H        GLY 595  38.263  46.459  38.997
  334    HA2  GLY 595           HA2      GLY 595  39.314  48.689  38.750
  335    HA3  GLY 595           HA3      GLY 595  40.756  48.028  39.552
  336    H    ASN 596           H        ASN 596  40.096  45.515  37.680
  337    HA   ASN 596           HA       ASN 596  41.858  46.622  35.534
  338    HB2  ASN 596           HB2      ASN 596  42.438  44.213  37.267
  339    HB3  ASN 596           HB3      ASN 596  43.311  44.636  35.808
  340   HD21  ASN 596          HD22      ASN 596  44.888  44.326  37.903
  341   HD22  ASN 596          HD21      ASN 596  45.312  45.837  38.668
  342    H    TYR 597           H        TYR 597  42.287  44.803  33.812
  343    HA   TYR 597           HA       TYR 597  39.776  43.417  33.181
  344    HB2  TYR 597           HB2      TYR 597  40.349  44.192  30.733
  345    HB3  TYR 597           HB3      TYR 597  39.491  45.189  31.843
  346    HD1  TYR 597           HD2      TYR 597  41.083  46.925  33.285
  347    HD2  TYR 597           HD1      TYR 597  42.147  45.139  29.493
  348    HE1  TYR 597           HE2      TYR 597  42.538  48.795  32.826
  349    HE2  TYR 597           HE1      TYR 597  43.487  47.097  28.941
  350    HH   TYR 597           HH       TYR 597  44.164  49.361  29.787
  351    H    GLU 598           H        GLU 598  39.786  41.799  31.679
  352    HA   GLU 598           HA       GLU 598  42.122  40.252  30.844
  353    HB2  GLU 598           HB2      GLU 598  41.427  38.226  31.970
  354    HB3  GLU 598           HB3      GLU 598  41.878  39.428  33.154
  355    HG2  GLU 598           HG2      GLU 598  39.325  39.943  33.320
  356    HG3  GLU 598           HG3      GLU 598  39.098  38.374  32.538
  357    H    GLU 599           H        GLU 599  41.180  38.206  29.890
  358    HA   GLU 599           HA       GLU 599  39.046  39.067  27.999
  359    HB2  GLU 599           HB2      GLU 599  39.942  37.418  26.507
  360    HB3  GLU 599           HB3      GLU 599  41.194  38.568  27.039
  361    HG2  GLU 599           HG2      GLU 599  42.204  36.935  28.450
  362    HG3  GLU 599           HG3      GLU 599  40.821  35.822  28.227
  363    H    VAL 600           H        VAL 600  37.269  37.910  27.577
  364    HA   VAL 600           HA       VAL 600  36.510  35.497  29.116
  365    HB   VAL 600           HB       VAL 600  34.961  38.124  28.965
  366   HG11  VAL 600          HG11      VAL 600  34.184  35.506  30.227
  367   HG12  VAL 600          HG12      VAL 600  33.412  37.085  30.593
  368   HG13  VAL 600          HG13      VAL 600  33.343  36.468  28.955
  369   HG21  VAL 600          HG21      VAL 600  36.403  36.794  31.297
  370   HG22  VAL 600          HG22      VAL 600  36.694  38.412  30.615
  371   HG23  VAL 600          HG23      VAL 600  35.208  38.096  31.510
  372    H    LEU 601           H        LEU 601  34.920  34.363  27.825
  373    HA   LEU 601           HA       LEU 601  34.826  34.786  24.995
  374    HB2  LEU 601           HB2      LEU 601  33.957  32.773  26.709
  375    HB3  LEU 601           HB3      LEU 601  32.426  33.446  26.150
  376    HG   LEU 601           HG       LEU 601  33.120  32.924  23.798
  377   HD11  LEU 601          HD11      LEU 601  35.576  32.990  23.864
  378   HD12  LEU 601          HD12      LEU 601  35.605  31.953  25.282
  379   HD13  LEU 601          HD13      LEU 601  35.144  31.296  23.683
  380   HD21  LEU 601          HD21      LEU 601  31.847  31.262  25.162
  381   HD22  LEU 601          HD22      LEU 601  32.891  30.561  23.899
  382   HD23  LEU 601          HD23      LEU 601  33.350  30.469  25.604
  383    H    LEU 602           H        LEU 602  33.659  35.986  23.587
  384    HA   LEU 602           HA       LEU 602  32.202  38.236  24.281
  385    HB2  LEU 602           HB2      LEU 602  31.800  36.316  21.975
  386    HB3  LEU 602           HB3      LEU 602  31.095  37.915  21.995
  387    HG   LEU 602           HG       LEU 602  34.080  37.731  22.378
  388   HD11  LEU 602          HD11      LEU 602  32.798  37.124  19.701
  389   HD12  LEU 602          HD12      LEU 602  34.548  37.282  20.071
  390   HD13  LEU 602          HD13      LEU 602  33.593  36.010  20.822
  391   HD21  LEU 602          HD21      LEU 602  32.894  39.917  22.377
  392   HD22  LEU 602          HD22      LEU 602  34.041  39.848  21.047
  393   HD23  LEU 602          HD23      LEU 602  32.322  39.639  20.719
  394    H    SER 603           H        SER 603  30.792  35.003  23.569
  395    HA   SER 603           HA       SER 603  28.094  35.575  24.373
  396    HB2  SER 603           HB2      SER 603  28.012  32.982  24.231
  397    HB3  SER 603           HB3      SER 603  28.407  33.838  22.742
  398    HG   SER 603           HG       SER 603  29.794  32.056  23.787
  399    H    ASN 604           H        ASN 604  30.588  35.605  26.420
  400    HA   ASN 604           HA       ASN 604  29.167  34.420  28.763
  401    HB2  ASN 604           HB2      ASN 604  32.141  34.644  28.214
  402    HB3  ASN 604           HB3      ASN 604  31.402  34.198  29.763
  403   HD21  ASN 604          HD22      ASN 604  29.617  32.757  27.265
  404   HD22  ASN 604          HD21      ASN 604  30.349  31.170  27.459
  405    H    ILE 605           H        ILE 605  29.337  37.039  27.241
  406    HA   ILE 605           HA       ILE 605  29.276  38.669  29.718
  407    HB   ILE 605           HB       ILE 605  30.019  39.824  26.992
  408   HG12  ILE 605          HG12      ILE 605  32.113  39.699  29.206
  409   HG13  ILE 605          HG13      ILE 605  32.020  38.347  28.093
  410   HG21  ILE 605          HG21      ILE 605  30.068  40.951  29.759
  411   HG22  ILE 605          HG22      ILE 605  30.483  41.802  28.217
  412   HG23  ILE 605          HG23      ILE 605  28.840  41.264  28.501
  413   HD11  ILE 605          HD11      ILE 605  32.211  41.218  27.140
  414   HD12  ILE 605          HD12      ILE 605  33.594  40.112  27.285
  415   HD13  ILE 605          HD13      ILE 605  32.274  39.744  26.162
  416    H    LYS 606           H        LYS 606  27.440  39.387  30.134
  417    HA   LYS 606           HA       LYS 606  25.046  39.360  28.336
  418    HB2  LYS 606           HB2      LYS 606  25.047  37.925  30.393
  419    HB3  LYS 606           HB3      LYS 606  25.353  39.377  31.374
  420    HG2  LYS 606           HG2      LYS 606  23.117  40.231  30.895
  421    HG3  LYS 606           HG3      LYS 606  22.786  38.845  29.828
  422    HD2  LYS 606           HD2      LYS 606  23.224  38.814  32.826
  423    HD3  LYS 606           HD3      LYS 606  21.698  38.642  31.937
  424    HE2  LYS 606           HE2      LYS 606  22.485  36.502  30.971
  425    HE3  LYS 606           HE3      LYS 606  24.033  36.691  31.792
  426    HZ1  LYS 606           HZ1      LYS 606  21.419  36.535  33.173
  427    HZ2  LYS 606           HZ2      LYS 606  22.263  35.222  32.873
  428    HZ3  LYS 606           HZ3      LYS 606  22.828  36.375  33.899
  429    HA   PRO 607           HA       PRO 607  25.043  43.745  28.901
  430    HB2  PRO 607           HB2      PRO 607  22.505  44.428  28.088
  431    HB3  PRO 607           HB3      PRO 607  23.839  43.844  26.994
  432    HG2  PRO 607           HG2      PRO 607  21.593  42.256  28.270
  433    HG3  PRO 607           HG3      PRO 607  22.010  42.305  26.519
  434    HD2  PRO 607           HD2      PRO 607  22.977  40.327  28.121
  435    HD3  PRO 607           HD3      PRO 607  23.978  41.081  26.850
  436    H    ILE 608           H        ILE 608  24.044  45.554  29.993
  437    HA   ILE 608           HA       ILE 608  23.146  44.858  32.687
  438    HB   ILE 608           HB       ILE 608  25.009  46.801  31.509
  439   HG12  ILE 608          HG12      ILE 608  24.416  45.791  34.290
  440   HG13  ILE 608          HG13      ILE 608  25.519  45.025  33.112
  441   HG21  ILE 608          HG21      ILE 608  23.338  47.957  33.739
  442   HG22  ILE 608          HG22      ILE 608  24.746  48.655  32.906
  443   HG23  ILE 608          HG23      ILE 608  23.226  48.503  32.041
  444   HD11  ILE 608          HD11      ILE 608  26.759  47.335  33.231
  445   HD12  ILE 608          HD12      ILE 608  25.849  47.492  34.770
  446   HD13  ILE 608          HD13      ILE 608  26.985  46.152  34.541
  447    H    LEU 609           H        LEU 609  21.775  46.341  29.803
  448    HA   LEU 609           HA       LEU 609  19.233  46.839  31.179
  449    HB2  LEU 609           HB2      LEU 609  18.990  49.038  30.591
  450    HB3  LEU 609           HB3      LEU 609  20.542  48.920  31.412
  451    HG   LEU 609           HG       LEU 609  19.940  49.403  28.474
  452   HD11  LEU 609          HD11      LEU 609  21.205  51.111  30.672
  453   HD12  LEU 609          HD12      LEU 609  21.119  51.545  28.958
  454   HD13  LEU 609          HD13      LEU 609  19.628  51.280  29.909
  455   HD21  LEU 609          HD21      LEU 609  21.994  47.989  28.537
  456   HD22  LEU 609          HD22      LEU 609  22.310  49.628  28.008
  457   HD23  LEU 609          HD23      LEU 609  22.729  49.124  29.678
  458    H    GLU 610           H        GLU 610  17.620  47.576  29.358
  459    HA   GLU 610           HA       GLU 610  17.527  45.862  27.033
  460    HB2  GLU 610           HB2      GLU 610  15.545  46.706  28.190
  461    HB3  GLU 610           HB3      GLU 610  15.932  48.374  27.672
  462    HG2  GLU 610           HG2      GLU 610  15.773  47.633  25.325
  463    HG3  GLU 610           HG3      GLU 610  15.332  46.016  25.890
  464    H1   TYR 611           H1       TYR 611  60.585  39.326  36.561
  465    H2   TYR 611           H2       TYR 611  61.482  40.645  36.274
  466    H3   TYR 611           H3       TYR 611  60.905  39.759  35.023
  467    HA   TYR 611           HA       TYR 611  59.372  41.371  36.952
  468    HB2  TYR 611           HB2      TYR 611  58.669  42.733  34.960
  469    HB3  TYR 611           HB3      TYR 611  60.388  42.828  35.248
  470    HD1  TYR 611           HD2      TYR 611  61.987  41.433  33.905
  471    HD2  TYR 611           HD1      TYR 611  57.860  42.022  32.781
  472    HE1  TYR 611           HE2      TYR 611  62.464  40.511  31.624
  473    HE2  TYR 611           HE1      TYR 611  58.376  41.213  30.498
  474    HH   TYR 611           HH       TYR 611  60.053  40.680  29.098
  475    H    SER 612           H        SER 612  57.424  40.852  37.388
  476    HA   SER 612           HA       SER 612  55.618  39.539  35.644
  477    HB2  SER 612           HB2      SER 612  55.430  37.334  36.645
  478    HB3  SER 612           HB3      SER 612  57.048  37.554  35.966
  479    HG   SER 612           HG       SER 612  56.782  36.728  38.152
  480    HA   PRO 613           HA       PRO 613  53.568  40.398  40.097
  481    HB2  PRO 613           HB2      PRO 613  55.653  42.533  40.617
  482    HB3  PRO 613           HB3      PRO 613  54.519  41.772  41.780
  483    HG2  PRO 613           HG2      PRO 613  57.009  40.922  41.677
  484    HG3  PRO 613           HG3      PRO 613  55.749  39.637  41.493
  485    HD2  PRO 613           HD2      PRO 613  57.176  41.195  39.321
  486    HD3  PRO 613           HD3      PRO 613  57.158  39.432  39.473
  487    H    SER 614           H        SER 614  51.815  41.709  39.599
  488    HA   SER 614           HA       SER 614  52.016  44.116  37.907
  489    HB2  SER 614           HB2      SER 614  51.070  43.489  35.996
  490    HB3  SER 614           HB3      SER 614  52.300  42.243  36.366
  491    HG   SER 614           HG       SER 614  50.649  40.864  36.762
  492    H    SER 615           H        SER 615  50.879  43.645  40.507
  493    HA   SER 615           HA       SER 615  49.012  43.514  41.767
  494    HB2  SER 615           HB2      SER 615  48.643  46.063  40.197
  495    HB3  SER 615           HB3      SER 615  47.860  45.660  41.749
  496    HG   SER 615           HG       SER 615  50.596  46.020  41.223
  497    HA   PRO 616           HA       PRO 616  45.442  42.053  39.017
  498    HB2  PRO 616           HB2      PRO 616  45.733  39.386  38.841
  499    HB3  PRO 616           HB3      PRO 616  46.839  40.438  37.920
  500    HG2  PRO 616           HG2      PRO 616  47.374  39.394  40.714
  501    HG3  PRO 616           HG3      PRO 616  48.330  38.993  39.239
  502    HD2  PRO 616           HD2      PRO 616  49.156  41.130  40.615
  503    HD3  PRO 616           HD3      PRO 616  48.914  41.221  38.852
  504   HC11  DA2 617          HC11      DA2 617  35.581  40.611  39.314
  505   HC12  DA2 617          HC12      DA2 617  37.302  40.681  39.604
  506   HC13  DA2 617          HC13      DA2 617  36.671  39.665  38.296
  507   HC21  DA2 617          HC21      DA2 617  34.990  37.225  40.042
  508   HC22  DA2 617          HC22      DA2 617  34.401  38.715  39.346
  509   HC23  DA2 617          HC23      DA2 617  34.382  38.499  41.109
  510    H2   DA2 617           H        DA2 617  43.703  40.447  39.800
  511    HA   DA2 617           HA       DA2 617  42.750  40.843  42.330
  512   HCB1  DA2 617          HCB1      DA2 617  42.249  38.151  41.019
  513   HCB2  DA2 617          HCB2      DA2 617  41.634  39.608  40.231
  514   HCG1  DA2 617          HCG1      DA2 617  41.148  38.961  43.139
  515   HCG2  DA2 617          HCG2      DA2 617  40.444  40.284  42.210
  516   HCD1  DA2 617          HCD1      DA2 617  40.015  37.408  41.314
  517   HCD2  DA2 617          HCD2      DA2 617  39.193  38.005  42.762
  518    HNE  DA2 617           HNE      DA2 617  38.733  39.666  40.380
  519   HNH2  DA2 617          HNH2      DA2 617  37.760  36.878  42.411
  520   HNH1  DA2 617          HNH1      DA2 617  36.141  36.879  41.867
  521    H    TYR 618           H        TYR 618  42.732  39.433  44.298
  522    HA   TYR 618           HA       TYR 618  45.091  38.463  45.330
  523    HB2  TYR 618           HB2      TYR 618  43.609  37.342  46.997
  524    HB3  TYR 618           HB3      TYR 618  43.209  39.038  46.673
  525    HD1  TYR 618           HD2      TYR 618  42.177  35.566  45.797
  526    HD2  TYR 618           HD1      TYR 618  41.085  39.727  46.113
  527    HE1  TYR 618           HE2      TYR 618  39.880  35.007  45.054
  528    HE2  TYR 618           HE1      TYR 618  38.773  39.164  45.312
  529    HH   TYR 618           HH       TYR 618  37.802  35.871  44.661
  530    H    THR 619           H        THR 619  46.235  36.636  45.321
  531    HA   THR 619           HA       THR 619  45.109  34.054  44.704
  532    HB   THR 619           HB       THR 619  45.418  34.858  42.449
  533    HG1  THR 619           HG1      THR 619  46.570  33.055  41.862
  534   HG21  THR 619          HG21      THR 619  47.552  36.229  42.832
  535   HG22  THR 619          HG22      THR 619  48.444  34.694  42.813
  536   HG23  THR 619          HG23      THR 619  47.533  35.198  41.392
  537    HA   PRO 620           HA       PRO 620  48.509  33.718  47.904
  538    HB2  PRO 620           HB2      PRO 620  46.310  31.914  48.883
  539    HB3  PRO 620           HB3      PRO 620  47.391  33.003  49.816
  540    HG2  PRO 620           HG2      PRO 620  44.808  33.692  49.292
  541    HG3  PRO 620           HG3      PRO 620  46.113  34.922  49.159
  542    HD2  PRO 620           HD2      PRO 620  44.799  33.404  46.918
  543    HD3  PRO 620           HD3      PRO 620  45.265  35.142  47.116
  544    H    GLN 621           H        GLN 621  46.657  31.353  45.982
  545    HA   GLN 621           HA       GLN 621  48.988  29.570  45.663
  546    HB2  GLN 621           HB2      GLN 621  46.261  28.464  46.534
  547    HB3  GLN 621           HB3      GLN 621  47.702  27.539  46.282
  548    HG2  GLN 621           HG2      GLN 621  48.686  28.656  48.383
  549    HG3  GLN 621           HG3      GLN 621  47.164  29.503  48.568
  550   HE21  GLN 621          HE22      GLN 621  45.375  28.415  49.490
  551   HE22  GLN 621          HE21      GLN 621  45.528  26.788  50.140
  552    H    SER 622           H        SER 622  49.017  28.653  43.639
  553    HA   SER 622           HA       SER 622  46.586  28.096  42.192
  554    HB2  SER 622           HB2      SER 622  48.317  30.368  41.239
  555    HB3  SER 622           HB3      SER 622  47.459  29.320  40.084
  556    HG   SER 622           HG       SER 622  46.125  30.596  42.181
  557    HA   PRO 623           HA       PRO 623  50.613  26.055  40.138
  558    HB2  PRO 623           HB2      PRO 623  52.297  26.752  42.567
  559    HB3  PRO 623           HB3      PRO 623  52.892  26.302  40.958
  560    HG2  PRO 623           HG2      PRO 623  52.796  28.927  41.477
  561    HG3  PRO 623           HG3      PRO 623  51.889  28.419  40.015
  562    HD2  PRO 623           HD2      PRO 623  50.819  28.795  42.779
  563    HD3  PRO 623           HD3      PRO 623  50.313  29.564  41.231
  Start of MODEL    3
    1    H1   MET 553           H1       MET 553  22.027  40.490  15.985
    2    H2   MET 553           H2       MET 553  20.871  41.626  15.918
    3    H3   MET 553           H3       MET 553  20.843  40.468  17.095
    4    HA   MET 553           HA       MET 553  23.052  42.336  16.657
    5    HB2  MET 553           HB2      MET 553  22.066  43.413  18.927
    6    HB3  MET 553           HB3      MET 553  21.827  44.018  17.295
    7    HG2  MET 553           HG2      MET 553  19.670  42.965  17.106
    8    HG3  MET 553           HG3      MET 553  19.893  42.121  18.641
    9    HE1  MET 553           HE1      MET 553  20.178  46.173  17.568
   10    HE2  MET 553           HE2      MET 553  19.139  45.106  16.610
   11    HE3  MET 553           HE3      MET 553  18.393  46.285  17.708
   12    H    LYS 554           H        LYS 554  24.723  41.890  17.540
   13    HA   LYS 554           HA       LYS 554  25.166  40.319  19.975
   14    HB2  LYS 554           HB2      LYS 554  26.420  38.546  18.974
   15    HB3  LYS 554           HB3      LYS 554  24.763  38.545  18.412
   16    HG2  LYS 554           HG2      LYS 554  25.462  39.416  16.220
   17    HG3  LYS 554           HG3      LYS 554  27.148  39.525  16.784
   18    HD2  LYS 554           HD2      LYS 554  26.958  36.997  17.317
   19    HD3  LYS 554           HD3      LYS 554  25.445  37.039  16.378
   20    HE2  LYS 554           HE2      LYS 554  26.607  37.892  14.468
   21    HE3  LYS 554           HE3      LYS 554  28.141  37.927  15.318
   22    HZ1  LYS 554           HZ1      LYS 554  27.936  35.488  15.694
   23    HZ2  LYS 554           HZ2      LYS 554  26.563  35.438  14.901
   24    HZ3  LYS 554           HZ3      LYS 554  27.888  35.803  14.077
   25    H    MET 555           H        MET 555  26.598  42.613  17.591
   26    HA   MET 555           HA       MET 555  29.285  41.792  18.200
   27    HB2  MET 555           HB2      MET 555  28.338  44.316  16.866
   28    HB3  MET 555           HB3      MET 555  29.993  43.698  16.893
   29    HG2  MET 555           HG2      MET 555  27.582  42.264  15.692
   30    HG3  MET 555           HG3      MET 555  28.830  43.057  14.756
   31    HE1  MET 555           HE1      MET 555  29.900  39.494  13.731
   32    HE2  MET 555           HE2      MET 555  28.324  40.307  13.691
   33    HE3  MET 555           HE3      MET 555  29.813  41.194  13.237
   34    H    TRP 556           H        TRP 556  29.979  41.922  20.188
   35    HA   TRP 556           HA       TRP 556  29.705  44.124  21.992
   36    HB2  TRP 556           HB2      TRP 556  31.345  41.631  21.673
   37    HB3  TRP 556           HB3      TRP 556  32.004  42.796  22.781
   38    HD1  TRP 556           HD1      TRP 556  30.628  39.850  23.398
   39    HE1  TRP 556           HE1      TRP 556  29.066  39.725  25.401
   40    HE3  TRP 556           HE3      TRP 556  29.466  44.829  23.830
   41    HZ2  TRP 556           HZ2      TRP 556  27.472  41.559  27.026
   42    HZ3  TRP 556           HZ3      TRP 556  27.800  45.549  25.498
   43    HH2  TRP 556           HH2      TRP 556  26.783  43.938  27.051
   44    H    LYS 557           H        LYS 557  31.217  45.632  22.710
   45    HA   LYS 557           HA       LYS 557  33.606  46.165  21.193
   46    HB2  LYS 557           HB2      LYS 557  32.998  47.934  19.802
   47    HB3  LYS 557           HB3      LYS 557  31.726  46.792  19.557
   48    HG2  LYS 557           HG2      LYS 557  30.245  48.029  21.104
   49    HG3  LYS 557           HG3      LYS 557  31.534  49.240  21.335
   50    HD2  LYS 557           HD2      LYS 557  30.572  48.597  18.536
   51    HD3  LYS 557           HD3      LYS 557  29.478  49.440  19.601
   52    HE2  LYS 557           HE2      LYS 557  31.176  51.260  19.932
   53    HE3  LYS 557           HE3      LYS 557  32.305  50.361  18.925
   54    HZ1  LYS 557           HZ1      LYS 557  30.979  52.105  17.772
   55    HZ2  LYS 557           HZ2      LYS 557  30.854  50.626  17.098
   56    HZ3  LYS 557           HZ3      LYS 557  29.622  51.167  17.998
   57    HA   PRO 558           HA       PRO 558  35.043  47.879  24.603
   58    HB2  PRO 558           HB2      PRO 558  36.602  50.019  23.939
   59    HB3  PRO 558           HB3      PRO 558  36.902  48.304  23.451
   60    HG2  PRO 558           HG2      PRO 558  35.458  50.382  21.778
   61    HG3  PRO 558           HG3      PRO 558  36.957  49.440  21.394
   62    HD2  PRO 558           HD2      PRO 558  34.573  48.573  20.637
   63    HD3  PRO 558           HD3      PRO 558  35.692  47.390  21.403
   64    H    GLY 559           H        GLY 559  34.837  49.465  26.367
   65    HA2  GLY 559           HA2      GLY 559  34.192  51.338  27.497
   66    HA3  GLY 559           HA3      GLY 559  33.634  52.098  25.990
   67    H    ASP 560           H        ASP 560  32.627  49.192  27.856
   68    HA   ASP 560           HA       ASP 560  29.855  50.273  28.004
   69    HB2  ASP 560           HB2      ASP 560  30.339  48.802  25.902
   70    HB3  ASP 560           HB3      ASP 560  30.256  47.436  27.028
   71    H    GLU 561           H        GLU 561  29.721  50.279  30.264
   72    HA   GLU 561           HA       GLU 561  30.451  48.066  31.863
   73    HB2  GLU 561           HB2      GLU 561  28.785  49.091  33.528
   74    HB3  GLU 561           HB3      GLU 561  30.141  50.007  32.916
   75    HG2  GLU 561           HG2      GLU 561  28.485  51.564  32.985
   76    HG3  GLU 561           HG3      GLU 561  28.530  51.164  31.267
   77    H    CYS 562           H        CYS 562  29.797  46.073  31.957
   78    HA   CYS 562           HA       CYS 562  27.072  45.183  31.222
   79    HB2  CYS 562           HB2      CYS 562  29.686  44.062  30.124
   80    HB3  CYS 562           HB3      CYS 562  28.088  43.448  29.708
   81    HG   CYS 562           HG       CYS 562  28.767  46.660  29.074
   82    H    PHE 563           H        PHE 563  27.400  42.451  31.479
   83    HA   PHE 563           HA       PHE 563  28.472  42.061  34.254
   84    HB2  PHE 563           HB2      PHE 563  25.752  41.523  33.140
   85    HB3  PHE 563           HB3      PHE 563  26.454  40.325  34.218
   86    HD1  PHE 563           HD1      PHE 563  27.447  41.360  36.574
   87    HD2  PHE 563           HD2      PHE 563  24.363  43.100  34.100
   88    HE1  PHE 563           HE1      PHE 563  26.719  42.751  38.459
   89    HE2  PHE 563           HE2      PHE 563  23.659  44.517  35.992
   90    HZ   PHE 563           HZ       PHE 563  24.808  44.349  38.182
   91    H    ALA 564           H        ALA 564  30.028  40.684  34.206
   92    HA   ALA 564           HA       ALA 564  30.307  38.969  31.783
   93    HB1  ALA 564           HB1      ALA 564  32.369  40.483  33.377
   94    HB2  ALA 564           HB2      ALA 564  32.661  39.495  31.897
   95    HB3  ALA 564           HB3      ALA 564  31.670  40.970  31.823
   96    H    LEU 565           H        LEU 565  30.605  36.947  31.989
   97    HA   LEU 565           HA       LEU 565  30.095  35.684  34.521
   98    HB2  LEU 565           HB2      LEU 565  29.256  35.078  32.188
   99    HB3  LEU 565           HB3      LEU 565  30.894  34.438  31.897
  100    HG   LEU 565           HG       LEU 565  30.591  32.812  33.655
  101   HD11  LEU 565          HD11      LEU 565  28.314  32.458  34.615
  102   HD12  LEU 565          HD12      LEU 565  29.006  33.997  35.195
  103   HD13  LEU 565          HD13      LEU 565  27.770  34.010  33.946
  104   HD21  LEU 565          HD21      LEU 565  28.306  32.955  31.636
  105   HD22  LEU 565          HD22      LEU 565  29.976  32.470  31.304
  106   HD23  LEU 565          HD23      LEU 565  28.991  31.477  32.392
  107    H    TYR 566           H        TYR 566  31.754  35.476  36.034
  108    HA   TYR 566           HA       TYR 566  34.495  35.022  35.277
  109    HB2  TYR 566           HB2      TYR 566  33.428  36.156  37.332
  110    HB3  TYR 566           HB3      TYR 566  33.220  34.509  37.948
  111    HD1  TYR 566           HD1      TYR 566  35.966  36.336  36.093
  112    HD2  TYR 566           HD2      TYR 566  34.841  34.183  39.644
  113    HE1  TYR 566           HE1      TYR 566  38.279  36.568  36.945
  114    HE2  TYR 566           HE2      TYR 566  37.212  34.415  40.506
  115    HH   TYR 566           HH       TYR 566  39.710  36.129  38.747
  116    H    TRP 567           H        TRP 567  35.386  33.210  36.973
  117    HA   TRP 567           HA       TRP 567  34.702  30.702  35.484
  118    HB2  TRP 567           HB2      TRP 567  36.999  30.257  35.150
  119    HB3  TRP 567           HB3      TRP 567  36.615  31.864  34.589
  120    HD1  TRP 567           HD1      TRP 567  37.914  33.876  35.574
  121    HE1  TRP 567           HE1      TRP 567  39.816  34.129  37.243
  122    HE3  TRP 567           HE3      TRP 567  38.204  29.097  37.335
  123    HZ2  TRP 567           HZ2      TRP 567  41.218  32.621  39.142
  124    HZ3  TRP 567           HZ3      TRP 567  39.821  28.535  39.147
  125    HH2  TRP 567           HH2      TRP 567  41.270  30.316  40.133
  126    H    GLU 568           H        GLU 568  36.547  31.669  38.478
  127    HA   GLU 568           HA       GLU 568  36.633  29.382  39.960
  128    HB2  GLU 568           HB2      GLU 568  37.529  31.389  40.871
  129    HB3  GLU 568           HB3      GLU 568  36.067  32.283  40.546
  130    HG2  GLU 568           HG2      GLU 568  36.222  32.200  42.843
  131    HG3  GLU 568           HG3      GLU 568  34.867  31.234  42.366
  132    H    ASP 569           H        ASP 569  33.771  31.334  39.471
  133    HA   ASP 569           HA       ASP 569  32.107  29.417  40.981
  134    HB2  ASP 569           HB2      ASP 569  30.786  31.611  41.589
  135    HB3  ASP 569           HB3      ASP 569  32.337  31.243  42.370
  136    H    ASN 570           H        ASN 570  32.440  31.180  38.060
  137    HA   ASN 570           HA       ASN 570  31.083  31.361  36.129
  138    HB2  ASN 570           HB2      ASN 570  31.167  28.828  36.766
  139    HB3  ASN 570           HB3      ASN 570  29.452  29.065  37.197
  140   HD21  ASN 570          HD22      ASN 570  31.825  29.327  34.599
  141   HD22  ASN 570          HD21      ASN 570  30.710  29.387  33.263
  142    H    LYS 571           H        LYS 571  30.512  32.955  38.415
  143    HA   LYS 571           HA       LYS 571  27.694  33.713  37.831
  144    HB2  LYS 571           HB2      LYS 571  29.434  34.088  40.289
  145    HB3  LYS 571           HB3      LYS 571  28.347  35.364  39.898
  146    HG2  LYS 571           HG2      LYS 571  27.270  32.523  39.982
  147    HG3  LYS 571           HG3      LYS 571  27.390  33.520  41.449
  148    HD2  LYS 571           HD2      LYS 571  26.058  35.258  40.502
  149    HD3  LYS 571           HD3      LYS 571  25.917  34.426  38.958
  150    HE2  LYS 571           HE2      LYS 571  25.151  32.733  41.262
  151    HE3  LYS 571           HE3      LYS 571  24.211  34.221  41.216
  152    HZ1  LYS 571           HZ1      LYS 571  23.068  32.522  39.918
  153    HZ2  LYS 571           HZ2      LYS 571  23.545  33.703  38.968
  154    HZ3  LYS 571           HZ3      LYS 571  24.376  32.322  38.949
  155    H    PHE 572           H        PHE 572  27.105  35.699  37.273
  156    HA   PHE 572           HA       PHE 572  29.026  37.301  35.813
  157    HB2  PHE 572           HB2      PHE 572  26.111  37.915  36.449
  158    HB3  PHE 572           HB3      PHE 572  27.126  38.778  35.362
  159    HD1  PHE 572           HD2      PHE 572  27.999  37.387  33.167
  160    HD2  PHE 572           HD1      PHE 572  25.043  35.833  35.918
  161    HE1  PHE 572           HE2      PHE 572  27.196  35.792  31.450
  162    HE2  PHE 572           HE1      PHE 572  24.218  34.317  34.148
  163    HZ   PHE 572           HZ       PHE 572  25.271  34.290  31.934
  164    H    TYR 573           H        TYR 573  30.118  38.936  36.398
  165    HA   TYR 573           HA       TYR 573  29.399  40.590  38.768
  166    HB2  TYR 573           HB2      TYR 573  32.081  39.714  37.673
  167    HB3  TYR 573           HB3      TYR 573  31.866  40.935  38.952
  168    HD1  TYR 573           HD1      TYR 573  31.095  40.216  41.209
  169    HD2  TYR 573           HD2      TYR 573  31.835  37.340  38.081
  170    HE1  TYR 573           HE1      TYR 573  31.112  38.360  42.891
  171    HE2  TYR 573           HE2      TYR 573  31.844  35.533  39.697
  172    HH   TYR 573           HH       TYR 573  31.704  35.041  41.979
  173    H    ARG 574           H        ARG 574  29.592  42.860  38.430
  174    HA   ARG 574           HA       ARG 574  29.113  43.940  35.852
  175    HB2  ARG 574           HB2      ARG 574  29.190  46.072  37.001
  176    HB3  ARG 574           HB3      ARG 574  28.268  44.842  37.899
  177    HG2  ARG 574           HG2      ARG 574  30.498  44.562  39.278
  178    HG3  ARG 574           HG3      ARG 574  30.972  46.066  38.510
  179    HD2  ARG 574           HD2      ARG 574  29.959  46.534  40.773
  180    HD3  ARG 574           HD3      ARG 574  29.141  47.298  39.470
  181    HE   ARG 574           HE       ARG 574  28.162  44.717  40.771
  182   HH11  ARG 574          HH11      ARG 574  27.340  48.007  39.682
  183   HH12  ARG 574          HH12      ARG 574  25.635  47.583  39.710
  184   HH21  ARG 574          HH21      ARG 574  26.012  44.445  40.817
  185   HH22  ARG 574          HH22      ARG 574  24.951  45.821  40.518
  186    H    ALA 575           H        ALA 575  30.527  44.861  34.289
  187    HA   ALA 575           HA       ALA 575  33.279  45.567  35.066
  188    HB1  ALA 575           HB1      ALA 575  32.807  43.659  32.747
  189    HB2  ALA 575           HB2      ALA 575  34.357  44.104  33.456
  190    HB3  ALA 575           HB3      ALA 575  33.254  43.038  34.354
  191    H    GLU 576           H        GLU 576  34.127  47.183  33.848
  192    HA   GLU 576           HA       GLU 576  32.465  48.315  31.659
  193    HB2  GLU 576           HB2      GLU 576  35.015  49.192  33.005
  194    HB3  GLU 576           HB3      GLU 576  34.404  49.950  31.506
  195    HG2  GLU 576           HG2      GLU 576  32.445  50.800  32.633
  196    HG3  GLU 576           HG3      GLU 576  32.877  49.894  34.095
  197    H    VAL 577           H        VAL 577  32.641  46.796  30.065
  198    HA   VAL 577           HA       VAL 577  34.549  45.408  28.802
  199    HB   VAL 577           HB       VAL 577  32.414  47.296  27.780
  200   HG11  VAL 577          HG11      VAL 577  34.532  45.761  26.274
  201   HG12  VAL 577          HG12      VAL 577  32.933  45.994  25.544
  202   HG13  VAL 577          HG13      VAL 577  33.900  47.408  26.037
  203   HG21  VAL 577          HG21      VAL 577  31.748  45.091  28.902
  204   HG22  VAL 577          HG22      VAL 577  31.344  45.204  27.201
  205   HG23  VAL 577          HG23      VAL 577  32.829  44.299  27.774
  206    H    GLU 578           H        GLU 578  36.700  45.796  28.321
  207    HA   GLU 578           HA       GLU 578  37.620  48.574  27.802
  208    HB2  GLU 578           HB2      GLU 578  38.630  47.304  29.682
  209    HB3  GLU 578           HB3      GLU 578  39.069  46.019  28.552
  210    HG2  GLU 578           HG2      GLU 578  40.968  47.369  29.147
  211    HG3  GLU 578           HG3      GLU 578  40.597  47.376  27.416
  212    H    ALA 579           H        ALA 579  37.531  45.309  26.298
  213    HA   ALA 579           HA       ALA 579  37.927  46.438  23.709
  214    HB1  ALA 579           HB1      ALA 579  40.143  45.287  23.219
  215    HB2  ALA 579           HB2      ALA 579  40.274  46.657  24.337
  216    HB3  ALA 579           HB3      ALA 579  40.321  44.979  24.942
  217    H    LEU 580           H        LEU 580  36.450  45.069  22.570
  218    HA   LEU 580           HA       LEU 580  36.617  42.102  23.045
  219    HB2  LEU 580           HB2      LEU 580  34.106  43.558  22.359
  220    HB3  LEU 580           HB3      LEU 580  34.264  41.954  23.041
  221    HG   LEU 580           HG       LEU 580  34.263  44.651  24.292
  222   HD11  LEU 580          HD11      LEU 580  32.747  42.104  24.852
  223   HD12  LEU 580          HD12      LEU 580  32.935  43.237  26.150
  224   HD13  LEU 580          HD13      LEU 580  32.222  43.815  24.650
  225   HD21  LEU 580          HD21      LEU 580  35.917  44.390  25.600
  226   HD22  LEU 580          HD22      LEU 580  34.983  43.211  26.517
  227   HD23  LEU 580          HD23      LEU 580  36.128  42.664  25.248
  228    H    HIS 581           H        HIS 581  36.621  40.884  21.500
  229    HA   HIS 581           HA       HIS 581  36.044  39.790  19.513
  230    HB2  HIS 581           HB2      HIS 581  33.942  41.212  19.774
  231    HB3  HIS 581           HB3      HIS 581  34.621  42.348  18.618
  232    HD2  HIS 581           HD2      HIS 581  33.754  42.066  16.308
  233    HE1  HIS 581           HE1      HIS 581  32.759  37.922  16.454
  234    HE2  HIS 581           HE2      HIS 581  32.591  40.073  15.046
  235    H    SER 582           H        SER 582  38.309  42.049  19.815
  236    HA   SER 582           HA       SER 582  38.884  42.591  17.008
  237    HB2  SER 582           HB2      SER 582  40.925  43.763  17.940
  238    HB3  SER 582           HB3      SER 582  39.412  44.399  18.516
  239    HG   SER 582           HG       SER 582  40.648  44.129  20.213
  240    H    SER 583           H        SER 583  39.302  39.620  18.404
  241    HA   SER 583           HA       SER 583  41.316  38.920  16.459
  242    HB2  SER 583           HB2      SER 583  43.054  38.134  17.978
  243    HB3  SER 583           HB3      SER 583  42.924  39.895  17.874
  244    HG   SER 583           HG       SER 583  42.977  38.424  19.898
  245    H    GLY 584           H        GLY 584  39.240  37.781  19.089
  246    HA2  GLY 584           HA2      GLY 584  38.804  35.287  17.736
  247    HA3  GLY 584           HA3      GLY 584  39.869  35.084  19.146
  248    H    MET 585           H        MET 585  38.220  33.707  19.816
  249    HA   MET 585           HA       MET 585  35.633  34.396  20.567
  250    HB2  MET 585           HB2      MET 585  35.582  32.392  21.780
  251    HB3  MET 585           HB3      MET 585  36.564  32.102  20.350
  252    HG2  MET 585           HG2      MET 585  37.816  32.469  23.103
  253    HG3  MET 585           HG3      MET 585  37.269  30.960  22.425
  254    HE1  MET 585           HE1      MET 585  40.235  32.352  23.399
  255    HE2  MET 585           HE2      MET 585  41.315  32.707  22.050
  256    HE3  MET 585           HE3      MET 585  39.889  33.747  22.324
  257    H    THR 586           H        THR 586  38.401  35.490  22.360
  258    HA   THR 586           HA       THR 586  36.668  35.964  24.778
  259    HB   THR 586           HB       THR 586  38.915  36.463  25.882
  260    HG1  THR 586           HG1      THR 586  40.589  35.803  24.803
  261   HG21  THR 586          HG21      THR 586  37.571  34.395  26.303
  262   HG22  THR 586          HG22      THR 586  38.422  33.632  24.938
  263   HG23  THR 586          HG23      THR 586  39.297  34.166  26.409
  264    H    ALA 587           H        ALA 587  37.212  37.910  26.024
  265    HA   ALA 587           HA       ALA 587  37.564  40.411  24.504
  266    HB1  ALA 587           HB1      ALA 587  35.295  40.467  24.235
  267    HB2  ALA 587           HB2      ALA 587  34.997  39.180  25.449
  268    HB3  ALA 587           HB3      ALA 587  35.213  40.822  25.976
  269    H    VAL 588           H        VAL 588  38.233  42.059  25.738
  270    HA   VAL 588           HA       VAL 588  39.124  41.378  28.467
  271    HB   VAL 588           HB       VAL 588  39.875  43.860  26.933
  272   HG11  VAL 588          HG11      VAL 588  40.337  44.033  29.232
  273   HG12  VAL 588          HG12      VAL 588  40.908  42.347  29.354
  274   HG13  VAL 588          HG13      VAL 588  41.895  43.541  28.522
  275   HG21  VAL 588          HG21      VAL 588  40.558  41.923  25.542
  276   HG22  VAL 588          HG22      VAL 588  42.001  42.542  26.366
  277   HG23  VAL 588          HG23      VAL 588  41.197  41.082  26.962
  278    H    VAL 589           H        VAL 589  37.992  42.167  30.238
  279    HA   VAL 589           HA       VAL 589  36.458  44.703  29.992
  280    HB   VAL 589           HB       VAL 589  34.554  43.692  31.065
  281   HG11  VAL 589          HG11      VAL 589  35.267  41.720  28.904
  282   HG12  VAL 589          HG12      VAL 589  33.692  42.422  29.349
  283   HG13  VAL 589          HG13      VAL 589  34.936  43.436  28.556
  284   HG21  VAL 589          HG21      VAL 589  35.520  41.964  32.523
  285   HG22  VAL 589          HG22      VAL 589  34.423  41.172  31.397
  286   HG23  VAL 589          HG23      VAL 589  36.187  41.101  31.140
  287    H    LYS 590           H        LYS 590  36.482  45.956  31.889
  288    HA   LYS 590           HA       LYS 590  38.331  45.084  34.017
  289    HB2  LYS 590           HB2      LYS 590  39.027  47.068  32.785
  290    HB3  LYS 590           HB3      LYS 590  37.471  47.852  33.104
  291    HG2  LYS 590           HG2      LYS 590  37.964  48.095  35.462
  292    HG3  LYS 590           HG3      LYS 590  39.421  47.156  35.347
  293    HD2  LYS 590           HD2      LYS 590  40.648  48.776  34.228
  294    HD3  LYS 590           HD3      LYS 590  39.261  49.698  33.659
  295    HE2  LYS 590           HE2      LYS 590  39.866  49.406  36.600
  296    HE3  LYS 590           HE3      LYS 590  40.715  50.579  35.523
  297    HZ1  LYS 590           HZ1      LYS 590  37.794  50.592  35.720
  298    HZ2  LYS 590           HZ2      LYS 590  38.727  51.413  36.752
  299    HZ3  LYS 590           HZ3      LYS 590  38.808  51.728  35.149
  300    H    PHE 591           H        PHE 591  37.398  44.367  35.738
  301    HA   PHE 591           HA       PHE 591  34.591  44.515  36.303
  302    HB2  PHE 591           HB2      PHE 591  37.027  43.491  37.730
  303    HB3  PHE 591           HB3      PHE 591  35.410  43.324  38.408
  304    HD1  PHE 591           HD2      PHE 591  33.617  42.146  37.167
  305    HD2  PHE 591           HD1      PHE 591  37.704  41.944  35.816
  306    HE1  PHE 591           HE2      PHE 591  33.084  40.109  35.835
  307    HE2  PHE 591           HE1      PHE 591  37.149  39.956  34.458
  308    HZ   PHE 591           HZ       PHE 591  34.874  39.000  34.492
  309    H    ILE 592           H        ILE 592  33.360  46.002  37.369
  310    HA   ILE 592           HA       ILE 592  34.745  48.458  38.022
  311    HB   ILE 592           HB       ILE 592  31.848  48.402  38.471
  312   HG12  ILE 592          HG12      ILE 592  32.982  47.839  35.718
  313   HG13  ILE 592          HG13      ILE 592  31.773  46.949  36.605
  314   HG21  ILE 592          HG21      ILE 592  33.494  50.269  36.658
  315   HG22  ILE 592          HG22      ILE 592  32.047  50.680  37.593
  316   HG23  ILE 592          HG23      ILE 592  33.574  50.483  38.395
  317   HD11  ILE 592          HD11      ILE 592  31.316  49.698  35.397
  318   HD12  ILE 592          HD12      ILE 592  30.816  48.160  34.705
  319   HD13  ILE 592          HD13      ILE 592  30.087  48.673  36.214
  320    H    ASP 593           H        ASP 593  34.672  45.972  39.997
  321    HA   ASP 593           HA       ASP 593  34.685  47.638  42.453
  322    HB2  ASP 593           HB2      ASP 593  32.443  46.390  42.226
  323    HB3  ASP 593           HB3      ASP 593  33.384  44.892  42.273
  324    H    TYR 594           H        TYR 594  36.561  46.567  40.732
  325    HA   TYR 594           HA       TYR 594  38.499  45.100  42.439
  326    HB2  TYR 594           HB2      TYR 594  37.632  44.118  39.685
  327    HB3  TYR 594           HB3      TYR 594  38.973  43.484  40.619
  328    HD1  TYR 594           HD1      TYR 594  35.267  43.721  40.574
  329    HD2  TYR 594           HD2      TYR 594  38.727  41.677  42.108
  330    HE1  TYR 594           HE1      TYR 594  33.811  41.904  41.429
  331    HE2  TYR 594           HE2      TYR 594  37.274  40.087  43.297
  332    HH   TYR 594           HH       TYR 594  33.745  40.166  43.033
  333    H    GLY 595           H        GLY 595  37.631  46.931  39.594
  334    HA2  GLY 595           HA2      GLY 595  38.738  48.355  38.281
  335    HA3  GLY 595           HA3      GLY 595  39.740  48.650  39.717
  336    H    ASN 596           H        ASN 596  39.849  45.490  38.006
  337    HA   ASN 596           HA       ASN 596  42.008  46.456  36.265
  338    HB2  ASN 596           HB2      ASN 596  43.530  44.680  36.794
  339    HB3  ASN 596           HB3      ASN 596  43.074  45.578  38.237
  340   HD21  ASN 596          HD22      ASN 596  42.477  44.318  39.960
  341   HD22  ASN 596          HD21      ASN 596  42.059  42.606  39.877
  342    H    TYR 597           H        TYR 597  42.479  44.639  34.566
  343    HA   TYR 597           HA       TYR 597  39.863  43.447  33.770
  344    HB2  TYR 597           HB2      TYR 597  40.757  43.855  31.364
  345    HB3  TYR 597           HB3      TYR 597  39.784  45.030  32.161
  346    HD1  TYR 597           HD2      TYR 597  41.302  46.729  33.801
  347    HD2  TYR 597           HD1      TYR 597  42.473  44.877  30.072
  348    HE1  TYR 597           HE2      TYR 597  42.912  48.475  33.470
  349    HE2  TYR 597           HE1      TYR 597  43.913  46.834  29.577
  350    HH   TYR 597           HH       TYR 597  44.924  48.804  30.562
  351    H    GLU 598           H        GLU 598  39.811  41.905  32.302
  352    HA   GLU 598           HA       GLU 598  42.109  40.218  31.715
  353    HB2  GLU 598           HB2      GLU 598  41.142  38.262  32.829
  354    HB3  GLU 598           HB3      GLU 598  41.747  39.561  33.892
  355    HG2  GLU 598           HG2      GLU 598  39.414  40.243  34.360
  356    HG3  GLU 598           HG3      GLU 598  38.819  38.907  33.390
  357    H    GLU 599           H        GLU 599  41.384  38.277  30.500
  358    HA   GLU 599           HA       GLU 599  39.283  38.804  28.602
  359    HB2  GLU 599           HB2      GLU 599  41.151  36.503  29.208
  360    HB3  GLU 599           HB3      GLU 599  39.900  36.380  27.944
  361    HG2  GLU 599           HG2      GLU 599  40.856  38.326  26.795
  362    HG3  GLU 599           HG3      GLU 599  42.063  38.485  28.100
  363    H    VAL 600           H        VAL 600  37.263  38.121  28.676
  364    HA   VAL 600           HA       VAL 600  36.497  35.655  30.079
  365    HB   VAL 600           HB       VAL 600  34.807  38.184  29.797
  366   HG11  VAL 600          HG11      VAL 600  33.223  36.446  29.694
  367   HG12  VAL 600          HG12      VAL 600  34.140  35.426  30.867
  368   HG13  VAL 600          HG13      VAL 600  33.251  36.850  31.398
  369   HG21  VAL 600          HG21      VAL 600  36.213  36.926  32.172
  370   HG22  VAL 600          HG22      VAL 600  36.154  38.641  31.672
  371   HG23  VAL 600          HG23      VAL 600  34.755  37.880  32.427
  372    H    LEU 601           H        LEU 601  34.762  34.485  28.649
  373    HA   LEU 601           HA       LEU 601  35.238  34.785  25.801
  374    HB2  LEU 601           HB2      LEU 601  34.237  32.770  27.441
  375    HB3  LEU 601           HB3      LEU 601  32.780  33.325  26.615
  376    HG   LEU 601           HG       LEU 601  33.921  33.012  24.428
  377   HD11  LEU 601          HD11      LEU 601  36.255  33.152  25.021
  378   HD12  LEU 601          HD12      LEU 601  36.070  31.864  26.245
  379   HD13  LEU 601          HD13      LEU 601  35.988  31.483  24.509
  380   HD21  LEU 601          HD21      LEU 601  32.464  31.194  25.330
  381   HD22  LEU 601          HD22      LEU 601  33.805  30.549  24.380
  382   HD23  LEU 601          HD23      LEU 601  33.852  30.486  26.160
  383    H    LEU 602           H        LEU 602  33.860  35.663  24.108
  384    HA   LEU 602           HA       LEU 602  32.449  38.042  24.761
  385    HB2  LEU 602           HB2      LEU 602  32.267  36.164  22.401
  386    HB3  LEU 602           HB3      LEU 602  31.565  37.788  22.395
  387    HG   LEU 602           HG       LEU 602  34.469  37.656  23.095
  388   HD11  LEU 602          HD11      LEU 602  33.529  37.379  20.205
  389   HD12  LEU 602          HD12      LEU 602  35.190  37.575  20.789
  390   HD13  LEU 602          HD13      LEU 602  34.287  36.080  21.152
  391   HD21  LEU 602          HD21      LEU 602  33.232  39.791  22.962
  392   HD22  LEU 602          HD22      LEU 602  34.431  39.694  21.624
  393   HD23  LEU 602          HD23      LEU 602  32.703  39.411  21.325
  394    H    SER 603           H        SER 603  31.221  34.733  24.166
  395    HA   SER 603           HA       SER 603  28.434  35.263  24.337
  396    HB2  SER 603           HB2      SER 603  28.461  32.707  24.749
  397    HB3  SER 603           HB3      SER 603  29.227  33.248  23.246
  398    HG   SER 603           HG       SER 603  30.640  31.942  24.257
  399    H    ASN 604           H        ASN 604  30.717  35.500  26.803
  400    HA   ASN 604           HA       ASN 604  28.935  34.415  28.928
  401    HB2  ASN 604           HB2      ASN 604  31.911  34.381  28.430
  402    HB3  ASN 604           HB3      ASN 604  31.289  34.182  30.039
  403   HD21  ASN 604          HD22      ASN 604  28.956  32.560  27.937
  404   HD22  ASN 604          HD21      ASN 604  29.772  31.016  28.139
  405    H    ILE 605           H        ILE 605  29.949  37.274  27.413
  406    HA   ILE 605           HA       ILE 605  29.497  38.809  29.936
  407    HB   ILE 605           HB       ILE 605  30.298  39.893  27.233
  408   HG12  ILE 605          HG12      ILE 605  32.318  39.772  29.480
  409   HG13  ILE 605          HG13      ILE 605  32.129  38.308  28.538
  410   HG21  ILE 605          HG21      ILE 605  29.287  41.555  28.707
  411   HG22  ILE 605          HG22      ILE 605  30.371  41.087  30.027
  412   HG23  ILE 605          HG23      ILE 605  31.010  41.868  28.546
  413   HD11  ILE 605          HD11      ILE 605  33.948  39.790  27.728
  414   HD12  ILE 605          HD12      ILE 605  32.759  39.260  26.521
  415   HD13  ILE 605          HD13      ILE 605  32.731  40.924  27.119
  416    H    LYS 606           H        LYS 606  27.429  39.373  30.234
  417    HA   LYS 606           HA       LYS 606  25.447  39.671  27.983
  418    HB2  LYS 606           HB2      LYS 606  23.877  38.697  29.393
  419    HB3  LYS 606           HB3      LYS 606  25.360  37.916  29.990
  420    HG2  LYS 606           HG2      LYS 606  25.535  39.737  31.684
  421    HG3  LYS 606           HG3      LYS 606  23.893  40.284  31.232
  422    HD2  LYS 606           HD2      LYS 606  24.663  37.578  32.292
  423    HD3  LYS 606           HD3      LYS 606  23.998  38.951  33.216
  424    HE2  LYS 606           HE2      LYS 606  21.861  38.793  32.098
  425    HE3  LYS 606           HE3      LYS 606  22.412  37.547  30.987
  426    HZ1  LYS 606           HZ1      LYS 606  22.399  37.140  33.880
  427    HZ2  LYS 606           HZ2      LYS 606  21.164  36.712  32.943
  428    HZ3  LYS 606           HZ3      LYS 606  22.621  36.001  32.715
  429    HA   PRO 607           HA       PRO 607  25.180  43.814  28.893
  430    HB2  PRO 607           HB2      PRO 607  22.620  44.577  28.512
  431    HB3  PRO 607           HB3      PRO 607  23.569  43.815  27.203
  432    HG2  PRO 607           HG2      PRO 607  21.677  42.356  29.115
  433    HG3  PRO 607           HG3      PRO 607  21.591  42.405  27.327
  434    HD2  PRO 607           HD2      PRO 607  22.840  40.433  28.715
  435    HD3  PRO 607           HD3      PRO 607  23.555  40.995  27.200
  436    H    ILE 608           H        ILE 608  24.199  45.545  30.090
  437    HA   ILE 608           HA       ILE 608  23.367  44.854  32.851
  438    HB   ILE 608           HB       ILE 608  25.014  46.956  31.604
  439   HG12  ILE 608          HG12      ILE 608  24.563  46.125  34.500
  440   HG13  ILE 608          HG13      ILE 608  25.661  45.264  33.411
  441   HG21  ILE 608          HG21      ILE 608  22.842  47.883  33.436
  442   HG22  ILE 608          HG22      ILE 608  24.420  48.700  33.245
  443   HG23  ILE 608          HG23      ILE 608  23.369  48.475  31.824
  444   HD11  ILE 608          HD11      ILE 608  26.072  47.767  34.946
  445   HD12  ILE 608          HD12      ILE 608  27.179  46.464  34.570
  446   HD13  ILE 608          HD13      ILE 608  26.835  47.695  33.334
  447    H    LEU 609           H        LEU 609  22.063  46.396  29.949
  448    HA   LEU 609           HA       LEU 609  19.382  46.047  31.120
  449    HB2  LEU 609           HB2      LEU 609  20.130  48.363  31.598
  450    HB3  LEU 609           HB3      LEU 609  20.478  48.639  29.925
  451    HG   LEU 609           HG       LEU 609  18.464  49.771  30.890
  452   HD11  LEU 609          HD11      LEU 609  18.901  49.545  28.552
  453   HD12  LEU 609          HD12      LEU 609  17.975  48.018  28.468
  454   HD13  LEU 609          HD13      LEU 609  17.146  49.538  28.875
  455   HD21  LEU 609          HD21      LEU 609  16.968  47.175  30.629
  456   HD22  LEU 609          HD22      LEU 609  17.546  47.847  32.189
  457   HD23  LEU 609          HD23      LEU 609  16.411  48.768  31.206
  458    H    GLU 610           H        GLU 610  17.974  45.141  29.745
  459    HA   GLU 610           HA       GLU 610  19.257  43.859  27.506
  460    HB2  GLU 610           HB2      GLU 610  17.806  42.712  29.259
  461    HB3  GLU 610           HB3      GLU 610  16.408  43.548  28.621
  462    HG2  GLU 610           HG2      GLU 610  16.399  41.297  27.909
  463    HG3  GLU 610           HG3      GLU 610  16.641  42.258  26.497
  464    H1   TYR 611           H1       TYR 611  46.266  49.510  48.009
  465    H2   TYR 611           H2       TYR 611  46.393  50.606  46.790
  466    H3   TYR 611           H3       TYR 611  47.533  49.457  46.993
  467    HA   TYR 611           HA       TYR 611  44.720  48.876  46.271
  468    HB2  TYR 611           HB2      TYR 611  46.014  50.079  44.543
  469    HB3  TYR 611           HB3      TYR 611  47.204  48.780  44.613
  470    HD1  TYR 611           HD1      TYR 611  43.495  49.399  43.939
  471    HD2  TYR 611           HD2      TYR 611  46.907  46.840  43.254
  472    HE1  TYR 611           HE1      TYR 611  42.219  48.142  42.239
  473    HE2  TYR 611           HE2      TYR 611  45.641  45.637  41.493
  474    HH   TYR 611           HH       TYR 611  42.238  46.342  40.767
  475    H    SER 612           H        SER 612  44.602  47.422  47.855
  476    HA   SER 612           HA       SER 612  44.572  45.490  48.850
  477    HB2  SER 612           HB2      SER 612  45.237  44.389  46.102
  478    HB3  SER 612           HB3      SER 612  44.435  43.533  47.424
  479    HG   SER 612           HG       SER 612  42.941  44.374  45.969
  480    HA   PRO 613           HA       PRO 613  49.274  44.983  49.457
  481    HB2  PRO 613           HB2      PRO 613  48.173  44.491  52.199
  482    HB3  PRO 613           HB3      PRO 613  49.719  45.275  51.752
  483    HG2  PRO 613           HG2      PRO 613  47.595  46.773  52.466
  484    HG3  PRO 613           HG3      PRO 613  48.646  47.293  51.126
  485    HD2  PRO 613           HD2      PRO 613  45.953  46.016  51.079
  486    HD3  PRO 613           HD3      PRO 613  46.638  47.250  49.964
  487    H    SER 614           H        SER 614  46.584  42.636  50.293
  488    HA   SER 614           HA       SER 614  48.512  40.413  50.399
  489    HB2  SER 614           HB2      SER 614  45.445  40.301  50.553
  490    HB3  SER 614           HB3      SER 614  46.567  39.057  51.041
  491    HG   SER 614           HG       SER 614  46.835  40.036  52.780
  492    H    SER 615           H        SER 615  47.081  42.021  48.043
  493    HA   SER 615           HA       SER 615  46.315  41.764  45.924
  494    HB2  SER 615           HB2      SER 615  48.260  39.472  45.600
  495    HB3  SER 615           HB3      SER 615  47.865  40.765  44.483
  496    HG   SER 615           HG       SER 615  49.128  42.104  45.678
  497    HA   PRO 616           HA       PRO 616  44.166  37.583  46.939
  498    HB2  PRO 616           HB2      PRO 616  41.541  38.275  47.196
  499    HB3  PRO 616           HB3      PRO 616  42.734  38.378  48.521
  500    HG2  PRO 616           HG2      PRO 616  41.956  40.612  46.607
  501    HG3  PRO 616           HG3      PRO 616  41.957  40.682  48.414
  502    HD2  PRO 616           HD2      PRO 616  44.003  41.633  47.042
  503    HD3  PRO 616           HD3      PRO 616  44.310  40.597  48.480
  504   HC11  DA2 617          HC11      DA2 617  35.727  39.738  37.882
  505   HC12  DA2 617          HC12      DA2 617  37.255  40.350  38.546
  506   HC13  DA2 617          HC13      DA2 617  37.216  38.840  37.603
  507   HC21  DA2 617          HC21      DA2 617  35.055  37.272  40.364
  508   HC22  DA2 617          HC22      DA2 617  34.752  37.757  38.704
  509   HC23  DA2 617          HC23      DA2 617  34.418  38.884  40.026
  510    H2   DA2 617           H        DA2 617  43.334  39.860  44.325
  511    HA   DA2 617           HA       DA2 617  41.785  37.818  42.833
  512   HCB1  DA2 617          HCB1      DA2 617  42.559  40.708  42.049
  513   HCB2  DA2 617          HCB2      DA2 617  41.135  40.344  42.943
  514   HCG1  DA2 617          HCG1      DA2 617  40.682  40.628  40.540
  515   HCG2  DA2 617          HCG2      DA2 617  41.676  39.221  40.168
  516   HCD1  DA2 617          HCD1      DA2 617  40.161  37.715  41.204
  517   HCD2  DA2 617          HCD2      DA2 617  39.449  39.001  42.209
  518    HNE  DA2 617           HNE      DA2 617  38.946  39.439  39.408
  519   HNH2  DA2 617          HNH2      DA2 617  37.970  37.354  42.120
  520   HNH1  DA2 617          HNH1      DA2 617  36.297  37.319  41.685
  521    H    TYR 618           H        TYR 618  42.521  36.503  41.320
  522    HA   TYR 618           HA       TYR 618  45.197  36.013  40.792
  523    HB2  TYR 618           HB2      TYR 618  42.862  35.242  39.044
  524    HB3  TYR 618           HB3      TYR 618  44.376  34.410  39.162
  525    HD1  TYR 618           HD1      TYR 618  44.824  32.980  41.354
  526    HD2  TYR 618           HD2      TYR 618  41.124  35.056  40.576
  527    HE1  TYR 618           HE1      TYR 618  43.661  31.551  43.022
  528    HE2  TYR 618           HE2      TYR 618  39.960  33.591  42.252
  529    HH   TYR 618           HH       TYR 618  41.734  31.230  44.118
  530    H    THR 619           H        THR 619  44.545  38.871  39.869
  531    HA   THR 619           HA       THR 619  43.979  39.211  37.198
  532    HB   THR 619           HB       THR 619  43.882  40.868  38.850
  533    HG1  THR 619           HG1      THR 619  43.918  41.835  37.080
  534   HG21  THR 619          HG21      THR 619  45.980  40.677  40.193
  535   HG22  THR 619          HG22      THR 619  46.910  41.103  38.746
  536   HG23  THR 619          HG23      THR 619  45.771  42.272  39.472
  537    HA   PRO 620           HA       PRO 620  47.438  38.036  34.492
  538    HB2  PRO 620           HB2      PRO 620  46.579  40.721  33.387
  539    HB3  PRO 620           HB3      PRO 620  47.142  39.300  32.457
  540    HG2  PRO 620           HG2      PRO 620  44.490  39.624  32.717
  541    HG3  PRO 620           HG3      PRO 620  45.150  38.025  33.195
  542    HD2  PRO 620           HD2      PRO 620  44.531  40.404  34.934
  543    HD3  PRO 620           HD3      PRO 620  44.057  38.667  35.162
  544    H    GLN 621           H        GLN 621  49.504  38.594  33.871
  545    HA   GLN 621           HA       GLN 621  50.962  40.793  35.200
  546    HB2  GLN 621           HB2      GLN 621  51.655  37.824  35.591
  547    HB3  GLN 621           HB3      GLN 621  52.554  39.195  36.213
  548    HG2  GLN 621           HG2      GLN 621  50.586  39.827  37.622
  549    HG3  GLN 621           HG3      GLN 621  49.690  38.420  37.006
  550   HE21  GLN 621          HE22      GLN 621  53.065  38.685  38.315
  551   HE22  GLN 621          HE21      GLN 621  52.790  37.369  39.437
  552    H    SER 622           H        SER 622  50.526  39.250  32.285
  553    HA   SER 622           HA       SER 622  53.214  39.570  31.250
  554    HB2  SER 622           HB2      SER 622  50.531  39.629  29.814
  555    HB3  SER 622           HB3      SER 622  52.141  39.554  29.045
  556    HG   SER 622           HG       SER 622  51.241  37.560  29.336
  557    HA   PRO 623           HA       PRO 623  53.797  43.799  31.312
  558    HB2  PRO 623           HB2      PRO 623  55.502  44.347  29.284
  559    HB3  PRO 623           HB3      PRO 623  55.986  43.296  30.647
  560    HG2  PRO 623           HG2      PRO 623  55.020  42.416  27.912
  561    HG3  PRO 623           HG3      PRO 623  56.399  41.774  28.867
  562    HD2  PRO 623           HD2      PRO 623  54.092  40.469  28.884
  563    HD3  PRO 623           HD3      PRO 623  55.105  40.630  30.329
  Start of MODEL    4
    1    H1   MET 553           H1       MET 553  22.712  44.449  13.595
    2    H2   MET 553           H2       MET 553  23.103  45.993  13.264
    3    H3   MET 553           H3       MET 553  21.987  45.644  14.449
    4    HA   MET 553           HA       MET 553  24.781  44.789  14.539
    5    HB2  MET 553           HB2      MET 553  25.120  46.408  16.326
    6    HB3  MET 553           HB3      MET 553  25.032  47.065  14.676
    7    HG2  MET 553           HG2      MET 553  22.706  47.294  16.616
    8    HG3  MET 553           HG3      MET 553  23.992  48.481  16.463
    9    HE1  MET 553           HE1      MET 553  20.865  49.910  14.477
   10    HE2  MET 553           HE2      MET 553  21.254  49.367  16.146
   11    HE3  MET 553           HE3      MET 553  22.236  50.629  15.365
   12    H    LYS 554           H        LYS 554  25.120  43.326  15.817
   13    HA   LYS 554           HA       LYS 554  23.283  42.582  18.095
   14    HB2  LYS 554           HB2      LYS 554  24.219  40.783  15.827
   15    HB3  LYS 554           HB3      LYS 554  23.432  40.247  17.323
   16    HG2  LYS 554           HG2      LYS 554  21.418  41.492  16.778
   17    HG3  LYS 554           HG3      LYS 554  22.202  42.256  15.384
   18    HD2  LYS 554           HD2      LYS 554  20.639  40.417  14.743
   19    HD3  LYS 554           HD3      LYS 554  22.260  40.175  14.155
   20    HE2  LYS 554           HE2      LYS 554  21.412  38.104  15.025
   21    HE3  LYS 554           HE3      LYS 554  22.680  38.616  16.137
   22    HZ1  LYS 554           HZ1      LYS 554  21.039  39.364  17.694
   23    HZ2  LYS 554           HZ2      LYS 554  19.855  39.273  16.600
   24    HZ3  LYS 554           HZ3      LYS 554  20.487  37.904  17.174
   25    H    MET 555           H        MET 555  26.481  42.294  16.587
   26    HA   MET 555           HA       MET 555  27.418  40.581  18.711
   27    HB2  MET 555           HB2      MET 555  28.371  40.878  16.211
   28    HB3  MET 555           HB3      MET 555  29.247  42.218  16.939
   29    HG2  MET 555           HG2      MET 555  30.270  40.706  18.568
   30    HG3  MET 555           HG3      MET 555  29.507  39.309  17.796
   31    HE1  MET 555           HE1      MET 555  33.362  39.133  16.672
   32    HE2  MET 555           HE2      MET 555  32.617  39.519  18.238
   33    HE3  MET 555           HE3      MET 555  32.036  38.124  17.285
   34    H    TRP 556           H        TRP 556  28.900  41.222  20.468
   35    HA   TRP 556           HA       TRP 556  28.574  43.763  21.661
   36    HB2  TRP 556           HB2      TRP 556  30.722  41.675  22.054
   37    HB3  TRP 556           HB3      TRP 556  30.512  43.185  22.983
   38    HD1  TRP 556           HD1      TRP 556  29.955  39.746  23.524
   39    HE1  TRP 556           HE1      TRP 556  28.333  39.411  25.482
   40    HE3  TRP 556           HE3      TRP 556  27.583  44.314  23.443
   41    HZ2  TRP 556           HZ2      TRP 556  26.581  41.080  27.093
   42    HZ3  TRP 556           HZ3      TRP 556  25.937  44.867  25.117
   43    HH2  TRP 556           HH2      TRP 556  25.532  43.320  27.071
   44    H    LYS 557           H        LYS 557  30.195  45.340  22.170
   45    HA   LYS 557           HA       LYS 557  32.424  46.007  20.383
   46    HB2  LYS 557           HB2      LYS 557  29.786  47.542  20.329
   47    HB3  LYS 557           HB3      LYS 557  31.308  48.395  20.165
   48    HG2  LYS 557           HG2      LYS 557  31.914  47.003  18.207
   49    HG3  LYS 557           HG3      LYS 557  30.401  46.100  18.394
   50    HD2  LYS 557           HD2      LYS 557  29.123  48.247  18.058
   51    HD3  LYS 557           HD3      LYS 557  30.687  49.101  17.927
   52    HE2  LYS 557           HE2      LYS 557  31.254  47.709  15.974
   53    HE3  LYS 557           HE3      LYS 557  29.690  46.837  16.157
   54    HZ1  LYS 557           HZ1      LYS 557  29.551  48.541  14.467
   55    HZ2  LYS 557           HZ2      LYS 557  28.587  48.934  15.742
   56    HZ3  LYS 557           HZ3      LYS 557  29.987  49.685  15.509
   57    HA   PRO 558           HA       PRO 558  34.007  47.543  24.189
   58    HB2  PRO 558           HB2      PRO 558  35.515  49.698  23.413
   59    HB3  PRO 558           HB3      PRO 558  35.982  48.000  23.074
   60    HG2  PRO 558           HG2      PRO 558  34.581  50.025  21.331
   61    HG3  PRO 558           HG3      PRO 558  35.902  48.940  20.801
   62    HD2  PRO 558           HD2      PRO 558  33.410  48.417  20.239
   63    HD3  PRO 558           HD3      PRO 558  34.527  47.067  20.734
   64    H    GLY 559           H        GLY 559  33.692  49.186  25.769
   65    HA2  GLY 559           HA2      GLY 559  32.899  51.203  26.664
   66    HA3  GLY 559           HA3      GLY 559  32.393  51.675  25.039
   67    H    ASP 560           H        ASP 560  31.435  49.001  27.295
   68    HA   ASP 560           HA       ASP 560  28.746  50.174  27.619
   69    HB2  ASP 560           HB2      ASP 560  29.092  48.370  25.529
   70    HB3  ASP 560           HB3      ASP 560  28.791  47.269  26.857
   71    H    GLU 561           H        GLU 561  28.613  50.155  29.888
   72    HA   GLU 561           HA       GLU 561  29.551  48.012  31.460
   73    HB2  GLU 561           HB2      GLU 561  27.963  48.694  33.179
   74    HB3  GLU 561           HB3      GLU 561  28.818  50.083  32.460
   75    HG2  GLU 561           HG2      GLU 561  26.590  50.424  31.099
   76    HG3  GLU 561           HG3      GLU 561  25.948  49.183  32.190
   77    H    CYS 562           H        CYS 562  29.135  45.916  31.582
   78    HA   CYS 562           HA       CYS 562  26.461  44.785  31.096
   79    HB2  CYS 562           HB2      CYS 562  29.066  43.736  29.850
   80    HB3  CYS 562           HB3      CYS 562  27.477  43.050  29.561
   81    HG   CYS 562           HG       CYS 562  28.875  45.734  28.358
   82    H    PHE 563           H        PHE 563  26.854  42.146  31.324
   83    HA   PHE 563           HA       PHE 563  27.973  41.735  34.073
   84    HB2  PHE 563           HB2      PHE 563  25.333  41.144  32.942
   85    HB3  PHE 563           HB3      PHE 563  26.123  39.755  33.678
   86    HD1  PHE 563           HD1      PHE 563  27.303  40.373  36.112
   87    HD2  PHE 563           HD2      PHE 563  23.889  42.256  34.314
   88    HE1  PHE 563           HE1      PHE 563  26.620  41.293  38.350
   89    HE2  PHE 563           HE2      PHE 563  23.243  43.204  36.525
   90    HZ   PHE 563           HZ       PHE 563  24.577  42.692  38.533
   91    H    ALA 564           H        ALA 564  29.650  40.397  34.009
   92    HA   ALA 564           HA       ALA 564  30.060  38.675  31.591
   93    HB1  ALA 564           HB1      ALA 564  32.186  40.210  33.052
   94    HB2  ALA 564           HB2      ALA 564  32.288  39.355  31.496
   95    HB3  ALA 564           HB3      ALA 564  31.289  40.820  31.618
   96    H    LEU 565           H        LEU 565  30.335  36.673  32.032
   97    HA   LEU 565           HA       LEU 565  30.158  35.433  34.579
   98    HB2  LEU 565           HB2      LEU 565  29.222  34.746  32.329
   99    HB3  LEU 565           HB3      LEU 565  30.866  34.238  31.887
  100    HG   LEU 565           HG       LEU 565  30.805  32.600  33.746
  101   HD11  LEU 565          HD11      LEU 565  27.943  33.611  34.043
  102   HD12  LEU 565          HD12      LEU 565  28.578  32.095  34.754
  103   HD13  LEU 565          HD13      LEU 565  29.255  33.651  35.248
  104   HD21  LEU 565          HD21      LEU 565  29.152  31.079  32.707
  105   HD22  LEU 565          HD22      LEU 565  28.540  32.401  31.688
  106   HD23  LEU 565          HD23      LEU 565  30.201  31.845  31.493
  107    H    TYR 566           H        TYR 566  31.771  35.989  35.871
  108    HA   TYR 566           HA       TYR 566  34.511  35.319  35.439
  109    HB2  TYR 566           HB2      TYR 566  33.455  36.687  37.435
  110    HB3  TYR 566           HB3      TYR 566  33.123  35.098  38.137
  111    HD1  TYR 566           HD1      TYR 566  35.948  36.783  36.331
  112    HD2  TYR 566           HD2      TYR 566  34.756  34.616  39.864
  113    HE1  TYR 566           HE1      TYR 566  38.289  36.738  37.070
  114    HE2  TYR 566           HE2      TYR 566  37.148  34.621  40.628
  115    HH   TYR 566           HH       TYR 566  39.761  35.838  38.681
  116    H    TRP 567           H        TRP 567  35.396  33.431  37.145
  117    HA   TRP 567           HA       TRP 567  34.165  30.983  35.837
  118    HB2  TRP 567           HB2      TRP 567  36.412  30.322  35.184
  119    HB3  TRP 567           HB3      TRP 567  36.050  31.925  34.551
  120    HD1  TRP 567           HD1      TRP 567  37.156  34.021  35.495
  121    HE1  TRP 567           HE1      TRP 567  39.416  34.405  36.664
  122    HE3  TRP 567           HE3      TRP 567  38.021  29.283  37.230
  123    HZ2  TRP 567           HZ2      TRP 567  41.139  33.019  38.338
  124    HZ3  TRP 567           HZ3      TRP 567  39.825  28.964  38.959
  125    HH2  TRP 567           HH2      TRP 567  41.426  30.747  39.425
  126    H    GLU 568           H        GLU 568  35.900  32.263  38.549
  127    HA   GLU 568           HA       GLU 568  36.628  29.936  39.907
  128    HB2  GLU 568           HB2      GLU 568  37.533  31.611  40.964
  129    HB3  GLU 568           HB3      GLU 568  36.313  32.772  40.421
  130    HG2  GLU 568           HG2      GLU 568  34.977  32.476  42.382
  131    HG3  GLU 568           HG3      GLU 568  35.979  31.142  42.962
  132    H    ASP 569           H        ASP 569  33.636  31.761  39.931
  133    HA   ASP 569           HA       ASP 569  32.250  29.522  41.243
  134    HB2  ASP 569           HB2      ASP 569  30.886  31.075  42.448
  135    HB3  ASP 569           HB3      ASP 569  32.573  31.454  42.780
  136    H    ASN 570           H        ASN 570  32.602  31.098  38.348
  137    HA   ASN 570           HA       ASN 570  31.382  31.172  36.431
  138    HB2  ASN 570           HB2      ASN 570  31.498  28.678  37.060
  139    HB3  ASN 570           HB3      ASN 570  29.805  28.872  37.560
  140   HD21  ASN 570          HD22      ASN 570  28.934  27.523  35.874
  141   HD22  ASN 570          HD21      ASN 570  29.154  27.998  34.189
  142    H    LYS 571           H        LYS 571  30.627  33.090  38.048
  143    HA   LYS 571           HA       LYS 571  27.688  33.402  37.622
  144    HB2  LYS 571           HB2      LYS 571  29.330  33.752  40.108
  145    HB3  LYS 571           HB3      LYS 571  28.457  35.200  39.661
  146    HG2  LYS 571           HG2      LYS 571  27.100  32.530  40.101
  147    HG3  LYS 571           HG3      LYS 571  27.320  33.789  41.334
  148    HD2  LYS 571           HD2      LYS 571  26.123  35.410  39.808
  149    HD3  LYS 571           HD3      LYS 571  25.699  34.040  38.775
  150    HE2  LYS 571           HE2      LYS 571  24.962  34.163  41.731
  151    HE3  LYS 571           HE3      LYS 571  23.966  34.820  40.447
  152    HZ1  LYS 571           HZ1      LYS 571  24.772  31.977  40.529
  153    HZ2  LYS 571           HZ2      LYS 571  23.339  32.537  41.003
  154    HZ3  LYS 571           HZ3      LYS 571  23.786  32.688  39.442
  155    H    PHE 572           H        PHE 572  27.016  35.533  37.177
  156    HA   PHE 572           HA       PHE 572  28.967  36.943  35.567
  157    HB2  PHE 572           HB2      PHE 572  26.240  37.970  36.412
  158    HB3  PHE 572           HB3      PHE 572  27.241  38.483  35.046
  159    HD1  PHE 572           HD2      PHE 572  27.511  37.170  33.072
  160    HD2  PHE 572           HD1      PHE 572  24.872  35.930  36.234
  161    HE1  PHE 572           HE2      PHE 572  26.644  35.306  31.629
  162    HE2  PHE 572           HE1      PHE 572  23.868  34.236  34.737
  163    HZ   PHE 572           HZ       PHE 572  24.876  33.802  32.503
  164    H    TYR 573           H        TYR 573  29.941  38.912  36.052
  165    HA   TYR 573           HA       TYR 573  29.317  40.395  38.593
  166    HB2  TYR 573           HB2      TYR 573  31.929  39.819  37.188
  167    HB3  TYR 573           HB3      TYR 573  31.760  41.065  38.440
  168    HD1  TYR 573           HD2      TYR 573  31.447  37.414  37.729
  169    HD2  TYR 573           HD1      TYR 573  31.893  40.435  40.798
  170    HE1  TYR 573           HE2      TYR 573  31.565  35.653  39.451
  171    HE2  TYR 573           HE1      TYR 573  32.235  38.608  42.480
  172    HH   TYR 573           HH       TYR 573  31.959  35.226  41.554
  173    H    ARG 574           H        ARG 574  29.380  42.652  38.403
  174    HA   ARG 574           HA       ARG 574  28.564  43.656  35.819
  175    HB2  ARG 574           HB2      ARG 574  29.589  45.318  38.174
  176    HB3  ARG 574           HB3      ARG 574  28.842  45.860  36.656
  177    HG2  ARG 574           HG2      ARG 574  27.008  46.030  37.959
  178    HG3  ARG 574           HG3      ARG 574  26.853  44.394  37.334
  179    HD2  ARG 574           HD2      ARG 574  26.255  44.450  39.680
  180    HD3  ARG 574           HD3      ARG 574  27.744  43.526  39.514
  181    HE   ARG 574           HE       ARG 574  29.001  45.330  40.580
  182   HH11  ARG 574          HH11      ARG 574  25.568  46.072  40.554
  183   HH12  ARG 574          HH12      ARG 574  25.748  47.113  41.947
  184   HH21  ARG 574          HH21      ARG 574  29.117  46.760  42.201
  185   HH22  ARG 574          HH22      ARG 574  27.664  47.344  42.948
  186    H    ALA 575           H        ALA 575  29.780  44.370  34.216
  187    HA   ALA 575           HA       ALA 575  32.538  45.306  34.677
  188    HB1  ALA 575           HB1      ALA 575  31.794  42.863  33.018
  189    HB2  ALA 575           HB2      ALA 575  33.442  43.620  33.130
  190    HB3  ALA 575           HB3      ALA 575  32.641  42.909  34.540
  191    H    GLU 576           H        GLU 576  33.050  47.011  33.577
  192    HA   GLU 576           HA       GLU 576  31.594  48.112  31.317
  193    HB2  GLU 576           HB2      GLU 576  34.351  48.794  32.405
  194    HB3  GLU 576           HB3      GLU 576  33.316  49.780  31.339
  195    HG2  GLU 576           HG2      GLU 576  31.726  49.963  33.299
  196    HG3  GLU 576           HG3      GLU 576  33.000  49.161  34.289
  197    H    VAL 577           H        VAL 577  31.683  47.085  29.501
  198    HA   VAL 577           HA       VAL 577  33.613  45.343  28.437
  199    HB   VAL 577           HB       VAL 577  31.448  47.143  27.361
  200   HG11  VAL 577          HG11      VAL 577  33.655  46.019  25.784
  201   HG12  VAL 577          HG12      VAL 577  32.043  45.613  25.169
  202   HG13  VAL 577          HG13      VAL 577  32.417  47.305  25.476
  203   HG21  VAL 577          HG21      VAL 577  30.765  44.953  28.384
  204   HG22  VAL 577          HG22      VAL 577  30.378  45.110  26.668
  205   HG23  VAL 577          HG23      VAL 577  31.791  44.134  27.168
  206    H    GLU 578           H        GLU 578  35.657  45.699  27.909
  207    HA   GLU 578           HA       GLU 578  36.539  48.493  27.447
  208    HB2  GLU 578           HB2      GLU 578  37.653  47.261  29.286
  209    HB3  GLU 578           HB3      GLU 578  38.172  46.042  28.141
  210    HG2  GLU 578           HG2      GLU 578  40.010  47.633  28.554
  211    HG3  GLU 578           HG3      GLU 578  39.490  47.749  26.890
  212    H    ALA 579           H        ALA 579  36.763  45.196  25.966
  213    HA   ALA 579           HA       ALA 579  37.096  46.264  23.292
  214    HB1  ALA 579           HB1      ALA 579  39.373  44.994  24.854
  215    HB2  ALA 579           HB2      ALA 579  39.420  45.129  23.090
  216    HB3  ALA 579           HB3      ALA 579  39.359  46.615  24.085
  217    H    LEU 580           H        LEU 580  35.665  44.964  22.381
  218    HA   LEU 580           HA       LEU 580  35.963  41.981  22.707
  219    HB2  LEU 580           HB2      LEU 580  33.337  43.163  21.935
  220    HB3  LEU 580           HB3      LEU 580  33.727  41.636  22.727
  221    HG   LEU 580           HG       LEU 580  33.116  44.325  23.872
  222   HD11  LEU 580          HD11      LEU 580  31.996  41.630  24.045
  223   HD12  LEU 580          HD12      LEU 580  32.533  42.038  25.651
  224   HD13  LEU 580          HD13      LEU 580  31.383  43.079  24.870
  225   HD21  LEU 580          HD21      LEU 580  34.979  44.373  25.065
  226   HD22  LEU 580          HD22      LEU 580  34.082  43.391  26.169
  227   HD23  LEU 580          HD23      LEU 580  35.180  42.573  25.022
  228    H    HIS 581           H        HIS 581  36.866  41.057  21.066
  229    HA   HIS 581           HA       HIS 581  37.125  42.691  18.647
  230    HB2  HIS 581           HB2      HIS 581  39.118  41.567  19.933
  231    HB3  HIS 581           HB3      HIS 581  38.582  40.081  19.149
  232    HD2  HIS 581           HD2      HIS 581  39.122  43.772  17.982
  233    HE1  HIS 581           HE1      HIS 581  41.186  41.274  15.239
  234    HE2  HIS 581           HE2      HIS 581  40.797  43.666  15.965
  235    H    SER 582           H        SER 582  37.458  41.587  16.517
  236    HA   SER 582           HA       SER 582  34.962  40.176  15.901
  237    HB2  SER 582           HB2      SER 582  35.388  40.687  13.623
  238    HB3  SER 582           HB3      SER 582  35.743  42.133  14.578
  239    HG   SER 582           HG       SER 582  37.355  40.457  13.171
  240    H    SER 583           H        SER 583  37.998  39.144  16.875
  241    HA   SER 583           HA       SER 583  38.622  36.841  15.330
  242    HB2  SER 583           HB2      SER 583  39.066  37.531  18.233
  243    HB3  SER 583           HB3      SER 583  39.579  35.981  17.561
  244    HG   SER 583           HG       SER 583  40.317  38.537  16.615
  245    H    GLY 584           H        GLY 584  35.859  37.412  17.172
  246    HA2  GLY 584           HA2      GLY 584  33.857  36.379  16.898
  247    HA3  GLY 584           HA3      GLY 584  34.603  35.055  16.031
  248    H    MET 585           H        MET 585  35.974  35.603  19.177
  249    HA   MET 585           HA       MET 585  33.956  33.887  20.571
  250    HB2  MET 585           HB2      MET 585  35.635  32.362  21.454
  251    HB3  MET 585           HB3      MET 585  35.465  32.287  19.712
  252    HG2  MET 585           HG2      MET 585  37.575  33.662  19.508
  253    HG3  MET 585           HG3      MET 585  37.642  33.766  21.269
  254    HE1  MET 585           HE1      MET 585  38.102  31.418  22.935
  255    HE2  MET 585           HE2      MET 585  39.713  31.047  22.271
  256    HE3  MET 585           HE3      MET 585  39.159  32.733  22.370
  257    H    THR 586           H        THR 586  36.748  36.128  21.207
  258    HA   THR 586           HA       THR 586  35.681  36.237  24.022
  259    HB   THR 586           HB       THR 586  37.931  36.593  24.904
  260    HG1  THR 586           HG1      THR 586  39.626  36.107  23.627
  261   HG21  THR 586          HG21      THR 586  37.089  34.402  25.225
  262   HG22  THR 586          HG22      THR 586  37.338  33.973  23.519
  263   HG23  THR 586          HG23      THR 586  38.725  34.196  24.622
  264    H    ALA 587           H        ALA 587  36.556  38.038  25.321
  265    HA   ALA 587           HA       ALA 587  36.221  40.644  24.028
  266    HB1  ALA 587           HB1      ALA 587  34.331  38.943  25.666
  267    HB2  ALA 587           HB2      ALA 587  34.258  40.667  25.922
  268    HB3  ALA 587           HB3      ALA 587  33.962  40.020  24.278
  269    H    VAL 588           H        VAL 588  37.005  42.215  25.489
  270    HA   VAL 588           HA       VAL 588  38.157  41.291  28.095
  271    HB   VAL 588           HB       VAL 588  38.909  43.806  26.646
  272   HG11  VAL 588          HG11      VAL 588  40.924  43.591  28.001
  273   HG12  VAL 588          HG12      VAL 588  39.455  43.785  28.964
  274   HG13  VAL 588          HG13      VAL 588  40.202  42.174  28.826
  275   HG21  VAL 588          HG21      VAL 588  39.506  41.768  25.170
  276   HG22  VAL 588          HG22      VAL 588  40.934  42.600  25.792
  277   HG23  VAL 588          HG23      VAL 588  40.389  41.095  26.553
  278    H    VAL 589           H        VAL 589  37.446  42.333  29.923
  279    HA   VAL 589           HA       VAL 589  35.396  44.477  29.691
  280    HB   VAL 589           HB       VAL 589  33.843  43.178  31.038
  281   HG11  VAL 589          HG11      VAL 589  34.371  41.653  28.481
  282   HG12  VAL 589          HG12      VAL 589  32.853  42.029  29.335
  283   HG13  VAL 589          HG13      VAL 589  33.751  43.311  28.503
  284   HG21  VAL 589          HG21      VAL 589  35.774  40.845  30.622
  285   HG22  VAL 589          HG22      VAL 589  35.072  41.404  32.138
  286   HG23  VAL 589          HG23      VAL 589  34.045  40.615  30.957
  287    H    LYS 590           H        LYS 590  35.733  45.941  31.451
  288    HA   LYS 590           HA       LYS 590  37.550  45.222  33.684
  289    HB2  LYS 590           HB2      LYS 590  38.031  47.289  32.432
  290    HB3  LYS 590           HB3      LYS 590  36.404  47.879  32.742
  291    HG2  LYS 590           HG2      LYS 590  36.826  48.359  34.987
  292    HG3  LYS 590           HG3      LYS 590  38.209  47.242  35.092
  293    HD2  LYS 590           HD2      LYS 590  39.671  48.776  34.157
  294    HD3  LYS 590           HD3      LYS 590  38.410  49.527  33.168
  295    HE2  LYS 590           HE2      LYS 590  38.436  49.845  36.200
  296    HE3  LYS 590           HE3      LYS 590  39.629  50.642  35.222
  297    HZ1  LYS 590           HZ1      LYS 590  37.935  52.178  35.355
  298    HZ2  LYS 590           HZ2      LYS 590  37.598  51.555  33.929
  299    HZ3  LYS 590           HZ3      LYS 590  36.691  51.134  35.222
  300    H    PHE 591           H        PHE 591  36.695  44.343  35.303
  301    HA   PHE 591           HA       PHE 591  33.937  44.211  36.082
  302    HB2  PHE 591           HB2      PHE 591  36.434  43.632  37.709
  303    HB3  PHE 591           HB3      PHE 591  34.800  43.222  38.168
  304    HD1  PHE 591           HD2      PHE 591  33.504  41.501  36.935
  305    HD2  PHE 591           HD1      PHE 591  37.595  42.352  35.920
  306    HE1  PHE 591           HE2      PHE 591  33.737  39.217  35.969
  307    HE2  PHE 591           HE1      PHE 591  37.759  40.150  34.777
  308    HZ   PHE 591           HZ       PHE 591  35.870  38.559  34.852
  309    H    ILE 592           H        ILE 592  32.725  45.699  37.016
  310    HA   ILE 592           HA       ILE 592  33.943  48.270  37.394
  311    HB   ILE 592           HB       ILE 592  31.093  47.846  38.149
  312   HG12  ILE 592          HG12      ILE 592  32.111  47.461  35.354
  313   HG13  ILE 592          HG13      ILE 592  30.888  46.571  36.332
  314   HG21  ILE 592          HG21      ILE 592  32.335  50.169  38.066
  315   HG22  ILE 592          HG22      ILE 592  32.183  50.026  36.327
  316   HG23  ILE 592          HG23      ILE 592  30.719  49.983  37.341
  317   HD11  ILE 592          HD11      ILE 592  30.568  49.081  34.703
  318   HD12  ILE 592          HD12      ILE 592  29.792  47.507  34.519
  319   HD13  ILE 592          HD13      ILE 592  29.337  48.551  35.884
  320    H    ASP 593           H        ASP 593  33.357  45.769  39.585
  321    HA   ASP 593           HA       ASP 593  33.490  47.500  42.038
  322    HB2  ASP 593           HB2      ASP 593  32.922  44.565  41.499
  323    HB3  ASP 593           HB3      ASP 593  33.091  45.165  43.138
  324    H    TYR 594           H        TYR 594  35.602  46.153  39.937
  325    HA   TYR 594           HA       TYR 594  37.639  45.616  42.045
  326    HB2  TYR 594           HB2      TYR 594  37.307  44.002  39.513
  327    HB3  TYR 594           HB3      TYR 594  38.530  43.791  40.737
  328    HD1  TYR 594           HD1      TYR 594  34.743  43.729  40.490
  329    HD2  TYR 594           HD2      TYR 594  38.288  42.063  42.317
  330    HE1  TYR 594           HE1      TYR 594  33.363  42.085  41.655
  331    HE2  TYR 594           HE2      TYR 594  36.872  40.510  43.624
  332    HH   TYR 594           HH       TYR 594  33.337  40.502  43.243
  333    H    GLY 595           H        GLY 595  36.871  47.082  39.008
  334    HA2  GLY 595           HA2      GLY 595  37.960  48.896  38.112
  335    HA3  GLY 595           HA3      GLY 595  39.225  48.641  39.382
  336    H    ASN 596           H        ASN 596  39.131  45.847  37.711
  337    HA   ASN 596           HA       ASN 596  41.120  46.669  35.661
  338    HB2  ASN 596           HB2      ASN 596  42.493  44.665  36.384
  339    HB3  ASN 596           HB3      ASN 596  42.419  46.053  37.425
  340   HD21  ASN 596          HD22      ASN 596  43.009  45.071  39.141
  341   HD22  ASN 596          HD21      ASN 596  42.023  43.930  40.102
  342    H    TYR 597           H        TYR 597  41.540  44.722  34.064
  343    HA   TYR 597           HA       TYR 597  38.910  43.491  33.365
  344    HB2  TYR 597           HB2      TYR 597  39.557  43.958  30.941
  345    HB3  TYR 597           HB3      TYR 597  38.863  45.260  31.864
  346    HD1  TYR 597           HD2      TYR 597  40.236  46.961  32.880
  347    HD2  TYR 597           HD1      TYR 597  41.776  44.375  29.802
  348    HE1  TYR 597           HE2      TYR 597  42.037  48.563  32.471
  349    HE2  TYR 597           HE1      TYR 597  43.609  45.933  29.376
  350    HH   TYR 597           HH       TYR 597  44.609  47.921  30.000
  351    H    GLU 598           H        GLU 598  38.957  41.809  31.943
  352    HA   GLU 598           HA       GLU 598  41.424  40.608  31.060
  353    HB2  GLU 598           HB2      GLU 598  40.759  38.308  32.133
  354    HB3  GLU 598           HB3      GLU 598  41.712  39.435  33.085
  355    HG2  GLU 598           HG2      GLU 598  39.640  40.152  34.223
  356    HG3  GLU 598           HG3      GLU 598  38.702  39.035  33.205
  357    H    GLU 599           H        GLU 599  41.000  38.480  29.876
  358    HA   GLU 599           HA       GLU 599  38.736  38.614  28.161
  359    HB2  GLU 599           HB2      GLU 599  40.681  36.337  28.569
  360    HB3  GLU 599           HB3      GLU 599  39.285  36.278  27.472
  361    HG2  GLU 599           HG2      GLU 599  39.922  38.201  26.285
  362    HG3  GLU 599           HG3      GLU 599  41.330  38.477  27.342
  363    H    VAL 600           H        VAL 600  36.942  37.780  27.995
  364    HA   VAL 600           HA       VAL 600  35.838  35.414  29.435
  365    HB   VAL 600           HB       VAL 600  34.371  38.079  29.079
  366   HG11  VAL 600          HG11      VAL 600  33.438  35.704  30.718
  367   HG12  VAL 600          HG12      VAL 600  32.564  37.154  30.296
  368   HG13  VAL 600          HG13      VAL 600  32.977  35.996  28.997
  369   HG21  VAL 600          HG21      VAL 600  35.993  38.194  31.005
  370   HG22  VAL 600          HG22      VAL 600  34.299  38.231  31.519
  371   HG23  VAL 600          HG23      VAL 600  35.230  36.723  31.661
  372    H    LEU 601           H        LEU 601  34.532  34.110  27.969
  373    HA   LEU 601           HA       LEU 601  34.562  34.571  25.182
  374    HB2  LEU 601           HB2      LEU 601  33.494  32.620  26.947
  375    HB3  LEU 601           HB3      LEU 601  32.086  33.287  26.159
  376    HG   LEU 601           HG       LEU 601  32.998  32.548  23.952
  377   HD11  LEU 601          HD11      LEU 601  35.423  32.681  24.264
  378   HD12  LEU 601          HD12      LEU 601  35.318  31.597  25.680
  379   HD13  LEU 601          HD13      LEU 601  35.036  30.971  24.053
  380   HD21  LEU 601          HD21      LEU 601  32.912  30.127  24.341
  381   HD22  LEU 601          HD22      LEU 601  33.219  30.339  26.067
  382   HD23  LEU 601          HD23      LEU 601  31.695  30.908  25.381
  383    H    LEU 602           H        LEU 602  33.069  35.488  23.684
  384    HA   LEU 602           HA       LEU 602  31.666  37.831  24.524
  385    HB2  LEU 602           HB2      LEU 602  31.202  36.300  21.886
  386    HB3  LEU 602           HB3      LEU 602  30.681  37.903  22.191
  387    HG   LEU 602           HG       LEU 602  33.632  37.370  22.456
  388   HD11  LEU 602          HD11      LEU 602  32.398  37.937  19.752
  389   HD12  LEU 602          HD12      LEU 602  34.095  37.614  20.146
  390   HD13  LEU 602          HD13      LEU 602  32.904  36.306  20.280
  391   HD21  LEU 602          HD21      LEU 602  32.525  39.673  22.837
  392   HD22  LEU 602          HD22      LEU 602  33.933  39.561  21.718
  393   HD23  LEU 602          HD23      LEU 602  32.302  39.757  21.091
  394    H    SER 603           H        SER 603  30.645  34.538  23.947
  395    HA   SER 603           HA       SER 603  27.824  34.854  24.341
  396    HB2  SER 603           HB2      SER 603  29.297  32.163  24.600
  397    HB3  SER 603           HB3      SER 603  27.664  32.480  24.050
  398    HG   SER 603           HG       SER 603  28.469  33.243  22.207
  399    H    ASN 604           H        ASN 604  30.103  35.196  26.592
  400    HA   ASN 604           HA       ASN 604  28.715  33.894  28.937
  401    HB2  ASN 604           HB2      ASN 604  31.622  34.421  28.293
  402    HB3  ASN 604           HB3      ASN 604  31.023  34.036  29.903
  403   HD21  ASN 604          HD22      ASN 604  32.773  32.232  29.356
  404   HD22  ASN 604          HD21      ASN 604  31.950  30.752  29.023
  405    H    ILE 605           H        ILE 605  29.024  36.760  27.394
  406    HA   ILE 605           HA       ILE 605  28.777  38.282  29.954
  407    HB   ILE 605           HB       ILE 605  29.382  39.338  27.213
  408   HG12  ILE 605          HG12      ILE 605  31.510  39.205  29.415
  409   HG13  ILE 605          HG13      ILE 605  31.324  37.864  28.302
  410   HG21  ILE 605          HG21      ILE 605  29.448  40.554  29.986
  411   HG22  ILE 605          HG22      ILE 605  30.185  41.360  28.572
  412   HG23  ILE 605          HG23      ILE 605  28.456  41.050  28.577
  413   HD11  ILE 605          HD11      ILE 605  33.097  39.401  27.538
  414   HD12  ILE 605          HD12      ILE 605  31.756  39.283  26.383
  415   HD13  ILE 605          HD13      ILE 605  31.968  40.723  27.425
  416    H    LYS 606           H        LYS 606  26.745  38.493  30.396
  417    HA   LYS 606           HA       LYS 606  24.617  38.879  28.374
  418    HB2  LYS 606           HB2      LYS 606  24.756  38.425  31.384
  419    HB3  LYS 606           HB3      LYS 606  23.216  38.772  30.616
  420    HG2  LYS 606           HG2      LYS 606  24.996  36.410  29.846
  421    HG3  LYS 606           HG3      LYS 606  23.620  36.366  30.956
  422    HD2  LYS 606           HD2      LYS 606  22.055  36.829  29.228
  423    HD3  LYS 606           HD3      LYS 606  23.307  37.419  28.105
  424    HE2  LYS 606           HE2      LYS 606  24.131  35.404  27.575
  425    HE3  LYS 606           HE3      LYS 606  23.411  34.552  28.950
  426    HZ1  LYS 606           HZ1      LYS 606  22.210  34.060  26.943
  427    HZ2  LYS 606           HZ2      LYS 606  21.249  34.904  27.971
  428    HZ3  LYS 606           HZ3      LYS 606  21.864  35.629  26.670
  429    HA   PRO 607           HA       PRO 607  24.076  43.230  29.056
  430    HB2  PRO 607           HB2      PRO 607  21.289  43.551  29.249
  431    HB3  PRO 607           HB3      PRO 607  22.181  43.312  27.743
  432    HG2  PRO 607           HG2      PRO 607  20.712  41.203  29.361
  433    HG3  PRO 607           HG3      PRO 607  20.727  41.490  27.614
  434    HD2  PRO 607           HD2      PRO 607  22.277  39.581  28.890
  435    HD3  PRO 607           HD3      PRO 607  22.852  40.385  27.432
  436    H    ILE 608           H        ILE 608  23.195  44.978  30.463
  437    HA   ILE 608           HA       ILE 608  23.121  44.255  33.372
  438    HB   ILE 608           HB       ILE 608  24.322  46.418  31.759
  439   HG12  ILE 608          HG12      ILE 608  25.316  44.424  33.140
  440   HG13  ILE 608          HG13      ILE 608  26.137  46.001  32.945
  441   HG21  ILE 608          HG21      ILE 608  23.091  47.156  34.410
  442   HG22  ILE 608          HG22      ILE 608  24.476  47.979  33.670
  443   HG23  ILE 608          HG23      ILE 608  22.943  47.935  32.798
  444   HD11  ILE 608          HD11      ILE 608  24.644  45.099  35.409
  445   HD12  ILE 608          HD12      ILE 608  26.402  44.993  35.123
  446   HD13  ILE 608          HD13      ILE 608  25.641  46.588  35.213
  447    H    LEU 609           H        LEU 609  21.252  46.035  30.865
  448    HA   LEU 609           HA       LEU 609  18.891  45.868  32.612
  449    HB2  LEU 609           HB2      LEU 609  20.393  47.951  33.242
  450    HB3  LEU 609           HB3      LEU 609  19.791  48.603  31.739
  451    HG   LEU 609           HG       LEU 609  17.376  48.277  32.785
  452   HD11  LEU 609          HD11      LEU 609  18.892  48.139  35.408
  453   HD12  LEU 609          HD12      LEU 609  17.172  48.250  35.170
  454   HD13  LEU 609          HD13      LEU 609  17.993  46.787  34.618
  455   HD21  LEU 609          HD21      LEU 609  18.458  50.443  32.512
  456   HD22  LEU 609          HD22      LEU 609  17.570  50.358  34.053
  457   HD23  LEU 609          HD23      LEU 609  19.345  50.243  34.036
  458    H    GLU 610           H        GLU 610  20.011  45.234  29.703
  459    HA   GLU 610           HA       GLU 610  17.531  46.113  28.389
  460    HB2  GLU 610           HB2      GLU 610  18.771  46.793  26.410
  461    HB3  GLU 610           HB3      GLU 610  19.189  47.730  27.853
  462    HG2  GLU 610           HG2      GLU 610  20.972  45.510  26.806
  463    HG3  GLU 610           HG3      GLU 610  21.069  47.164  26.281
  464    H1   TYR 611           H1       TYR 611  42.692  45.992  46.468
  465    H2   TYR 611           H2       TYR 611  43.405  46.688  45.172
  466    H3   TYR 611           H3       TYR 611  43.846  47.139  46.689
  467    HA   TYR 611           HA       TYR 611  45.540  45.836  46.327
  468    HB2  TYR 611           HB2      TYR 611  43.391  43.812  47.082
  469    HB3  TYR 611           HB3      TYR 611  45.103  43.485  47.132
  470    HD1  TYR 611           HD2      TYR 611  46.571  45.290  48.505
  471    HD2  TYR 611           HD1      TYR 611  42.350  44.590  49.024
  472    HE1  TYR 611           HE2      TYR 611  46.653  46.411  50.728
  473    HE2  TYR 611           HE1      TYR 611  42.475  45.592  51.313
  474    HH   TYR 611           HH       TYR 611  43.838  46.631  52.844
  475    H    SER 612           H        SER 612  46.598  44.143  45.147
  476    HA   SER 612           HA       SER 612  47.265  43.127  43.195
  477    HB2  SER 612           HB2      SER 612  44.601  41.688  43.440
  478    HB3  SER 612           HB3      SER 612  46.139  41.077  42.813
  479    HG   SER 612           HG       SER 612  46.902  41.104  44.874
  480    HA   PRO 613           HA       PRO 613  44.161  45.474  40.612
  481    HB2  PRO 613           HB2      PRO 613  45.450  47.672  39.574
  482    HB3  PRO 613           HB3      PRO 613  44.694  47.649  41.183
  483    HG2  PRO 613           HG2      PRO 613  47.590  47.331  40.464
  484    HG3  PRO 613           HG3      PRO 613  46.851  48.229  41.802
  485    HD2  PRO 613           HD2      PRO 613  47.917  45.668  42.085
  486    HD3  PRO 613           HD3      PRO 613  46.596  46.306  43.113
  487    H    SER 614           H        SER 614  47.339  44.251  39.549
  488    HA   SER 614           HA       SER 614  47.056  45.112  36.825
  489    HB2  SER 614           HB2      SER 614  48.621  42.789  37.985
  490    HB3  SER 614           HB3      SER 614  48.931  43.525  36.399
  491    HG   SER 614           HG       SER 614  50.252  44.566  37.814
  492    H    SER 615           H        SER 615  45.266  42.771  38.365
  493    HA   SER 615           HA       SER 615  43.234  42.139  37.278
  494    HB2  SER 615           HB2      SER 615  44.834  41.104  34.902
  495    HB3  SER 615           HB3      SER 615  43.124  40.814  35.279
  496    HG   SER 615           HG       SER 615  42.873  42.539  34.306
  497    HA   PRO 616           HA       PRO 616  44.756  37.731  38.433
  498    HB2  PRO 616           HB2      PRO 616  47.543  38.510  39.192
  499    HB3  PRO 616           HB3      PRO 616  46.906  36.924  38.617
  500    HG2  PRO 616           HG2      PRO 616  48.291  38.459  36.916
  501    HG3  PRO 616           HG3      PRO 616  46.756  37.740  36.364
  502    HD2  PRO 616           HD2      PRO 616  47.116  40.592  37.347
  503    HD3  PRO 616           HD3      PRO 616  46.249  39.990  35.914
  504   HC11  DA2 617          HC11      DA2 617  36.411  40.229  38.375
  505   HC12  DA2 617          HC12      DA2 617  37.422  40.899  39.692
  506   HC13  DA2 617          HC13      DA2 617  38.033  39.568  38.666
  507   HC21  DA2 617          HC21      DA2 617  35.022  37.704  40.303
  508   HC22  DA2 617          HC22      DA2 617  34.792  38.968  39.110
  509   HC23  DA2 617          HC23      DA2 617  34.677  39.347  40.843
  510    H2   DA2 617           H        DA2 617  43.561  37.875  40.254
  511    HA   DA2 617           HA       DA2 617  43.744  39.781  42.302
  512   HCB1  DA2 617          HCB1      DA2 617  42.084  38.324  43.433
  513   HCB2  DA2 617          HCB2      DA2 617  42.477  37.012  42.314
  514   HCG1  DA2 617          HCG1      DA2 617  41.297  39.716  41.520
  515   HCG2  DA2 617          HCG2      DA2 617  41.536  38.348  40.432
  516   HCD1  DA2 617          HCD1      DA2 617  39.920  37.009  41.630
  517   HCD2  DA2 617          HCD2      DA2 617  39.666  38.304  42.825
  518    HNE  DA2 617           HNE      DA2 617  39.215  39.343  40.204
  519   HNH2  DA2 617          HNH2      DA2 617  37.716  36.929  42.343
  520   HNH1  DA2 617          HNH1      DA2 617  36.102  37.465  42.006
  521    H    TYR 618           H        TYR 618  43.690  38.724  44.713
  522    HA   TYR 618           HA       TYR 618  46.264  38.662  45.717
  523    HB2  TYR 618           HB2      TYR 618  45.169  37.818  47.853
  524    HB3  TYR 618           HB3      TYR 618  44.578  39.282  47.170
  525    HD1  TYR 618           HD2      TYR 618  43.847  35.683  47.793
  526    HD2  TYR 618           HD1      TYR 618  42.265  39.380  46.254
  527    HE1  TYR 618           HE2      TYR 618  41.534  34.832  48.135
  528    HE2  TYR 618           HE1      TYR 618  39.939  38.518  46.609
  529    HH   TYR 618           HH       TYR 618  38.720  36.768  47.355
  530    H    THR 619           H        THR 619  47.514  37.186  47.048
  531    HA   THR 619           HA       THR 619  48.390  34.949  45.633
  532    HB   THR 619           HB       THR 619  49.430  34.276  47.938
  533    HG1  THR 619           HG1      THR 619  48.203  35.565  49.318
  534   HG21  THR 619          HG21      THR 619  51.222  35.774  47.627
  535   HG22  THR 619          HG22      THR 619  50.520  35.643  46.012
  536   HG23  THR 619          HG23      THR 619  50.148  37.060  47.036
  537    HA   PRO 620           HA       PRO 620  46.131  31.307  46.776
  538    HB2  PRO 620           HB2      PRO 620  48.783  30.025  47.350
  539    HB3  PRO 620           HB3      PRO 620  47.429  29.437  46.395
  540    HG2  PRO 620           HG2      PRO 620  49.583  30.535  45.132
  541    HG3  PRO 620           HG3      PRO 620  47.942  30.950  44.572
  542    HD2  PRO 620           HD2      PRO 620  49.701  32.613  46.396
  543    HD3  PRO 620           HD3      PRO 620  48.753  33.074  44.955
  544    H    GLN 621           H        GLN 621  45.853  29.691  48.377
  545    HA   GLN 621           HA       GLN 621  46.742  29.989  51.129
  546    HB2  GLN 621           HB2      GLN 621  44.717  30.739  52.057
  547    HB3  GLN 621           HB3      GLN 621  45.060  31.846  50.720
  548    HG2  GLN 621           HG2      GLN 621  43.446  30.698  49.276
  549    HG3  GLN 621           HG3      GLN 621  43.069  29.543  50.553
  550   HE21  GLN 621          HE22      GLN 621  42.391  32.796  49.458
  551   HE22  GLN 621          HE21      GLN 621  41.226  33.133  50.744
  552    H    SER 622           H        SER 622  45.198  28.037  48.676
  553    HA   SER 622           HA       SER 622  44.035  26.178  50.532
  554    HB2  SER 622           HB2      SER 622  44.758  25.872  47.580
  555    HB3  SER 622           HB3      SER 622  43.776  24.694  48.459
  556    HG   SER 622           HG       SER 622  43.112  27.035  47.419
  557    HA   PRO 623           HA       PRO 623  48.317  23.715  49.804
  558    HB2  PRO 623           HB2      PRO 623  49.715  26.413  50.136
  559    HB3  PRO 623           HB3      PRO 623  50.429  24.932  49.483
  560    HG2  PRO 623           HG2      PRO 623  49.526  26.803  47.831
  561    HG3  PRO 623           HG3      PRO 623  49.003  25.119  47.473
  562    HD2  PRO 623           HD2      PRO 623  47.464  27.320  48.766
  563    HD3  PRO 623           HD3      PRO 623  46.890  26.051  47.638
  Start of MODEL    5
    1    H1   MET 553           H1       MET 553  18.462  38.876  20.692
    2    H2   MET 553           H2       MET 553  19.647  38.217  21.661
    3    H3   MET 553           H3       MET 553  19.841  38.298  20.041
    4    HA   MET 553           HA       MET 553  19.889  40.659  20.020
    5    HB2  MET 553           HB2      MET 553  18.424  41.007  21.971
    6    HB3  MET 553           HB3      MET 553  19.693  40.448  23.043
    7    HG2  MET 553           HG2      MET 553  19.616  42.946  22.874
    8    HG3  MET 553           HG3      MET 553  21.148  42.246  22.447
    9    HE1  MET 553           HE1      MET 553  18.957  45.124  21.619
   10    HE2  MET 553           HE2      MET 553  20.690  45.066  22.065
   11    HE3  MET 553           HE3      MET 553  20.188  45.747  20.515
   12    H    LYS 554           H        LYS 554  21.871  40.713  19.222
   13    HA   LYS 554           HA       LYS 554  24.222  40.236  20.906
   14    HB2  LYS 554           HB2      LYS 554  23.898  38.716  18.269
   15    HB3  LYS 554           HB3      LYS 554  25.395  39.037  19.076
   16    HG2  LYS 554           HG2      LYS 554  24.571  37.802  21.134
   17    HG3  LYS 554           HG3      LYS 554  23.133  37.331  20.196
   18    HD2  LYS 554           HD2      LYS 554  24.586  36.131  18.595
   19    HD3  LYS 554           HD3      LYS 554  26.021  36.766  19.417
   20    HE2  LYS 554           HE2      LYS 554  25.617  34.460  19.908
   21    HE3  LYS 554           HE3      LYS 554  25.612  35.447  21.372
   22    HZ1  LYS 554           HZ1      LYS 554  23.827  33.680  21.114
   23    HZ2  LYS 554           HZ2      LYS 554  23.240  35.129  21.518
   24    HZ3  LYS 554           HZ3      LYS 554  23.122  34.630  19.998
   25    H    MET 555           H        MET 555  25.037  42.117  20.790
   26    HA   MET 555           HA       MET 555  26.352  43.094  18.518
   27    HB2  MET 555           HB2      MET 555  25.104  45.264  18.155
   28    HB3  MET 555           HB3      MET 555  24.201  43.877  17.626
   29    HG2  MET 555           HG2      MET 555  22.972  43.802  19.786
   30    HG3  MET 555           HG3      MET 555  23.729  45.296  20.293
   31    HE1  MET 555           HE1      MET 555  22.310  47.720  17.392
   32    HE2  MET 555           HE2      MET 555  22.915  47.883  19.047
   33    HE3  MET 555           HE3      MET 555  23.879  47.022  17.817
   34    H    TRP 556           H        TRP 556  27.617  42.691  20.700
   35    HA   TRP 556           HA       TRP 556  27.421  44.714  22.712
   36    HB2  TRP 556           HB2      TRP 556  29.217  42.381  22.121
   37    HB3  TRP 556           HB3      TRP 556  29.892  43.641  23.129
   38    HD1  TRP 556           HD1      TRP 556  28.948  40.551  23.891
   39    HE1  TRP 556           HE1      TRP 556  27.703  40.274  26.109
   40    HE3  TRP 556           HE3      TRP 556  27.481  45.408  24.671
   41    HZ2  TRP 556           HZ2      TRP 556  26.085  41.887  27.896
   42    HZ3  TRP 556           HZ3      TRP 556  25.878  45.926  26.483
   43    HH2  TRP 556           HH2      TRP 556  25.098  44.193  28.013
   44    H    LYS 557           H        LYS 557  29.107  46.336  23.276
   45    HA   LYS 557           HA       LYS 557  30.967  47.269  21.196
   46    HB2  LYS 557           HB2      LYS 557  28.250  48.497  21.762
   47    HB3  LYS 557           HB3      LYS 557  29.551  49.488  21.121
   48    HG2  LYS 557           HG2      LYS 557  29.436  47.938  18.993
   49    HG3  LYS 557           HG3      LYS 557  27.983  47.236  19.726
   50    HD2  LYS 557           HD2      LYS 557  28.341  50.167  19.203
   51    HD3  LYS 557           HD3      LYS 557  27.596  49.057  18.054
   52    HE2  LYS 557           HE2      LYS 557  25.647  48.784  19.342
   53    HE3  LYS 557           HE3      LYS 557  26.548  48.968  20.865
   54    HZ1  LYS 557           HZ1      LYS 557  25.359  50.925  20.685
   55    HZ2  LYS 557           HZ2      LYS 557  26.822  51.289  20.209
   56    HZ3  LYS 557           HZ3      LYS 557  25.647  51.102  19.061
   57    HA   PRO 558           HA       PRO 558  33.104  48.681  24.670
   58    HB2  PRO 558           HB2      PRO 558  34.678  50.677  23.796
   59    HB3  PRO 558           HB3      PRO 558  34.625  49.065  23.005
   60    HG2  PRO 558           HG2      PRO 558  32.960  51.525  22.222
   61    HG3  PRO 558           HG3      PRO 558  34.222  50.720  21.217
   62    HD2  PRO 558           HD2      PRO 558  31.602  50.149  21.105
   63    HD3  PRO 558           HD3      PRO 558  32.822  48.847  20.961
   64    H    GLY 559           H        GLY 559  33.413  50.130  26.512
   65    HA2  GLY 559           HA2      GLY 559  32.854  51.774  27.950
   66    HA3  GLY 559           HA3      GLY 559  32.270  52.742  26.623
   67    H    ASP 560           H        ASP 560  31.188  49.548  27.991
   68    HA   ASP 560           HA       ASP 560  28.551  50.754  28.645
   69    HB2  ASP 560           HB2      ASP 560  28.929  49.004  26.439
   70    HB3  ASP 560           HB3      ASP 560  28.059  48.086  27.642
   71    H    GLU 561           H        GLU 561  28.735  50.651  30.898
   72    HA   GLU 561           HA       GLU 561  29.617  48.375  32.293
   73    HB2  GLU 561           HB2      GLU 561  28.237  49.146  34.241
   74    HB3  GLU 561           HB3      GLU 561  29.501  50.209  33.680
   75    HG2  GLU 561           HG2      GLU 561  26.712  50.681  32.639
   76    HG3  GLU 561           HG3      GLU 561  27.124  51.145  34.292
   77    H    CYS 562           H        CYS 562  28.994  46.448  32.513
   78    HA   CYS 562           HA       CYS 562  26.263  45.391  32.154
   79    HB2  CYS 562           HB2      CYS 562  28.650  44.788  30.345
   80    HB3  CYS 562           HB3      CYS 562  27.102  43.918  30.306
   81    HG   CYS 562           HG       CYS 562  27.618  47.130  29.820
   82    H    PHE 563           H        PHE 563  26.503  42.781  32.403
   83    HA   PHE 563           HA       PHE 563  28.124  42.391  34.901
   84    HB2  PHE 563           HB2      PHE 563  25.438  41.488  33.889
   85    HB3  PHE 563           HB3      PHE 563  26.389  40.336  34.794
   86    HD1  PHE 563           HD1      PHE 563  27.432  41.295  37.120
   87    HD2  PHE 563           HD2      PHE 563  23.893  42.703  35.098
   88    HE1  PHE 563           HE1      PHE 563  26.596  42.336  39.240
   89    HE2  PHE 563           HE2      PHE 563  22.943  43.422  37.279
   90    HZ   PHE 563           HZ       PHE 563  24.339  43.229  39.356
   91    H    ALA 564           H        ALA 564  29.983  41.161  34.382
   92    HA   ALA 564           HA       ALA 564  29.827  39.343  32.025
   93    HB1  ALA 564           HB1      ALA 564  32.174  40.729  33.400
   94    HB2  ALA 564           HB2      ALA 564  32.344  39.582  32.074
   95    HB3  ALA 564           HB3      ALA 564  31.485  41.119  31.810
   96    H    LEU 565           H        LEU 565  30.091  37.289  32.147
   97    HA   LEU 565           HA       LEU 565  29.926  35.909  34.674
   98    HB2  LEU 565           HB2      LEU 565  28.810  35.240  32.510
   99    HB3  LEU 565           HB3      LEU 565  30.456  34.694  31.989
  100    HG   LEU 565           HG       LEU 565  30.554  32.978  33.530
  101   HD11  LEU 565          HD11      LEU 565  27.749  33.666  34.529
  102   HD12  LEU 565          HD12      LEU 565  28.777  32.314  35.029
  103   HD13  LEU 565          HD13      LEU 565  29.259  33.955  35.443
  104   HD21  LEU 565          HD21      LEU 565  28.880  31.551  32.532
  105   HD22  LEU 565          HD22      LEU 565  27.891  32.966  32.058
  106   HD23  LEU 565          HD23      LEU 565  29.479  32.674  31.332
  107    H    TYR 566           H        TYR 566  31.641  35.806  35.932
  108    HA   TYR 566           HA       TYR 566  34.307  35.335  35.142
  109    HB2  TYR 566           HB2      TYR 566  33.134  36.099  37.372
  110    HB3  TYR 566           HB3      TYR 566  33.192  34.365  37.781
  111    HD1  TYR 566           HD1      TYR 566  35.563  36.783  36.132
  112    HD2  TYR 566           HD2      TYR 566  34.873  34.005  39.356
  113    HE1  TYR 566           HE1      TYR 566  37.912  37.085  36.901
  114    HE2  TYR 566           HE2      TYR 566  37.215  34.318  40.117
  115    HH   TYR 566           HH       TYR 566  39.464  36.430  38.516
  116    H    TRP 567           H        TRP 567  35.345  33.394  36.401
  117    HA   TRP 567           HA       TRP 567  34.567  30.980  34.780
  118    HB2  TRP 567           HB2      TRP 567  37.001  30.589  34.514
  119    HB3  TRP 567           HB3      TRP 567  36.477  32.106  33.790
  120    HD1  TRP 567           HD1      TRP 567  37.395  34.318  34.934
  121    HE1  TRP 567           HE1      TRP 567  39.346  34.826  36.592
  122    HE3  TRP 567           HE3      TRP 567  38.438  29.582  36.534
  123    HZ2  TRP 567           HZ2      TRP 567  41.248  33.366  38.130
  124    HZ3  TRP 567           HZ3      TRP 567  40.366  29.151  38.001
  125    HH2  TRP 567           HH2      TRP 567  41.775  31.004  38.822
  126    H    GLU 568           H        GLU 568  36.476  31.947  37.633
  127    HA   GLU 568           HA       GLU 568  37.045  29.531  38.877
  128    HB2  GLU 568           HB2      GLU 568  38.018  31.391  39.866
  129    HB3  GLU 568           HB3      GLU 568  36.600  32.390  39.553
  130    HG2  GLU 568           HG2      GLU 568  35.504  31.518  41.579
  131    HG3  GLU 568           HG3      GLU 568  36.840  30.380  41.806
  132    H    ASP 569           H        ASP 569  34.068  31.357  38.918
  133    HA   ASP 569           HA       ASP 569  32.743  29.280  40.553
  134    HB2  ASP 569           HB2      ASP 569  31.493  31.215  41.738
  135    HB3  ASP 569           HB3      ASP 569  33.183  30.999  42.135
  136    H    ASN 570           H        ASN 570  32.732  31.043  37.754
  137    HA   ASN 570           HA       ASN 570  31.191  31.503  36.125
  138    HB2  ASN 570           HB2      ASN 570  31.342  29.019  36.414
  139    HB3  ASN 570           HB3      ASN 570  29.796  29.041  37.256
  140   HD21  ASN 570          HD22      ASN 570  27.831  29.658  35.953
  141   HD22  ASN 570          HD21      ASN 570  27.986  29.515  34.208
  142    H    LYS 571           H        LYS 571  30.888  33.259  38.082
  143    HA   LYS 571           HA       LYS 571  27.940  33.746  38.285
  144    HB2  LYS 571           HB2      LYS 571  30.121  34.086  40.340
  145    HB3  LYS 571           HB3      LYS 571  29.101  35.466  40.124
  146    HG2  LYS 571           HG2      LYS 571  27.912  32.701  40.611
  147    HG3  LYS 571           HG3      LYS 571  28.348  33.864  41.870
  148    HD2  LYS 571           HD2      LYS 571  26.893  35.568  40.800
  149    HD3  LYS 571           HD3      LYS 571  26.357  34.420  39.597
  150    HE2  LYS 571           HE2      LYS 571  25.399  32.945  41.361
  151    HE3  LYS 571           HE3      LYS 571  26.171  33.924  42.610
  152    HZ1  LYS 571           HZ1      LYS 571  24.135  34.983  40.804
  153    HZ2  LYS 571           HZ2      LYS 571  23.887  34.520  42.365
  154    HZ3  LYS 571           HZ3      LYS 571  24.897  35.757  42.036
  155    H    PHE 572           H        PHE 572  27.140  35.663  37.584
  156    HA   PHE 572           HA       PHE 572  28.944  37.335  36.019
  157    HB2  PHE 572           HB2      PHE 572  26.137  38.075  36.807
  158    HB3  PHE 572           HB3      PHE 572  27.213  38.737  35.569
  159    HD1  PHE 572           HD1      PHE 572  25.354  35.585  36.522
  160    HD2  PHE 572           HD2      PHE 572  27.366  37.749  33.375
  161    HE1  PHE 572           HE1      PHE 572  24.434  34.023  34.826
  162    HE2  PHE 572           HE2      PHE 572  26.367  36.180  31.702
  163    HZ   PHE 572           HZ       PHE 572  24.735  34.480  32.426
  164    H    TYR 573           H        TYR 573  29.954  39.187  36.468
  165    HA   TYR 573           HA       TYR 573  29.350  40.579  39.003
  166    HB2  TYR 573           HB2      TYR 573  32.184  40.043  38.001
  167    HB3  TYR 573           HB3      TYR 573  31.762  41.064  39.319
  168    HD1  TYR 573           HD2      TYR 573  31.750  37.539  38.143
  169    HD2  TYR 573           HD1      TYR 573  31.313  40.095  41.545
  170    HE1  TYR 573           HE2      TYR 573  31.899  35.549  39.624
  171    HE2  TYR 573           HE1      TYR 573  31.187  38.073  43.042
  172    HH   TYR 573           HH       TYR 573  31.816  34.852  41.969
  173    H    ARG 574           H        ARG 574  29.493  42.759  38.898
  174    HA   ARG 574           HA       ARG 574  28.892  43.957  36.480
  175    HB2  ARG 574           HB2      ARG 574  29.120  46.123  37.494
  176    HB3  ARG 574           HB3      ARG 574  28.104  44.961  38.398
  177    HG2  ARG 574           HG2      ARG 574  29.973  44.887  40.101
  178    HG3  ARG 574           HG3      ARG 574  30.852  46.058  39.124
  179    HD2  ARG 574           HD2      ARG 574  29.113  47.757  39.379
  180    HD3  ARG 574           HD3      ARG 574  28.140  46.712  40.375
  181    HE   ARG 574           HE       ARG 574  30.526  46.507  41.657
  182   HH11  ARG 574          HH11      ARG 574  29.163  49.492  40.447
  183   HH12  ARG 574          HH12      ARG 574  29.465  50.328  41.950
  184   HH21  ARG 574          HH21      ARG 574  30.760  47.732  43.634
  185   HH22  ARG 574          HH22      ARG 574  30.232  49.391  43.664
  186    H    ALA 575           H        ALA 575  30.111  44.576  34.737
  187    HA   ALA 575           HA       ALA 575  32.821  45.604  35.240
  188    HB1  ALA 575           HB1      ALA 575  32.078  43.851  32.861
  189    HB2  ALA 575           HB2      ALA 575  33.704  44.339  33.413
  190    HB3  ALA 575           HB3      ALA 575  32.741  43.140  34.324
  191    H    GLU 576           H        GLU 576  33.338  47.464  34.134
  192    HA   GLU 576           HA       GLU 576  31.527  48.680  32.136
  193    HB2  GLU 576           HB2      GLU 576  33.811  49.622  33.799
  194    HB3  GLU 576           HB3      GLU 576  33.736  50.254  32.128
  195    HG2  GLU 576           HG2      GLU 576  31.366  50.941  32.552
  196    HG3  GLU 576           HG3      GLU 576  31.525  50.251  34.190
  197    H    VAL 577           H        VAL 577  31.491  47.591  30.345
  198    HA   VAL 577           HA       VAL 577  33.410  46.066  29.068
  199    HB   VAL 577           HB       VAL 577  31.022  47.707  28.175
  200   HG11  VAL 577          HG11      VAL 577  33.044  46.470  26.379
  201   HG12  VAL 577          HG12      VAL 577  31.312  46.370  25.965
  202   HG13  VAL 577          HG13      VAL 577  32.042  47.953  26.238
  203   HG21  VAL 577          HG21      VAL 577  30.735  45.538  29.399
  204   HG22  VAL 577          HG22      VAL 577  30.072  45.628  27.740
  205   HG23  VAL 577          HG23      VAL 577  31.597  44.735  28.053
  206    H    GLU 578           H        GLU 578  35.216  46.353  27.948
  207    HA   GLU 578           HA       GLU 578  36.232  49.138  27.747
  208    HB2  GLU 578           HB2      GLU 578  37.332  47.396  29.204
  209    HB3  GLU 578           HB3      GLU 578  37.576  46.419  27.741
  210    HG2  GLU 578           HG2      GLU 578  39.614  47.547  28.481
  211    HG3  GLU 578           HG3      GLU 578  39.116  47.917  26.836
  212    H    ALA 579           H        ALA 579  36.041  46.036  25.963
  213    HA   ALA 579           HA       ALA 579  36.160  47.305  23.347
  214    HB1  ALA 579           HB1      ALA 579  38.414  46.110  22.830
  215    HB2  ALA 579           HB2      ALA 579  38.456  47.592  23.827
  216    HB3  ALA 579           HB3      ALA 579  38.584  45.954  24.577
  217    H    LEU 580           H        LEU 580  34.548  46.232  22.654
  218    HA   LEU 580           HA       LEU 580  34.741  43.281  22.535
  219    HB2  LEU 580           HB2      LEU 580  32.016  44.539  22.508
  220    HB3  LEU 580           HB3      LEU 580  32.570  42.918  22.901
  221    HG   LEU 580           HG       LEU 580  32.654  45.473  24.427
  222   HD11  LEU 580          HD11      LEU 580  31.207  42.835  24.717
  223   HD12  LEU 580          HD12      LEU 580  31.426  43.759  26.189
  224   HD13  LEU 580          HD13      LEU 580  30.608  44.515  24.838
  225   HD21  LEU 580          HD21      LEU 580  34.480  45.016  25.540
  226   HD22  LEU 580          HD22      LEU 580  33.643  43.726  26.363
  227   HD23  LEU 580          HD23      LEU 580  34.598  43.386  24.884
  228    H    HIS 581           H        HIS 581  36.007  43.572  20.989
  229    HA   HIS 581           HA       HIS 581  35.581  44.778  18.427
  230    HB2  HIS 581           HB2      HIS 581  37.450  42.571  19.416
  231    HB3  HIS 581           HB3      HIS 581  37.480  43.256  17.831
  232    HD2  HIS 581           HD2      HIS 581  36.931  46.100  20.318
  233    HE1  HIS 581           HE1      HIS 581  41.088  46.042  19.523
  234    HE2  HIS 581           HE2      HIS 581  39.267  47.294  20.620
  235    H    SER 582           H        SER 582  35.473  43.727  16.424
  236    HA   SER 582           HA       SER 582  33.411  41.628  16.486
  237    HB2  SER 582           HB2      SER 582  34.488  43.260  14.179
  238    HB3  SER 582           HB3      SER 582  33.150  42.067  14.123
  239    HG   SER 582           HG       SER 582  33.177  44.590  14.831
  240    H    SER 583           H        SER 583  36.830  41.898  15.944
  241    HA   SER 583           HA       SER 583  37.400  39.859  14.133
  242    HB2  SER 583           HB2      SER 583  39.686  40.172  15.207
  243    HB3  SER 583           HB3      SER 583  38.847  41.629  14.608
  244    HG   SER 583           HG       SER 583  38.902  40.927  17.278
  245    H    GLY 584           H        GLY 584  35.751  38.999  16.808
  246    HA2  GLY 584           HA2      GLY 584  36.521  36.283  16.846
  247    HA3  GLY 584           HA3      GLY 584  37.391  37.100  18.161
  248    H    MET 585           H        MET 585  36.230  35.340  19.062
  249    HA   MET 585           HA       MET 585  33.380  35.552  19.726
  250    HB2  MET 585           HB2      MET 585  33.608  33.324  20.480
  251    HB3  MET 585           HB3      MET 585  34.372  33.485  18.904
  252    HG2  MET 585           HG2      MET 585  35.809  33.319  21.563
  253    HG3  MET 585           HG3      MET 585  35.558  32.016  20.400
  254    HE1  MET 585           HE1      MET 585  38.264  33.072  21.848
  255    HE2  MET 585           HE2      MET 585  39.399  33.904  20.769
  256    HE3  MET 585           HE3      MET 585  38.062  34.800  21.518
  257    H    THR 586           H        THR 586  36.289  36.525  21.408
  258    HA   THR 586           HA       THR 586  34.655  36.752  23.895
  259    HB   THR 586           HB       THR 586  36.854  37.127  25.113
  260    HG1  THR 586           HG1      THR 586  38.523  36.076  23.955
  261   HG21  THR 586          HG21      THR 586  37.533  34.709  25.001
  262   HG22  THR 586          HG22      THR 586  35.792  34.817  25.138
  263   HG23  THR 586          HG23      THR 586  36.529  34.533  23.548
  264    H    ALA 587           H        ALA 587  35.535  38.711  25.224
  265    HA   ALA 587           HA       ALA 587  35.598  41.295  23.800
  266    HB1  ALA 587           HB1      ALA 587  33.220  39.995  25.056
  267    HB2  ALA 587           HB2      ALA 587  33.641  41.497  25.832
  268    HB3  ALA 587           HB3      ALA 587  33.330  41.512  24.086
  269    H    VAL 588           H        VAL 588  36.552  42.827  25.160
  270    HA   VAL 588           HA       VAL 588  37.775  41.858  27.677
  271    HB   VAL 588           HB       VAL 588  38.213  44.497  26.217
  272   HG11  VAL 588          HG11      VAL 588  40.509  44.285  27.196
  273   HG12  VAL 588          HG12      VAL 588  39.201  44.619  28.352
  274   HG13  VAL 588          HG13      VAL 588  39.893  42.977  28.232
  275   HG21  VAL 588          HG21      VAL 588  40.244  43.280  25.199
  276   HG22  VAL 588          HG22      VAL 588  39.442  41.779  25.763
  277   HG23  VAL 588          HG23      VAL 588  38.646  42.870  24.583
  278    H    VAL 589           H        VAL 589  37.135  42.657  29.690
  279    HA   VAL 589           HA       VAL 589  35.369  45.030  29.781
  280    HB   VAL 589           HB       VAL 589  33.822  43.657  31.281
  281   HG11  VAL 589          HG11      VAL 589  32.542  42.986  29.468
  282   HG12  VAL 589          HG12      VAL 589  33.677  44.057  28.628
  283   HG13  VAL 589          HG13      VAL 589  33.937  42.317  28.584
  284   HG21  VAL 589          HG21      VAL 589  33.798  41.225  30.975
  285   HG22  VAL 589          HG22      VAL 589  35.368  41.274  30.174
  286   HG23  VAL 589          HG23      VAL 589  35.241  41.758  31.876
  287    H    LYS 590           H        LYS 590  35.620  46.332  31.622
  288    HA   LYS 590           HA       LYS 590  37.759  45.619  33.532
  289    HB2  LYS 590           HB2      LYS 590  37.979  47.726  32.372
  290    HB3  LYS 590           HB3      LYS 590  36.427  48.299  32.981
  291    HG2  LYS 590           HG2      LYS 590  37.164  48.365  35.222
  292    HG3  LYS 590           HG3      LYS 590  38.666  47.490  34.874
  293    HD2  LYS 590           HD2      LYS 590  39.630  49.369  33.726
  294    HD3  LYS 590           HD3      LYS 590  38.073  50.198  33.639
  295    HE2  LYS 590           HE2      LYS 590  38.158  50.239  36.208
  296    HE3  LYS 590           HE3      LYS 590  39.832  49.724  36.086
  297    HZ1  LYS 590           HZ1      LYS 590  39.735  52.134  36.101
  298    HZ2  LYS 590           HZ2      LYS 590  40.264  51.671  34.642
  299    HZ3  LYS 590           HZ3      LYS 590  38.724  52.179  34.873
  300    H    PHE 591           H        PHE 591  36.886  44.319  35.056
  301    HA   PHE 591           HA       PHE 591  34.420  44.326  36.404
  302    HB2  PHE 591           HB2      PHE 591  37.238  43.660  37.241
  303    HB3  PHE 591           HB3      PHE 591  35.803  43.356  38.243
  304    HD1  PHE 591           HD2      PHE 591  33.991  41.862  37.408
  305    HD2  PHE 591           HD1      PHE 591  37.768  42.180  35.348
  306    HE1  PHE 591           HE2      PHE 591  33.533  39.717  36.169
  307    HE2  PHE 591           HE1      PHE 591  37.205  40.155  34.021
  308    HZ   PHE 591           HZ       PHE 591  35.116  38.919  34.469
  309    H    ILE 592           H        ILE 592  33.341  45.983  37.495
  310    HA   ILE 592           HA       ILE 592  34.709  48.512  37.904
  311    HB   ILE 592           HB       ILE 592  31.994  48.170  39.022
  312   HG12  ILE 592          HG12      ILE 592  32.521  48.147  36.007
  313   HG13  ILE 592          HG13      ILE 592  31.754  46.884  36.988
  314   HG21  ILE 592          HG21      ILE 592  33.043  50.316  37.113
  315   HG22  ILE 592          HG22      ILE 592  31.703  50.457  38.227
  316   HG23  ILE 592          HG23      ILE 592  33.349  50.416  38.861
  317   HD11  ILE 592          HD11      ILE 592  30.761  49.582  36.148
  318   HD12  ILE 592          HD12      ILE 592  30.073  47.960  35.841
  319   HD13  ILE 592          HD13      ILE 592  29.945  48.698  37.463
  320    H    ASP 593           H        ASP 593  33.691  45.982  40.269
  321    HA   ASP 593           HA       ASP 593  35.069  47.515  42.384
  322    HB2  ASP 593           HB2      ASP 593  34.136  45.755  43.995
  323    HB3  ASP 593           HB3      ASP 593  33.054  46.930  43.326
  324    H    TYR 594           H        TYR 594  36.406  46.011  40.162
  325    HA   TYR 594           HA       TYR 594  38.585  45.146  42.014
  326    HB2  TYR 594           HB2      TYR 594  38.042  43.846  39.335
  327    HB3  TYR 594           HB3      TYR 594  39.344  43.448  40.417
  328    HD1  TYR 594           HD1      TYR 594  35.597  43.448  40.176
  329    HD2  TYR 594           HD2      TYR 594  39.043  41.812  42.199
  330    HE1  TYR 594           HE1      TYR 594  34.169  41.741  41.175
  331    HE2  TYR 594           HE2      TYR 594  37.565  40.038  43.197
  332    HH   TYR 594           HH       TYR 594  34.073  40.011  42.685
  333    H    GLY 595           H        GLY 595  37.638  47.145  39.456
  334    HA2  GLY 595           HA2      GLY 595  38.557  48.504  38.019
  335    HA3  GLY 595           HA3      GLY 595  39.767  48.809  39.267
  336    H    ASN 596           H        ASN 596  39.587  45.747  37.356
  337    HA   ASN 596           HA       ASN 596  41.386  46.878  35.363
  338    HB2  ASN 596           HB2      ASN 596  42.968  44.936  35.483
  339    HB3  ASN 596           HB3      ASN 596  42.906  45.796  37.023
  340   HD21  ASN 596          HD22      ASN 596  42.690  44.584  38.758
  341   HD22  ASN 596          HD21      ASN 596  42.091  42.930  38.799
  342    H    TYR 597           H        TYR 597  41.704  45.239  33.443
  343    HA   TYR 597           HA       TYR 597  39.098  43.925  32.986
  344    HB2  TYR 597           HB2      TYR 597  39.512  44.682  30.492
  345    HB3  TYR 597           HB3      TYR 597  38.791  45.783  31.619
  346    HD1  TYR 597           HD2      TYR 597  40.482  47.354  32.982
  347    HD2  TYR 597           HD1      TYR 597  41.173  45.595  29.096
  348    HE1  TYR 597           HE2      TYR 597  42.160  49.031  32.554
  349    HE2  TYR 597           HE1      TYR 597  42.551  47.588  28.479
  350    HH   TYR 597           HH       TYR 597  43.591  49.365  29.276
  351    H    GLU 598           H        GLU 598  38.831  42.215  31.852
  352    HA   GLU 598           HA       GLU 598  41.057  40.628  30.605
  353    HB2  GLU 598           HB2      GLU 598  38.938  39.087  32.007
  354    HB3  GLU 598           HB3      GLU 598  40.579  38.672  31.629
  355    HG2  GLU 598           HG2      GLU 598  41.336  40.299  33.425
  356    HG3  GLU 598           HG3      GLU 598  39.634  40.480  33.862
  357    H    GLU 599           H        GLU 599  40.197  38.839  29.278
  358    HA   GLU 599           HA       GLU 599  37.824  39.706  27.761
  359    HB2  GLU 599           HB2      GLU 599  38.586  38.532  25.995
  360    HB3  GLU 599           HB3      GLU 599  40.045  39.199  26.721
  361    HG2  GLU 599           HG2      GLU 599  40.522  36.875  27.701
  362    HG3  GLU 599           HG3      GLU 599  38.980  36.356  27.036
  363    H    VAL 600           H        VAL 600  36.030  38.460  27.487
  364    HA   VAL 600           HA       VAL 600  35.628  35.875  28.771
  365    HB   VAL 600           HB       VAL 600  33.641  38.161  29.185
  366   HG11  VAL 600          HG11      VAL 600  33.934  35.502  30.647
  367   HG12  VAL 600          HG12      VAL 600  32.702  36.745  30.947
  368   HG13  VAL 600          HG13      VAL 600  32.704  35.865  29.418
  369   HG21  VAL 600          HG21      VAL 600  35.608  38.846  30.538
  370   HG22  VAL 600          HG22      VAL 600  34.199  38.471  31.494
  371   HG23  VAL 600          HG23      VAL 600  35.519  37.282  31.396
  372    H    LEU 601           H        LEU 601  33.950  34.798  27.646
  373    HA   LEU 601           HA       LEU 601  33.495  35.324  24.911
  374    HB2  LEU 601           HB2      LEU 601  33.111  33.134  26.126
  375    HB3  LEU 601           HB3      LEU 601  31.570  33.870  26.684
  376    HG   LEU 601           HG       LEU 601  31.179  34.154  24.079
  377   HD11  LEU 601          HD11      LEU 601  33.160  31.819  24.352
  378   HD12  LEU 601          HD12      LEU 601  32.019  31.844  23.047
  379   HD13  LEU 601          HD13      LEU 601  33.216  33.136  23.141
  380   HD21  LEU 601          HD21      LEU 601  30.084  31.829  24.162
  381   HD22  LEU 601          HD22      LEU 601  30.955  31.558  25.661
  382   HD23  LEU 601          HD23      LEU 601  29.712  32.837  25.567
  383    H    LEU 602           H        LEU 602  32.017  36.466  23.829
  384    HA   LEU 602           HA       LEU 602  30.621  38.658  24.967
  385    HB2  LEU 602           HB2      LEU 602  30.238  37.099  22.408
  386    HB3  LEU 602           HB3      LEU 602  29.461  38.653  22.675
  387    HG   LEU 602           HG       LEU 602  32.487  38.417  22.851
  388   HD11  LEU 602          HD11      LEU 602  31.679  37.378  20.697
  389   HD12  LEU 602          HD12      LEU 602  31.162  39.009  20.180
  390   HD13  LEU 602          HD13      LEU 602  32.851  38.722  20.559
  391   HD21  LEU 602          HD21      LEU 602  31.465  40.550  23.456
  392   HD22  LEU 602          HD22      LEU 602  32.534  40.689  22.036
  393   HD23  LEU 602          HD23      LEU 602  30.788  40.694  21.788
  394    H    SER 603           H        SER 603  29.285  35.449  24.058
  395    HA   SER 603           HA       SER 603  26.609  36.098  24.977
  396    HB2  SER 603           HB2      SER 603  27.612  33.278  24.452
  397    HB3  SER 603           HB3      SER 603  25.962  33.915  24.417
  398    HG   SER 603           HG       SER 603  26.712  33.769  22.381
  399    H    ASN 604           H        ASN 604  29.248  35.821  26.831
  400    HA   ASN 604           HA       ASN 604  27.877  34.707  29.259
  401    HB2  ASN 604           HB2      ASN 604  30.823  34.916  28.545
  402    HB3  ASN 604           HB3      ASN 604  30.223  34.634  30.131
  403   HD21  ASN 604          HD22      ASN 604  27.977  33.058  28.068
  404   HD22  ASN 604          HD21      ASN 604  28.748  31.488  28.081
  405    H    ILE 605           H        ILE 605  29.121  37.707  27.839
  406    HA   ILE 605           HA       ILE 605  28.591  39.118  30.393
  407    HB   ILE 605           HB       ILE 605  28.751  40.405  27.694
  408   HG12  ILE 605          HG12      ILE 605  31.236  40.077  29.477
  409   HG13  ILE 605          HG13      ILE 605  30.885  38.978  28.136
  410   HG21  ILE 605          HG21      ILE 605  29.330  42.390  28.845
  411   HG22  ILE 605          HG22      ILE 605  27.919  41.715  29.661
  412   HG23  ILE 605          HG23      ILE 605  29.529  41.544  30.397
  413   HD11  ILE 605          HD11      ILE 605  32.403  40.708  27.450
  414   HD12  ILE 605          HD12      ILE 605  30.842  40.793  26.570
  415   HD13  ILE 605          HD13      ILE 605  31.239  41.975  27.858
  416    H    LYS 606           H        LYS 606  26.804  39.641  31.041
  417    HA   LYS 606           HA       LYS 606  24.233  39.622  29.567
  418    HB2  LYS 606           HB2      LYS 606  24.686  38.157  31.521
  419    HB3  LYS 606           HB3      LYS 606  25.121  39.530  32.513
  420    HG2  LYS 606           HG2      LYS 606  22.845  40.294  32.637
  421    HG3  LYS 606           HG3      LYS 606  22.366  39.159  31.327
  422    HD2  LYS 606           HD2      LYS 606  21.539  38.395  33.387
  423    HD3  LYS 606           HD3      LYS 606  22.740  37.281  32.684
  424    HE2  LYS 606           HE2      LYS 606  24.359  37.877  34.342
  425    HE3  LYS 606           HE3      LYS 606  23.328  39.141  35.009
  426    HZ1  LYS 606           HZ1      LYS 606  23.084  37.006  36.292
  427    HZ2  LYS 606           HZ2      LYS 606  21.700  37.315  35.546
  428    HZ3  LYS 606           HZ3      LYS 606  22.667  36.236  34.888
  429    HA   PRO 607           HA       PRO 607  23.964  44.181  30.017
  430    HB2  PRO 607           HB2      PRO 607  21.227  44.447  30.127
  431    HB3  PRO 607           HB3      PRO 607  22.173  44.275  28.598
  432    HG2  PRO 607           HG2      PRO 607  20.617  42.252  30.181
  433    HG3  PRO 607           HG3      PRO 607  20.715  42.478  28.388
  434    HD2  PRO 607           HD2      PRO 607  22.127  40.541  29.777
  435    HD3  PRO 607           HD3      PRO 607  22.702  41.325  28.266
  436    H    ILE 608           H        ILE 608  23.801  45.482  31.833
  437    HA   ILE 608           HA       ILE 608  23.046  44.401  34.408
  438    HB   ILE 608           HB       ILE 608  24.140  46.859  33.126
  439   HG12  ILE 608          HG12      ILE 608  25.318  44.786  34.318
  440   HG13  ILE 608          HG13      ILE 608  26.017  46.355  33.980
  441   HG21  ILE 608          HG21      ILE 608  23.258  47.383  35.940
  442   HG22  ILE 608          HG22      ILE 608  23.933  48.453  34.688
  443   HG23  ILE 608          HG23      ILE 608  22.304  47.851  34.505
  444   HD11  ILE 608          HD11      ILE 608  24.937  45.588  36.665
  445   HD12  ILE 608          HD12      ILE 608  26.647  45.637  36.095
  446   HD13  ILE 608          HD13      ILE 608  25.730  47.135  36.182
  447    H    LEU 609           H        LEU 609  21.314  46.150  31.875
  448    HA   LEU 609           HA       LEU 609  18.829  45.815  33.263
  449    HB2  LEU 609           HB2      LEU 609  19.997  48.116  34.052
  450    HB3  LEU 609           HB3      LEU 609  19.488  48.686  32.469
  451    HG   LEU 609           HG       LEU 609  17.136  48.112  33.000
  452   HD11  LEU 609          HD11      LEU 609  16.835  46.520  34.583
  453   HD12  LEU 609          HD12      LEU 609  18.392  46.791  35.335
  454   HD13  LEU 609          HD13      LEU 609  17.032  47.864  35.741
  455   HD21  LEU 609          HD21      LEU 609  18.009  50.361  33.413
  456   HD22  LEU 609          HD22      LEU 609  16.802  49.911  34.645
  457   HD23  LEU 609          HD23      LEU 609  18.536  49.892  35.028
  458    H    GLU 610           H        GLU 610  17.023  46.346  31.828
  459    HA   GLU 610           HA       GLU 610  17.705  46.157  28.911
  460    HB2  GLU 610           HB2      GLU 610  16.180  44.152  30.626
  461    HB3  GLU 610           HB3      GLU 610  15.779  44.379  28.935
  462    HG2  GLU 610           HG2      GLU 610  18.618  43.746  29.778
  463    HG3  GLU 610           HG3      GLU 610  17.389  42.500  29.658
  464    H1   TYR 611           H1       TYR 611  51.505  31.401  41.112
  465    H2   TYR 611           H2       TYR 611  51.417  29.828  40.741
  466    H3   TYR 611           H3       TYR 611  52.487  30.301  41.846
  467    HA   TYR 611           HA       TYR 611  50.413  29.167  42.668
  468    HB2  TYR 611           HB2      TYR 611  50.847  31.944  43.777
  469    HB3  TYR 611           HB3      TYR 611  50.028  30.618  44.587
  470    HD1  TYR 611           HD2      TYR 611  51.361  28.292  44.706
  471    HD2  TYR 611           HD1      TYR 611  53.168  32.173  44.088
  472    HE1  TYR 611           HE2      TYR 611  53.556  27.396  45.413
  473    HE2  TYR 611           HE1      TYR 611  55.392  31.214  44.645
  474    HH   TYR 611           HH       TYR 611  56.481  29.293  45.236
  475    H    SER 612           H        SER 612  49.891  32.494  41.384
  476    HA   SER 612           HA       SER 612  47.019  31.912  41.096
  477    HB2  SER 612           HB2      SER 612  48.270  34.446  42.302
  478    HB3  SER 612           HB3      SER 612  46.564  34.269  41.864
  479    HG   SER 612           HG       SER 612  46.644  32.452  43.369
  480    HA   PRO 613           HA       PRO 613  49.275  33.897  37.454
  481    HB2  PRO 613           HB2      PRO 613  49.084  32.017  35.526
  482    HB3  PRO 613           HB3      PRO 613  50.308  32.042  36.819
  483    HG2  PRO 613           HG2      PRO 613  47.689  30.455  36.788
  484    HG3  PRO 613           HG3      PRO 613  49.314  29.809  37.145
  485    HD2  PRO 613           HD2      PRO 613  47.688  30.557  39.189
  486    HD3  PRO 613           HD3      PRO 613  49.435  30.851  39.214
  487    H    SER 614           H        SER 614  45.993  33.273  38.026
  488    HA   SER 614           HA       SER 614  45.260  34.762  35.519
  489    HB2  SER 614           HB2      SER 614  43.681  32.505  36.610
  490    HB3  SER 614           HB3      SER 614  43.407  33.501  35.140
  491    HG   SER 614           HG       SER 614  45.056  31.354  35.391
  492    H    SER 615           H        SER 615  45.408  35.145  38.741
  493    HA   SER 615           HA       SER 615  42.733  36.464  38.931
  494    HB2  SER 615           HB2      SER 615  44.007  35.188  41.379
  495    HB3  SER 615           HB3      SER 615  42.364  35.785  41.094
  496    HG   SER 615           HG       SER 615  41.959  33.894  40.416
  497    HA   PRO 616           HA       PRO 616  45.711  39.888  39.940
  498    HB2  PRO 616           HB2      PRO 616  44.998  41.660  37.994
  499    HB3  PRO 616           HB3      PRO 616  46.080  40.289  37.629
  500    HG2  PRO 616           HG2      PRO 616  43.111  40.546  37.240
  501    HG3  PRO 616           HG3      PRO 616  44.291  39.919  36.045
  502    HD2  PRO 616           HD2      PRO 616  42.688  38.419  37.668
  503    HD3  PRO 616           HD3      PRO 616  44.251  37.798  37.061
  504   HC11  DA2 617          HC11      DA2 617  37.963  40.033  39.325
  505   HC12  DA2 617          HC12      DA2 617  37.107  39.122  38.094
  506   HC13  DA2 617          HC13      DA2 617  36.258  40.377  39.002
  507   HC21  DA2 617          HC21      DA2 617  34.991  37.916  38.798
  508   HC22  DA2 617          HC22      DA2 617  34.493  38.987  40.110
  509   HC23  DA2 617          HC23      DA2 617  34.853  37.301  40.455
  510    H2   DA2 617           H        DA2 617  43.951  39.170  41.510
  511    HA   DA2 617           HA       DA2 617  42.381  41.544  42.320
  512   HCB1  DA2 617          HCB1      DA2 617  40.740  40.399  41.095
  513   HCB2  DA2 617          HCB2      DA2 617  40.403  40.173  42.797
  514   HCG1  DA2 617          HCG1      DA2 617  41.354  38.189  40.712
  515   HCG2  DA2 617          HCG2      DA2 617  41.708  37.831  42.415
  516   HCD1  DA2 617          HCD1      DA2 617  39.686  36.722  41.622
  517   HCD2  DA2 617          HCD2      DA2 617  39.351  37.850  42.964
  518    HNE  DA2 617           HNE      DA2 617  38.943  39.255  40.538
  519   HNH2  DA2 617          HNH2      DA2 617  37.603  36.689  42.558
  520   HNH1  DA2 617          HNH1      DA2 617  36.070  36.691  41.799
  521    H    TYR 618           H        TYR 618  44.752  39.824  43.295
  522    HA   TYR 618           HA       TYR 618  43.935  39.322  46.125
  523    HB2  TYR 618           HB2      TYR 618  46.022  37.899  44.413
  524    HB3  TYR 618           HB3      TYR 618  45.768  37.619  46.122
  525    HD1  TYR 618           HD1      TYR 618  42.504  37.762  45.678
  526    HD2  TYR 618           HD2      TYR 618  45.890  35.547  44.160
  527    HE1  TYR 618           HE1      TYR 618  41.032  35.860  45.161
  528    HE2  TYR 618           HE2      TYR 618  44.400  33.666  43.554
  529    HH   TYR 618           HH       TYR 618  42.207  32.871  43.662
  530    H    THR 619           H        THR 619  45.485  41.694  44.504
  531    HA   THR 619           HA       THR 619  47.550  42.137  46.578
  532    HB   THR 619           HB       THR 619  48.205  42.568  43.660
  533    HG1  THR 619           HG1      THR 619  47.828  40.349  43.998
  534   HG21  THR 619          HG21      THR 619  50.006  41.919  46.030
  535   HG22  THR 619          HG22      THR 619  50.502  42.354  44.376
  536   HG23  THR 619          HG23      THR 619  49.749  43.574  45.423
  537    HA   PRO 620           HA       PRO 620  45.229  46.164  45.236
  538    HB2  PRO 620           HB2      PRO 620  43.617  46.639  47.299
  539    HB3  PRO 620           HB3      PRO 620  43.264  45.333  46.122
  540    HG2  PRO 620           HG2      PRO 620  44.658  44.937  48.820
  541    HG3  PRO 620           HG3      PRO 620  43.155  44.169  48.256
  542    HD2  PRO 620           HD2      PRO 620  45.594  43.052  47.928
  543    HD3  PRO 620           HD3      PRO 620  44.361  42.893  46.635
  544    H    GLN 621           H        GLN 621  47.228  45.305  47.848
  545    HA   GLN 621           HA       GLN 621  48.347  46.407  49.436
  546    HB2  GLN 621           HB2      GLN 621  49.286  48.098  47.112
  547    HB3  GLN 621           HB3      GLN 621  50.092  47.677  48.623
  548    HG2  GLN 621           HG2      GLN 621  50.197  45.274  47.872
  549    HG3  GLN 621           HG3      GLN 621  49.717  45.778  46.251
  550   HE21  GLN 621          HE22      GLN 621  52.145  46.097  48.746
  551   HE22  GLN 621          HE21      GLN 621  53.468  46.584  47.720
  552    H    SER 622           H        SER 622  45.878  47.435  49.722
  553    HA   SER 622           HA       SER 622  44.620  49.015  50.628
  554    HB2  SER 622           HB2      SER 622  45.575  50.316  52.406
  555    HB3  SER 622           HB3      SER 622  46.372  48.750  52.296
  556    HG   SER 622           HG       SER 622  47.976  50.022  50.993
  557    HA   PRO 623           HA       PRO 623  43.607  52.483  48.307
  558    HB2  PRO 623           HB2      PRO 623  43.712  54.345  50.651
  559    HB3  PRO 623           HB3      PRO 623  42.366  54.117  49.503
  560    HG2  PRO 623           HG2      PRO 623  42.211  52.996  51.981
  561    HG3  PRO 623           HG3      PRO 623  41.720  52.025  50.568
  562    HD2  PRO 623           HD2      PRO 623  44.322  51.966  52.057
  563    HD3  PRO 623           HD3      PRO 623  43.336  50.606  51.466
  Start of MODEL    6
    1    H1   MET 553           H1       MET 553  24.722  41.181  25.301
    2    H2   MET 553           H2       MET 553  24.024  41.544  23.844
    3    H3   MET 553           H3       MET 553  25.520  42.009  24.129
    4    HA   MET 553           HA       MET 553  26.400  39.864  24.186
    5    HB2  MET 553           HB2      MET 553  23.545  38.916  23.787
    6    HB3  MET 553           HB3      MET 553  24.980  37.952  23.398
    7    HG2  MET 553           HG2      MET 553  25.450  37.400  25.446
    8    HG3  MET 553           HG3      MET 553  25.113  38.987  26.102
    9    HE1  MET 553           HE1      MET 553  22.211  35.340  26.018
   10    HE2  MET 553           HE2      MET 553  23.345  35.558  24.699
   11    HE3  MET 553           HE3      MET 553  23.957  35.307  26.343
   12    H    LYS 554           H        LYS 554  23.689  40.137  21.754
   13    HA   LYS 554           HA       LYS 554  25.201  39.297  19.600
   14    HB2  LYS 554           HB2      LYS 554  22.589  39.555  20.024
   15    HB3  LYS 554           HB3      LYS 554  22.830  41.192  19.416
   16    HG2  LYS 554           HG2      LYS 554  23.647  40.241  17.261
   17    HG3  LYS 554           HG3      LYS 554  23.342  38.609  17.906
   18    HD2  LYS 554           HD2      LYS 554  20.967  39.174  18.254
   19    HD3  LYS 554           HD3      LYS 554  21.211  40.785  17.556
   20    HE2  LYS 554           HE2      LYS 554  21.900  39.749  15.410
   21    HE3  LYS 554           HE3      LYS 554  21.633  38.151  16.138
   22    HZ1  LYS 554           HZ1      LYS 554  19.261  38.791  16.343
   23    HZ2  LYS 554           HZ2      LYS 554  19.630  40.279  15.664
   24    HZ3  LYS 554           HZ3      LYS 554  19.738  38.997  14.784
   25    H    MET 555           H        MET 555  26.655  40.338  18.484
   26    HA   MET 555           HA       MET 555  28.324  41.845  17.997
   27    HB2  MET 555           HB2      MET 555  25.838  43.372  17.161
   28    HB3  MET 555           HB3      MET 555  27.502  43.863  16.753
   29    HG2  MET 555           HG2      MET 555  27.905  41.895  15.537
   30    HG3  MET 555           HG3      MET 555  26.300  41.232  15.909
   31    HE1  MET 555           HE1      MET 555  24.332  41.543  14.832
   32    HE2  MET 555           HE2      MET 555  23.942  43.204  15.309
   33    HE3  MET 555           HE3      MET 555  23.871  42.727  13.599
   34    H    TRP 556           H        TRP 556  28.682  41.825  20.467
   35    HA   TRP 556           HA       TRP 556  27.934  44.048  22.081
   36    HB2  TRP 556           HB2      TRP 556  29.881  41.762  22.246
   37    HB3  TRP 556           HB3      TRP 556  30.328  43.227  23.115
   38    HD1  TRP 556           HD1      TRP 556  29.079  40.103  23.906
   39    HE1  TRP 556           HE1      TRP 556  27.930  40.114  26.131
   40    HE3  TRP 556           HE3      TRP 556  27.753  45.048  24.083
   41    HZ2  TRP 556           HZ2      TRP 556  26.551  42.013  27.853
   42    HZ3  TRP 556           HZ3      TRP 556  26.273  45.837  25.909
   43    HH2  TRP 556           HH2      TRP 556  25.618  44.322  27.747
   44    H    LYS 557           H        LYS 557  29.566  45.619  23.092
   45    HA   LYS 557           HA       LYS 557  31.542  46.653  21.275
   46    HB2  LYS 557           HB2      LYS 557  30.217  48.428  20.194
   47    HB3  LYS 557           HB3      LYS 557  29.270  46.989  20.117
   48    HG2  LYS 557           HG2      LYS 557  27.997  47.647  22.121
   49    HG3  LYS 557           HG3      LYS 557  28.928  49.155  22.238
   50    HD2  LYS 557           HD2      LYS 557  28.059  49.822  19.968
   51    HD3  LYS 557           HD3      LYS 557  27.169  48.282  19.911
   52    HE2  LYS 557           HE2      LYS 557  25.948  48.997  21.971
   53    HE3  LYS 557           HE3      LYS 557  26.863  50.534  21.935
   54    HZ1  LYS 557           HZ1      LYS 557  24.732  49.638  20.130
   55    HZ2  LYS 557           HZ2      LYS 557  25.041  51.183  20.689
   56    HZ3  LYS 557           HZ3      LYS 557  25.901  50.511  19.525
   57    HA   PRO 558           HA       PRO 558  33.250  48.675  24.576
   58    HB2  PRO 558           HB2      PRO 558  34.658  50.654  23.526
   59    HB3  PRO 558           HB3      PRO 558  34.760  49.006  22.934
   60    HG2  PRO 558           HG2      PRO 558  33.158  51.242  21.632
   61    HG3  PRO 558           HG3      PRO 558  34.236  50.073  20.841
   62    HD2  PRO 558           HD2      PRO 558  31.539  49.723  21.040
   63    HD3  PRO 558           HD3      PRO 558  32.709  48.380  20.902
   64    H    GLY 559           H        GLY 559  33.558  50.214  26.089
   65    HA2  GLY 559           HA2      GLY 559  33.066  51.755  27.664
   66    HA3  GLY 559           HA3      GLY 559  32.352  52.790  26.424
   67    H    ASP 560           H        ASP 560  31.478  49.729  28.164
   68    HA   ASP 560           HA       ASP 560  28.782  50.869  28.634
   69    HB2  ASP 560           HB2      ASP 560  29.276  49.398  26.327
   70    HB3  ASP 560           HB3      ASP 560  28.678  48.165  27.399
   71    H    GLU 561           H        GLU 561  28.621  50.708  30.822
   72    HA   GLU 561           HA       GLU 561  29.481  48.414  32.244
   73    HB2  GLU 561           HB2      GLU 561  27.361  49.066  33.814
   74    HB3  GLU 561           HB3      GLU 561  29.003  49.730  33.821
   75    HG2  GLU 561           HG2      GLU 561  27.488  51.453  34.174
   76    HG3  GLU 561           HG3      GLU 561  28.195  51.704  32.591
   77    H    CYS 562           H        CYS 562  28.861  46.434  32.570
   78    HA   CYS 562           HA       CYS 562  26.330  45.291  31.645
   79    HB2  CYS 562           HB2      CYS 562  29.087  44.424  30.584
   80    HB3  CYS 562           HB3      CYS 562  27.596  43.638  30.145
   81    HG   CYS 562           HG       CYS 562  28.739  46.591  29.449
   82    H    PHE 563           H        PHE 563  26.744  42.672  31.910
   83    HA   PHE 563           HA       PHE 563  27.899  42.155  34.615
   84    HB2  PHE 563           HB2      PHE 563  25.224  41.541  33.457
   85    HB3  PHE 563           HB3      PHE 563  26.039  40.238  34.360
   86    HD1  PHE 563           HD1      PHE 563  27.064  40.777  36.608
   87    HD2  PHE 563           HD2      PHE 563  23.793  42.940  34.853
   88    HE1  PHE 563           HE1      PHE 563  26.548  41.791  38.814
   89    HE2  PHE 563           HE2      PHE 563  23.494  44.205  36.985
   90    HZ   PHE 563           HZ       PHE 563  24.823  43.589  38.975
   91    H    ALA 564           H        ALA 564  29.768  41.007  34.253
   92    HA   ALA 564           HA       ALA 564  29.890  39.165  31.939
   93    HB1  ALA 564           HB1      ALA 564  32.018  40.471  33.651
   94    HB2  ALA 564           HB2      ALA 564  32.316  39.398  32.262
   95    HB3  ALA 564           HB3      ALA 564  31.485  40.959  32.013
   96    H    LEU 565           H        LEU 565  30.149  36.999  32.183
   97    HA   LEU 565           HA       LEU 565  29.957  35.676  34.712
   98    HB2  LEU 565           HB2      LEU 565  29.148  34.906  32.382
   99    HB3  LEU 565           HB3      LEU 565  30.851  34.552  32.030
  100    HG   LEU 565           HG       LEU 565  30.953  32.748  33.517
  101   HD11  LEU 565          HD11      LEU 565  28.284  33.810  34.559
  102   HD12  LEU 565          HD12      LEU 565  28.743  32.141  34.826
  103   HD13  LEU 565          HD13      LEU 565  29.787  33.454  35.453
  104   HD21  LEU 565          HD21      LEU 565  29.010  31.306  32.828
  105   HD22  LEU 565          HD22      LEU 565  28.459  32.704  31.850
  106   HD23  LEU 565          HD23      LEU 565  30.042  31.927  31.570
  107    H    TYR 566           H        TYR 566  31.461  34.915  35.937
  108    HA   TYR 566           HA       TYR 566  34.303  35.098  35.240
  109    HB2  TYR 566           HB2      TYR 566  33.066  35.910  37.426
  110    HB3  TYR 566           HB3      TYR 566  33.162  34.216  37.884
  111    HD1  TYR 566           HD1      TYR 566  35.639  36.442  36.035
  112    HD2  TYR 566           HD2      TYR 566  34.714  34.130  39.541
  113    HE1  TYR 566           HE1      TYR 566  37.988  36.668  36.787
  114    HE2  TYR 566           HE2      TYR 566  37.030  34.503  40.391
  115    HH   TYR 566           HH       TYR 566  39.352  36.426  38.516
  116    H    TRP 567           H        TRP 567  35.302  33.046  36.843
  117    HA   TRP 567           HA       TRP 567  34.636  30.546  35.305
  118    HB2  TRP 567           HB2      TRP 567  37.040  30.275  34.799
  119    HB3  TRP 567           HB3      TRP 567  36.384  31.742  34.103
  120    HD1  TRP 567           HD1      TRP 567  37.509  34.002  34.960
  121    HE1  TRP 567           HE1      TRP 567  39.505  34.585  36.466
  122    HE3  TRP 567           HE3      TRP 567  38.515  29.387  36.919
  123    HZ2  TRP 567           HZ2      TRP 567  41.199  33.308  38.396
  124    HZ3  TRP 567           HZ3      TRP 567  40.207  29.160  38.759
  125    HH2  TRP 567           HH2      TRP 567  41.511  31.122  39.500
  126    H    GLU 568           H        GLU 568  36.506  31.950  38.010
  127    HA   GLU 568           HA       GLU 568  37.079  29.614  39.440
  128    HB2  GLU 568           HB2      GLU 568  37.965  31.722  40.273
  129    HB3  GLU 568           HB3      GLU 568  36.362  32.487  40.149
  130    HG2  GLU 568           HG2      GLU 568  35.545  31.613  42.054
  131    HG3  GLU 568           HG3      GLU 568  36.835  30.390  42.223
  132    H    ASP 569           H        ASP 569  34.138  31.585  39.504
  133    HA   ASP 569           HA       ASP 569  32.762  29.451  41.044
  134    HB2  ASP 569           HB2      ASP 569  31.434  31.245  42.124
  135    HB3  ASP 569           HB3      ASP 569  33.113  31.149  42.609
  136    H    ASN 570           H        ASN 570  32.818  31.365  38.231
  137    HA   ASN 570           HA       ASN 570  31.440  31.596  36.421
  138    HB2  ASN 570           HB2      ASN 570  31.646  29.054  36.856
  139    HB3  ASN 570           HB3      ASN 570  29.954  29.135  37.358
  140   HD21  ASN 570          HD22      ASN 570  32.082  30.325  34.690
  141   HD22  ASN 570          HD21      ASN 570  31.040  29.695  33.417
  142    H    LYS 571           H        LYS 571  30.723  33.091  38.854
  143    HA   LYS 571           HA       LYS 571  27.825  33.602  38.431
  144    HB2  LYS 571           HB2      LYS 571  29.794  33.957  40.591
  145    HB3  LYS 571           HB3      LYS 571  29.073  35.495  40.216
  146    HG2  LYS 571           HG2      LYS 571  27.399  32.999  40.612
  147    HG3  LYS 571           HG3      LYS 571  27.872  33.959  41.986
  148    HD2  LYS 571           HD2      LYS 571  26.659  35.986  40.736
  149    HD3  LYS 571           HD3      LYS 571  26.153  34.745  39.602
  150    HE2  LYS 571           HE2      LYS 571  25.554  33.506  41.927
  151    HE3  LYS 571           HE3      LYS 571  25.207  35.162  42.437
  152    HZ1  LYS 571           HZ1      LYS 571  24.166  33.781  40.083
  153    HZ2  LYS 571           HZ2      LYS 571  23.294  34.106  41.425
  154    HZ3  LYS 571           HZ3      LYS 571  23.760  35.332  40.455
  155    H    PHE 572           H        PHE 572  27.073  35.684  37.738
  156    HA   PHE 572           HA       PHE 572  28.923  37.160  36.022
  157    HB2  PHE 572           HB2      PHE 572  25.998  37.506  36.705
  158    HB3  PHE 572           HB3      PHE 572  26.906  38.439  35.504
  159    HD1  PHE 572           HD1      PHE 572  25.437  35.126  36.265
  160    HD2  PHE 572           HD2      PHE 572  27.617  37.485  33.387
  161    HE1  PHE 572           HE1      PHE 572  24.963  33.433  34.479
  162    HE2  PHE 572           HE2      PHE 572  26.898  35.930  31.585
  163    HZ   PHE 572           HZ       PHE 572  25.771  33.798  32.190
  164    H    TYR 573           H        TYR 573  29.657  39.159  36.403
  165    HA   TYR 573           HA       TYR 573  29.189  40.588  38.994
  166    HB2  TYR 573           HB2      TYR 573  31.787  40.008  37.500
  167    HB3  TYR 573           HB3      TYR 573  31.658  41.151  38.815
  168    HD1  TYR 573           HD2      TYR 573  31.615  37.518  37.947
  169    HD2  TYR 573           HD1      TYR 573  31.434  40.438  41.115
  170    HE1  TYR 573           HE2      TYR 573  31.978  35.742  39.577
  171    HE2  TYR 573           HE1      TYR 573  31.516  38.597  42.790
  172    HH   TYR 573           HH       TYR 573  32.048  35.252  41.983
  173    H    ARG 574           H        ARG 574  29.322  42.817  38.848
  174    HA   ARG 574           HA       ARG 574  28.690  44.204  36.410
  175    HB2  ARG 574           HB2      ARG 574  29.957  45.394  38.913
  176    HB3  ARG 574           HB3      ARG 574  29.088  46.209  37.607
  177    HG2  ARG 574           HG2      ARG 574  27.024  45.201  38.162
  178    HG3  ARG 574           HG3      ARG 574  27.735  44.005  39.233
  179    HD2  ARG 574           HD2      ARG 574  28.260  45.534  40.932
  180    HD3  ARG 574           HD3      ARG 574  27.828  46.936  39.997
  181    HE   ARG 574           HE       ARG 574  25.924  45.101  41.370
  182   HH11  ARG 574          HH11      ARG 574  26.139  47.808  39.015
  183   HH12  ARG 574          HH12      ARG 574  24.377  47.801  38.954
  184   HH21  ARG 574          HH21      ARG 574  23.735  45.651  41.293
  185   HH22  ARG 574          HH22      ARG 574  23.213  46.706  39.974
  186    H    ALA 575           H        ALA 575  29.973  44.795  34.764
  187    HA   ALA 575           HA       ALA 575  32.720  45.626  35.286
  188    HB1  ALA 575           HB1      ALA 575  32.218  43.544  33.083
  189    HB2  ALA 575           HB2      ALA 575  33.778  44.102  33.708
  190    HB3  ALA 575           HB3      ALA 575  32.757  43.084  34.703
  191    H    GLU 576           H        GLU 576  33.467  47.144  34.043
  192    HA   GLU 576           HA       GLU 576  31.587  48.371  32.125
  193    HB2  GLU 576           HB2      GLU 576  33.943  49.601  33.549
  194    HB3  GLU 576           HB3      GLU 576  33.544  50.131  31.920
  195    HG2  GLU 576           HG2      GLU 576  31.244  50.674  32.551
  196    HG3  GLU 576           HG3      GLU 576  31.512  50.010  34.146
  197    H    VAL 577           H        VAL 577  31.650  47.581  30.205
  198    HA   VAL 577           HA       VAL 577  33.662  46.124  28.958
  199    HB   VAL 577           HB       VAL 577  31.247  47.753  28.125
  200   HG11  VAL 577          HG11      VAL 577  33.257  46.677  26.185
  201   HG12  VAL 577          HG12      VAL 577  31.512  46.462  25.896
  202   HG13  VAL 577          HG13      VAL 577  32.156  48.087  26.158
  203   HG21  VAL 577          HG21      VAL 577  30.744  45.738  29.224
  204   HG22  VAL 577          HG22      VAL 577  30.402  45.528  27.503
  205   HG23  VAL 577          HG23      VAL 577  31.874  44.800  28.201
  206    H    GLU 578           H        GLU 578  35.496  46.553  27.884
  207    HA   GLU 578           HA       GLU 578  36.278  49.404  27.532
  208    HB2  GLU 578           HB2      GLU 578  37.596  48.534  29.231
  209    HB3  GLU 578           HB3      GLU 578  37.858  47.008  28.407
  210    HG2  GLU 578           HG2      GLU 578  39.910  48.443  28.293
  211    HG3  GLU 578           HG3      GLU 578  39.280  48.101  26.711
  212    H    ALA 579           H        ALA 579  36.441  46.111  26.122
  213    HA   ALA 579           HA       ALA 579  36.471  47.226  23.440
  214    HB1  ALA 579           HB1      ALA 579  38.646  46.577  22.756
  215    HB2  ALA 579           HB2      ALA 579  38.916  47.320  24.344
  216    HB3  ALA 579           HB3      ALA 579  38.905  45.567  24.217
  217    H    LEU 580           H        LEU 580  34.915  45.955  22.505
  218    HA   LEU 580           HA       LEU 580  35.029  42.982  22.896
  219    HB2  LEU 580           HB2      LEU 580  32.428  44.361  22.369
  220    HB3  LEU 580           HB3      LEU 580  32.773  42.773  22.990
  221    HG   LEU 580           HG       LEU 580  32.876  45.452  24.357
  222   HD11  LEU 580          HD11      LEU 580  31.417  42.842  24.860
  223   HD12  LEU 580          HD12      LEU 580  31.556  43.969  26.173
  224   HD13  LEU 580          HD13      LEU 580  30.779  44.527  24.695
  225   HD21  LEU 580          HD21      LEU 580  34.646  44.924  25.607
  226   HD22  LEU 580          HD22      LEU 580  33.595  43.822  26.461
  227   HD23  LEU 580          HD23      LEU 580  34.590  43.220  25.103
  228    H    HIS 581           H        HIS 581  35.546  41.854  21.192
  229    HA   HIS 581           HA       HIS 581  35.405  42.799  18.493
  230    HB2  HIS 581           HB2      HIS 581  37.039  41.246  19.439
  231    HB3  HIS 581           HB3      HIS 581  35.871  39.948  19.469
  232    HD2  HIS 581           HD2      HIS 581  38.430  39.553  17.723
  233    HE1  HIS 581           HE1      HIS 581  35.974  40.280  14.343
  234    HE2  HIS 581           HE2      HIS 581  38.174  39.376  15.125
  235    H    SER 582           H        SER 582  33.554  43.411  17.663
  236    HA   SER 582           HA       SER 582  30.954  42.252  18.119
  237    HB2  SER 582           HB2      SER 582  31.667  44.071  15.807
  238    HB3  SER 582           HB3      SER 582  30.133  43.930  16.693
  239    HG   SER 582           HG       SER 582  31.242  44.843  18.476
  240    H    SER 583           H        SER 583  33.420  41.088  16.094
  241    HA   SER 583           HA       SER 583  31.485  39.168  14.916
  242    HB2  SER 583           HB2      SER 583  32.512  39.067  12.855
  243    HB3  SER 583           HB3      SER 583  31.962  40.736  13.091
  244    HG   SER 583           HG       SER 583  34.297  39.882  12.435
  245    H    GLY 584           H        GLY 584  32.976  38.926  17.241
  246    HA2  GLY 584           HA2      GLY 584  35.199  37.009  16.638
  247    HA3  GLY 584           HA3      GLY 584  35.296  38.290  17.835
  248    H    MET 585           H        MET 585  35.906  36.575  19.183
  249    HA   MET 585           HA       MET 585  33.791  34.749  20.250
  250    HB2  MET 585           HB2      MET 585  35.801  33.660  19.316
  251    HB3  MET 585           HB3      MET 585  36.822  34.712  20.287
  252    HG2  MET 585           HG2      MET 585  36.074  33.539  22.342
  253    HG3  MET 585           HG3      MET 585  35.153  32.406  21.348
  254    HE1  MET 585           HE1      MET 585  38.295  34.097  22.198
  255    HE2  MET 585           HE2      MET 585  39.231  32.634  22.568
  256    HE3  MET 585           HE3      MET 585  39.472  33.501  21.016
  257    H    THR 586           H        THR 586  36.320  37.099  21.311
  258    HA   THR 586           HA       THR 586  35.239  36.930  24.093
  259    HB   THR 586           HB       THR 586  37.617  37.857  24.678
  260    HG1  THR 586           HG1      THR 586  39.045  36.714  23.104
  261   HG21  THR 586          HG21      THR 586  38.521  35.691  25.032
  262   HG22  THR 586          HG22      THR 586  36.815  35.623  25.418
  263   HG23  THR 586          HG23      THR 586  37.363  34.924  23.899
  264    H    ALA 587           H        ALA 587  35.575  38.739  25.447
  265    HA   ALA 587           HA       ALA 587  35.565  41.415  24.177
  266    HB1  ALA 587           HB1      ALA 587  33.337  39.920  25.498
  267    HB2  ALA 587           HB2      ALA 587  33.539  41.599  25.988
  268    HB3  ALA 587           HB3      ALA 587  33.317  41.215  24.257
  269    H    VAL 588           H        VAL 588  36.641  42.868  25.338
  270    HA   VAL 588           HA       VAL 588  37.888  42.032  27.896
  271    HB   VAL 588           HB       VAL 588  38.623  44.496  26.330
  272   HG11  VAL 588          HG11      VAL 588  39.917  42.904  28.552
  273   HG12  VAL 588          HG12      VAL 588  40.794  44.120  27.610
  274   HG13  VAL 588          HG13      VAL 588  39.393  44.604  28.556
  275   HG21  VAL 588          HG21      VAL 588  39.936  41.691  26.182
  276   HG22  VAL 588          HG22      VAL 588  39.194  42.507  24.790
  277   HG23  VAL 588          HG23      VAL 588  40.658  43.144  25.499
  278    H    VAL 589           H        VAL 589  37.044  42.600  29.616
  279    HA   VAL 589           HA       VAL 589  35.466  45.077  29.790
  280    HB   VAL 589           HB       VAL 589  33.836  43.852  31.225
  281   HG11  VAL 589          HG11      VAL 589  34.008  42.206  28.721
  282   HG12  VAL 589          HG12      VAL 589  32.605  43.014  29.473
  283   HG13  VAL 589          HG13      VAL 589  33.835  43.968  28.608
  284   HG21  VAL 589          HG21      VAL 589  34.077  41.177  30.899
  285   HG22  VAL 589          HG22      VAL 589  35.775  41.558  30.923
  286   HG23  VAL 589          HG23      VAL 589  34.812  42.111  32.272
  287    H    LYS 590           H        LYS 590  35.630  46.176  31.605
  288    HA   LYS 590           HA       LYS 590  37.739  45.444  33.540
  289    HB2  LYS 590           HB2      LYS 590  38.024  47.544  32.393
  290    HB3  LYS 590           HB3      LYS 590  36.420  48.116  32.895
  291    HG2  LYS 590           HG2      LYS 590  36.994  48.132  35.189
  292    HG3  LYS 590           HG3      LYS 590  38.537  47.328  34.915
  293    HD2  LYS 590           HD2      LYS 590  39.452  49.370  33.865
  294    HD3  LYS 590           HD3      LYS 590  37.786  50.056  33.733
  295    HE2  LYS 590           HE2      LYS 590  37.753  49.668  36.256
  296    HE3  LYS 590           HE3      LYS 590  39.524  49.739  36.134
  297    HZ1  LYS 590           HZ1      LYS 590  37.630  51.763  35.079
  298    HZ2  LYS 590           HZ2      LYS 590  38.416  51.908  36.477
  299    HZ3  LYS 590           HZ3      LYS 590  39.247  51.911  35.026
  300    H    PHE 591           H        PHE 591  36.848  44.192  35.151
  301    HA   PHE 591           HA       PHE 591  34.314  44.480  36.364
  302    HB2  PHE 591           HB2      PHE 591  37.044  43.623  37.390
  303    HB3  PHE 591           HB3      PHE 591  35.591  43.347  38.321
  304    HD1  PHE 591           HD2      PHE 591  33.605  42.102  36.978
  305    HD2  PHE 591           HD1      PHE 591  37.762  41.995  35.842
  306    HE1  PHE 591           HE2      PHE 591  33.210  40.011  35.674
  307    HE2  PHE 591           HE1      PHE 591  37.336  39.937  34.503
  308    HZ   PHE 591           HZ       PHE 591  35.062  38.956  34.431
  309    H    ILE 592           H        ILE 592  33.397  46.095  37.565
  310    HA   ILE 592           HA       ILE 592  34.842  48.565  37.566
  311    HB   ILE 592           HB       ILE 592  32.256  48.434  39.047
  312   HG12  ILE 592          HG12      ILE 592  32.527  47.889  36.100
  313   HG13  ILE 592          HG13      ILE 592  31.549  47.084  37.366
  314   HG21  ILE 592          HG21      ILE 592  33.368  50.288  36.872
  315   HG22  ILE 592          HG22      ILE 592  32.059  50.700  37.988
  316   HG23  ILE 592          HG23      ILE 592  33.703  50.607  38.584
  317   HD11  ILE 592          HD11      ILE 592  30.191  48.266  35.823
  318   HD12  ILE 592          HD12      ILE 592  30.068  48.999  37.458
  319   HD13  ILE 592          HD13      ILE 592  31.001  49.807  36.175
  320    H    ASP 593           H        ASP 593  33.717  46.615  40.380
  321    HA   ASP 593           HA       ASP 593  34.931  48.476  42.277
  322    HB2  ASP 593           HB2      ASP 593  32.803  47.199  42.673
  323    HB3  ASP 593           HB3      ASP 593  33.717  45.701  42.680
  324    H    TYR 594           H        TYR 594  36.050  45.722  40.515
  325    HA   TYR 594           HA       TYR 594  38.424  45.417  42.246
  326    HB2  TYR 594           HB2      TYR 594  37.901  44.070  39.546
  327    HB3  TYR 594           HB3      TYR 594  39.019  43.643  40.794
  328    HD1  TYR 594           HD1      TYR 594  35.142  44.081  40.601
  329    HD2  TYR 594           HD2      TYR 594  38.524  41.642  41.827
  330    HE1  TYR 594           HE1      TYR 594  33.624  42.410  41.480
  331    HE2  TYR 594           HE2      TYR 594  36.919  39.983  42.777
  332    HH   TYR 594           HH       TYR 594  33.467  40.469  42.683
  333    H    GLY 595           H        GLY 595  37.623  46.952  39.164
  334    HA2  GLY 595           HA2      GLY 595  38.689  48.763  38.330
  335    HA3  GLY 595           HA3      GLY 595  40.105  48.457  39.438
  336    H    ASN 596           H        ASN 596  39.428  45.750  37.456
  337    HA   ASN 596           HA       ASN 596  41.202  46.791  35.338
  338    HB2  ASN 596           HB2      ASN 596  42.984  45.209  35.756
  339    HB3  ASN 596           HB3      ASN 596  42.638  46.088  37.223
  340   HD21  ASN 596          HD22      ASN 596  42.791  44.805  39.030
  341   HD22  ASN 596          HD21      ASN 596  42.257  43.133  39.059
  342    H    TYR 597           H        TYR 597  41.771  45.186  33.663
  343    HA   TYR 597           HA       TYR 597  39.308  43.682  33.024
  344    HB2  TYR 597           HB2      TYR 597  39.588  44.545  30.650
  345    HB3  TYR 597           HB3      TYR 597  38.997  45.669  31.871
  346    HD1  TYR 597           HD2      TYR 597  40.284  47.361  32.892
  347    HD2  TYR 597           HD1      TYR 597  41.586  45.317  29.343
  348    HE1  TYR 597           HE2      TYR 597  42.015  49.078  32.575
  349    HE2  TYR 597           HE1      TYR 597  43.276  47.110  28.936
  350    HH   TYR 597           HH       TYR 597  44.226  49.019  29.813
  351    H    GLU 598           H        GLU 598  39.335  42.322  31.297
  352    HA   GLU 598           HA       GLU 598  41.615  40.783  30.375
  353    HB2  GLU 598           HB2      GLU 598  40.878  38.703  31.617
  354    HB3  GLU 598           HB3      GLU 598  41.686  39.916  32.612
  355    HG2  GLU 598           HG2      GLU 598  39.491  40.611  33.527
  356    HG3  GLU 598           HG3      GLU 598  38.695  39.519  32.398
  357    H    GLU 599           H        GLU 599  40.751  38.878  29.076
  358    HA   GLU 599           HA       GLU 599  38.283  39.484  27.714
  359    HB2  GLU 599           HB2      GLU 599  38.838  37.652  26.336
  360    HB3  GLU 599           HB3      GLU 599  40.286  38.595  26.603
  361    HG2  GLU 599           HG2      GLU 599  39.676  35.950  28.093
  362    HG3  GLU 599           HG3      GLU 599  40.510  36.041  26.583
  363    H    VAL 600           H        VAL 600  36.454  38.456  27.655
  364    HA   VAL 600           HA       VAL 600  35.865  36.023  29.204
  365    HB   VAL 600           HB       VAL 600  34.158  38.604  29.253
  366   HG11  VAL 600          HG11      VAL 600  33.628  35.964  30.581
  367   HG12  VAL 600          HG12      VAL 600  32.762  37.504  30.863
  368   HG13  VAL 600          HG13      VAL 600  32.740  36.778  29.246
  369   HG21  VAL 600          HG21      VAL 600  36.048  38.943  30.738
  370   HG22  VAL 600          HG22      VAL 600  34.610  38.677  31.707
  371   HG23  VAL 600          HG23      VAL 600  35.794  37.357  31.493
  372    H    LEU 601           H        LEU 601  33.968  34.864  28.162
  373    HA   LEU 601           HA       LEU 601  33.895  35.271  25.296
  374    HB2  LEU 601           HB2      LEU 601  33.199  33.187  27.006
  375    HB3  LEU 601           HB3      LEU 601  31.628  33.783  26.407
  376    HG   LEU 601           HG       LEU 601  32.505  33.595  24.097
  377   HD11  LEU 601          HD11      LEU 601  34.848  32.172  25.522
  378   HD12  LEU 601          HD12      LEU 601  34.450  31.946  23.826
  379   HD13  LEU 601          HD13      LEU 601  34.978  33.545  24.431
  380   HD21  LEU 601          HD21      LEU 601  31.208  31.738  25.474
  381   HD22  LEU 601          HD22      LEU 601  31.958  31.328  23.948
  382   HD23  LEU 601          HD23      LEU 601  32.799  30.948  25.494
  383    H    LEU 602           H        LEU 602  32.484  36.298  23.990
  384    HA   LEU 602           HA       LEU 602  31.062  38.631  24.845
  385    HB2  LEU 602           HB2      LEU 602  30.490  37.150  22.241
  386    HB3  LEU 602           HB3      LEU 602  30.047  38.758  22.636
  387    HG   LEU 602           HG       LEU 602  32.970  38.304  22.924
  388   HD11  LEU 602          HD11      LEU 602  33.330  38.577  20.485
  389   HD12  LEU 602          HD12      LEU 602  32.547  37.021  20.873
  390   HD13  LEU 602          HD13      LEU 602  31.602  38.386  20.208
  391   HD21  LEU 602          HD21      LEU 602  31.723  40.598  22.997
  392   HD22  LEU 602          HD22      LEU 602  33.055  40.479  21.790
  393   HD23  LEU 602          HD23      LEU 602  31.394  40.343  21.270
  394    H    SER 603           H        SER 603  29.674  35.446  24.095
  395    HA   SER 603           HA       SER 603  26.971  36.041  24.695
  396    HB2  SER 603           HB2      SER 603  28.087  34.138  23.398
  397    HB3  SER 603           HB3      SER 603  28.351  33.361  24.986
  398    HG   SER 603           HG       SER 603  25.998  34.148  23.746
  399    H    ASN 604           H        ASN 604  29.748  35.469  26.750
  400    HA   ASN 604           HA       ASN 604  28.292  34.498  29.172
  401    HB2  ASN 604           HB2      ASN 604  31.239  34.777  28.539
  402    HB3  ASN 604           HB3      ASN 604  30.557  34.397  30.095
  403   HD21  ASN 604          HD22      ASN 604  32.256  32.591  28.958
  404   HD22  ASN 604          HD21      ASN 604  31.358  31.185  28.394
  405    H    ILE 605           H        ILE 605  28.817  37.391  27.748
  406    HA   ILE 605           HA       ILE 605  28.620  38.797  30.384
  407    HB   ILE 605           HB       ILE 605  29.257  40.061  27.703
  408   HG12  ILE 605          HG12      ILE 605  31.446  40.025  29.807
  409   HG13  ILE 605          HG13      ILE 605  31.171  38.548  28.916
  410   HG21  ILE 605          HG21      ILE 605  29.529  41.253  30.462
  411   HG22  ILE 605          HG22      ILE 605  29.789  42.046  28.865
  412   HG23  ILE 605          HG23      ILE 605  28.170  41.550  29.349
  413   HD11  ILE 605          HD11      ILE 605  32.880  39.879  27.887
  414   HD12  ILE 605          HD12      ILE 605  31.477  39.722  26.787
  415   HD13  ILE 605          HD13      ILE 605  31.791  41.246  27.597
  416    H    LYS 606           H        LYS 606  26.708  39.015  30.883
  417    HA   LYS 606           HA       LYS 606  24.407  39.539  29.159
  418    HB2  LYS 606           HB2      LYS 606  24.935  39.002  32.060
  419    HB3  LYS 606           HB3      LYS 606  23.472  39.894  31.618
  420    HG2  LYS 606           HG2      LYS 606  22.667  38.179  30.206
  421    HG3  LYS 606           HG3      LYS 606  24.153  37.229  30.264
  422    HD2  LYS 606           HD2      LYS 606  23.770  36.713  32.628
  423    HD3  LYS 606           HD3      LYS 606  22.376  37.851  32.644
  424    HE2  LYS 606           HE2      LYS 606  21.477  36.523  30.682
  425    HE3  LYS 606           HE3      LYS 606  22.650  35.264  31.093
  426    HZ1  LYS 606           HZ1      LYS 606  20.576  34.884  32.269
  427    HZ2  LYS 606           HZ2      LYS 606  21.733  35.312  33.367
  428    HZ3  LYS 606           HZ3      LYS 606  20.584  36.377  32.887
  429    HA   PRO 607           HA       PRO 607  24.477  44.155  29.938
  430    HB2  PRO 607           HB2      PRO 607  21.751  44.667  29.942
  431    HB3  PRO 607           HB3      PRO 607  22.747  44.509  28.470
  432    HG2  PRO 607           HG2      PRO 607  20.942  42.588  29.934
  433    HG3  PRO 607           HG3      PRO 607  21.121  42.721  28.150
  434    HD2  PRO 607           HD2      PRO 607  22.273  40.697  29.639
  435    HD3  PRO 607           HD3      PRO 607  22.980  41.319  28.139
  436    H    ILE 608           H        ILE 608  23.625  45.758  31.430
  437    HA   ILE 608           HA       ILE 608  23.025  44.768  34.142
  438    HB   ILE 608           HB       ILE 608  24.743  46.781  32.949
  439   HG12  ILE 608          HG12      ILE 608  24.279  45.927  35.792
  440   HG13  ILE 608          HG13      ILE 608  25.363  45.193  34.559
  441   HG21  ILE 608          HG21      ILE 608  22.958  48.051  35.006
  442   HG22  ILE 608          HG22      ILE 608  24.435  48.701  34.219
  443   HG23  ILE 608          HG23      ILE 608  22.989  48.447  33.258
  444   HD11  ILE 608          HD11      ILE 608  26.468  46.503  36.380
  445   HD12  ILE 608          HD12      ILE 608  26.903  47.022  34.736
  446   HD13  ILE 608          HD13      ILE 608  25.789  47.979  35.750
  447    H    LEU 609           H        LEU 609  21.510  46.599  31.617
  448    HA   LEU 609           HA       LEU 609  19.069  47.029  33.262
  449    HB2  LEU 609           HB2      LEU 609  20.742  49.154  32.793
  450    HB3  LEU 609           HB3      LEU 609  19.661  49.288  31.412
  451    HG   LEU 609           HG       LEU 609  19.120  50.668  33.361
  452   HD11  LEU 609          HD11      LEU 609  17.469  50.183  31.729
  453   HD12  LEU 609          HD12      LEU 609  16.851  48.816  32.675
  454   HD13  LEU 609          HD13      LEU 609  16.831  50.463  33.377
  455   HD21  LEU 609          HD21      LEU 609  19.781  49.097  35.143
  456   HD22  LEU 609          HD22      LEU 609  18.218  49.891  35.372
  457   HD23  LEU 609          HD23      LEU 609  18.300  48.175  34.898
  458    H    GLU 610           H        GLU 610  20.442  46.718  29.947
  459    HA   GLU 610           HA       GLU 610  18.063  46.917  28.463
  460    HB2  GLU 610           HB2      GLU 610  20.307  46.732  27.445
  461    HB3  GLU 610           HB3      GLU 610  20.352  45.022  27.890
  462    HG2  GLU 610           HG2      GLU 610  18.421  44.569  26.353
  463    HG3  GLU 610           HG3      GLU 610  18.389  46.258  25.910
  464    H1   TYR 611           H1       TYR 611  57.541  44.035  50.319
  465    H2   TYR 611           H2       TYR 611  57.297  45.270  51.332
  466    H3   TYR 611           H3       TYR 611  56.964  45.433  49.710
  467    HA   TYR 611           HA       TYR 611  55.634  43.603  51.561
  468    HB2  TYR 611           HB2      TYR 611  54.496  46.184  50.407
  469    HB3  TYR 611           HB3      TYR 611  53.563  45.000  51.298
  470    HD1  TYR 611           HD2      TYR 611  53.835  44.701  53.799
  471    HD2  TYR 611           HD1      TYR 611  55.906  47.759  51.536
  472    HE1  TYR 611           HE2      TYR 611  54.629  45.730  55.894
  473    HE2  TYR 611           HE1      TYR 611  56.562  48.856  53.634
  474    HH   TYR 611           HH       TYR 611  56.621  48.583  55.965
  475    H    SER 612           H        SER 612  54.035  42.429  50.804
  476    HA   SER 612           HA       SER 612  53.283  40.790  49.447
  477    HB2  SER 612           HB2      SER 612  51.328  41.900  48.089
  478    HB3  SER 612           HB3      SER 612  51.481  42.098  49.852
  479    HG   SER 612           HG       SER 612  52.471  43.907  47.945
  480    HA   PRO 613           HA       PRO 613  55.630  40.731  45.571
  481    HB2  PRO 613           HB2      PRO 613  56.902  38.378  45.877
  482    HB3  PRO 613           HB3      PRO 613  57.406  39.901  46.711
  483    HG2  PRO 613           HG2      PRO 613  55.655  37.675  47.802
  484    HG3  PRO 613           HG3      PRO 613  57.142  38.304  48.567
  485    HD2  PRO 613           HD2      PRO 613  54.768  39.256  49.316
  486    HD3  PRO 613           HD3      PRO 613  56.112  40.394  49.085
  487    H    SER 614           H        SER 614  53.230  38.516  46.933
  488    HA   SER 614           HA       SER 614  52.357  37.721  44.173
  489    HB2  SER 614           HB2      SER 614  53.495  35.815  45.138
  490    HB3  SER 614           HB3      SER 614  52.546  36.007  46.657
  491    HG   SER 614           HG       SER 614  51.637  35.184  44.127
  492    H    SER 615           H        SER 615  50.332  38.261  43.914
  493    HA   SER 615           HA       SER 615  48.331  38.525  45.966
  494    HB2  SER 615           HB2      SER 615  49.501  41.032  44.631
  495    HB3  SER 615           HB3      SER 615  47.922  41.001  45.419
  496    HG   SER 615           HG       SER 615  50.134  40.058  46.813
  497    HA   PRO 616           HA       PRO 616  47.485  37.240  41.589
  498    HB2  PRO 616           HB2      PRO 616  45.401  35.602  43.075
  499    HB3  PRO 616           HB3      PRO 616  46.290  35.193  41.617
  500    HG2  PRO 616           HG2      PRO 616  47.108  34.306  44.082
  501    HG3  PRO 616           HG3      PRO 616  48.392  34.972  43.027
  502    HD2  PRO 616           HD2      PRO 616  46.748  36.373  45.145
  503    HD3  PRO 616           HD3      PRO 616  48.536  36.392  45.005
  504   HC11  DA2 617          HC11      DA2 617  36.647  39.167  37.999
  505   HC12  DA2 617          HC12      DA2 617  36.066  40.376  39.162
  506   HC13  DA2 617          HC13      DA2 617  37.810  40.057  39.005
  507   HC21  DA2 617          HC21      DA2 617  34.944  37.970  41.105
  508   HC22  DA2 617          HC22      DA2 617  35.128  37.209  39.482
  509   HC23  DA2 617          HC23      DA2 617  34.607  38.891  39.645
  510    H2   DA2 617           H        DA2 617  44.927  38.364  43.874
  511    HA   DA2 617           HA       DA2 617  43.707  39.791  41.583
  512   HCB1  DA2 617          HCB1      DA2 617  41.847  38.375  43.488
  513   HCB2  DA2 617          HCB2      DA2 617  42.548  37.475  42.152
  514   HCG1  DA2 617          HCG1      DA2 617  40.846  39.996  41.895
  515   HCG2  DA2 617          HCG2      DA2 617  41.624  39.159  40.555
  516   HCD1  DA2 617          HCD1      DA2 617  40.292  37.067  41.170
  517   HCD2  DA2 617          HCD2      DA2 617  39.600  37.957  42.522
  518    HNE  DA2 617           HNE      DA2 617  39.113  39.193  39.902
  519   HNH2  DA2 617          HNH2      DA2 617  38.172  36.681  42.173
  520   HNH1  DA2 617          HNH1      DA2 617  36.488  36.726  41.808
  521    H    TYR 618           H        TYR 618  44.379  39.889  45.120
  522    HA   TYR 618           HA       TYR 618  42.648  42.319  45.287
  523    HB2  TYR 618           HB2      TYR 618  42.915  40.065  47.321
  524    HB3  TYR 618           HB3      TYR 618  41.888  41.467  47.482
  525    HD1  TYR 618           HD2      TYR 618  40.094  41.832  45.551
  526    HD2  TYR 618           HD1      TYR 618  41.953  37.996  46.374
  527    HE1  TYR 618           HE2      TYR 618  38.140  40.662  44.619
  528    HE2  TYR 618           HE1      TYR 618  40.023  36.866  45.362
  529    HH   TYR 618           HH       TYR 618  37.861  37.164  44.477
  530    H    THR 619           H        THR 619  45.682  40.907  46.154
  531    HA   THR 619           HA       THR 619  47.369  41.290  47.635
  532    HB   THR 619           HB       THR 619  46.328  44.105  47.813
  533    HG1  THR 619           HG1      THR 619  46.849  43.101  45.646
  534   HG21  THR 619          HG21      THR 619  49.233  43.159  48.041
  535   HG22  THR 619          HG22      THR 619  48.642  44.820  47.976
  536   HG23  THR 619          HG23      THR 619  48.265  43.801  49.376
  537    HA   PRO 620           HA       PRO 620  45.672  40.421  51.681
  538    HB2  PRO 620           HB2      PRO 620  48.003  41.019  53.149
  539    HB3  PRO 620           HB3      PRO 620  47.576  39.440  52.428
  540    HG2  PRO 620           HG2      PRO 620  49.444  41.529  51.422
  541    HG3  PRO 620           HG3      PRO 620  49.516  39.738  51.248
  542    HD2  PRO 620           HD2      PRO 620  48.790  41.388  49.217
  543    HD3  PRO 620           HD3      PRO 620  48.096  39.772  49.384
  544    H    GLN 621           H        GLN 621  44.160  41.815  52.165
  545    HA   GLN 621           HA       GLN 621  44.566  44.642  52.442
  546    HB2  GLN 621           HB2      GLN 621  42.209  42.922  53.223
  547    HB3  GLN 621           HB3      GLN 621  42.297  44.703  53.315
  548    HG2  GLN 621           HG2      GLN 621  42.832  43.228  50.706
  549    HG3  GLN 621           HG3      GLN 621  41.234  43.770  51.219
  550   HE21  GLN 621          HE22      GLN 621  41.428  44.735  49.227
  551   HE22  GLN 621          HE21      GLN 621  42.216  46.310  49.046
  552    H    SER 622           H        SER 622  45.952  42.525  54.525
  553    HA   SER 622           HA       SER 622  44.926  42.904  56.996
  554    HB2  SER 622           HB2      SER 622  47.871  42.752  56.952
  555    HB3  SER 622           HB3      SER 622  46.681  41.678  57.686
  556    HG   SER 622           HG       SER 622  47.763  40.643  55.985
  557    HA   PRO 623           HA       PRO 623  47.921  46.632  58.022
  558    HB2  PRO 623           HB2      PRO 623  47.193  48.432  55.782
  559    HB3  PRO 623           HB3      PRO 623  48.774  48.203  56.598
  560    HG2  PRO 623           HG2      PRO 623  48.238  47.238  54.076
  561    HG3  PRO 623           HG3      PRO 623  49.257  46.282  55.190
  562    HD2  PRO 623           HD2      PRO 623  46.337  46.087  54.607
  563    HD3  PRO 623           HD3      PRO 623  47.547  44.752  54.759
  Start of MODEL    7
    1    H1   MET 553           H1       MET 553  25.156  35.677  19.745
    2    H2   MET 553           H2       MET 553  23.907  34.879  19.083
    3    H3   MET 553           H3       MET 553  23.712  35.659  20.512
    4    HA   MET 553           HA       MET 553  24.007  36.776  17.823
    5    HB2  MET 553           HB2      MET 553  21.685  36.437  19.000
    6    HB3  MET 553           HB3      MET 553  22.179  37.758  20.055
    7    HG2  MET 553           HG2      MET 553  21.580  37.849  17.079
    8    HG3  MET 553           HG3      MET 553  20.566  38.343  18.411
    9    HE1  MET 553           HE1      MET 553  19.844  40.660  18.068
   10    HE2  MET 553           HE2      MET 553  20.791  41.745  17.027
   11    HE3  MET 553           HE3      MET 553  20.283  40.128  16.447
   12    H    LYS 554           H        LYS 554  25.046  38.742  17.541
   13    HA   LYS 554           HA       LYS 554  26.804  39.717  19.645
   14    HB2  LYS 554           HB2      LYS 554  27.136  39.415  16.965
   15    HB3  LYS 554           HB3      LYS 554  26.763  41.122  16.971
   16    HG2  LYS 554           HG2      LYS 554  28.985  39.713  18.512
   17    HG3  LYS 554           HG3      LYS 554  29.197  40.617  17.050
   18    HD2  LYS 554           HD2      LYS 554  28.400  41.854  19.707
   19    HD3  LYS 554           HD3      LYS 554  29.964  41.898  18.884
   20    HE2  LYS 554           HE2      LYS 554  28.958  42.994  16.914
   21    HE3  LYS 554           HE3      LYS 554  27.378  43.026  17.672
   22    HZ1  LYS 554           HZ1      LYS 554  28.047  44.599  19.221
   23    HZ2  LYS 554           HZ2      LYS 554  29.613  44.505  18.895
   24    HZ3  LYS 554           HZ3      LYS 554  28.594  45.145  17.795
   25    H    MET 555           H        MET 555  24.535  40.201  20.757
   26    HA   MET 555           HA       MET 555  23.204  42.647  19.893
   27    HB2  MET 555           HB2      MET 555  21.569  42.203  21.447
   28    HB3  MET 555           HB3      MET 555  22.013  40.612  20.888
   29    HG2  MET 555           HG2      MET 555  22.842  41.855  23.535
   30    HG3  MET 555           HG3      MET 555  21.681  40.554  23.254
   31    HE1  MET 555           HE1      MET 555  22.635  38.719  24.839
   32    HE2  MET 555           HE2      MET 555  24.338  38.289  24.965
   33    HE3  MET 555           HE3      MET 555  23.800  39.892  25.516
   34    H    TRP 556           H        TRP 556  26.027  42.380  21.578
   35    HA   TRP 556           HA       TRP 556  25.470  44.621  23.425
   36    HB2  TRP 556           HB2      TRP 556  27.608  42.527  22.943
   37    HB3  TRP 556           HB3      TRP 556  27.984  43.953  23.887
   38    HD1  TRP 556           HD1      TRP 556  27.024  40.532  24.592
   39    HE1  TRP 556           HE1      TRP 556  26.051  40.314  26.922
   40    HE3  TRP 556           HE3      TRP 556  25.926  45.440  25.442
   41    HZ2  TRP 556           HZ2      TRP 556  25.096  42.115  29.063
   42    HZ3  TRP 556           HZ3      TRP 556  25.066  46.166  27.644
   43    HH2  TRP 556           HH2      TRP 556  24.676  44.518  29.450
   44    H    LYS 557           H        LYS 557  27.226  46.249  23.676
   45    HA   LYS 557           HA       LYS 557  29.006  46.881  21.427
   46    HB2  LYS 557           HB2      LYS 557  26.592  48.509  22.336
   47    HB3  LYS 557           HB3      LYS 557  27.966  49.265  21.506
   48    HG2  LYS 557           HG2      LYS 557  27.673  47.605  19.660
   49    HG3  LYS 557           HG3      LYS 557  26.111  47.126  20.420
   50    HD2  LYS 557           HD2      LYS 557  25.217  49.321  20.197
   51    HD3  LYS 557           HD3      LYS 557  26.783  49.973  19.677
   52    HE2  LYS 557           HE2      LYS 557  26.721  48.526  17.670
   53    HE3  LYS 557           HE3      LYS 557  25.100  47.972  18.079
   54    HZ1  LYS 557           HZ1      LYS 557  24.324  50.233  18.002
   55    HZ2  LYS 557           HZ2      LYS 557  25.829  50.777  17.598
   56    HZ3  LYS 557           HZ3      LYS 557  24.972  49.853  16.564
   57    HA   PRO 558           HA       PRO 558  31.554  48.493  24.699
   58    HB2  PRO 558           HB2      PRO 558  33.085  50.392  23.637
   59    HB3  PRO 558           HB3      PRO 558  33.046  48.740  22.967
   60    HG2  PRO 558           HG2      PRO 558  31.330  51.086  21.985
   61    HG3  PRO 558           HG3      PRO 558  32.590  50.202  21.070
   62    HD2  PRO 558           HD2      PRO 558  29.987  49.470  20.994
   63    HD3  PRO 558           HD3      PRO 558  31.249  48.228  21.094
   64    H    GLY 559           H        GLY 559  31.715  49.982  26.439
   65    HA2  GLY 559           HA2      GLY 559  31.457  52.042  27.562
   66    HA3  GLY 559           HA3      GLY 559  30.437  52.629  26.249
   67    H    ASP 560           H        ASP 560  30.104  49.752  28.443
   68    HA   ASP 560           HA       ASP 560  27.520  50.845  29.451
   69    HB2  ASP 560           HB2      ASP 560  27.346  49.425  27.249
   70    HB3  ASP 560           HB3      ASP 560  27.526  48.047  28.310
   71    H    GLU 561           H        GLU 561  27.814  50.775  31.613
   72    HA   GLU 561           HA       GLU 561  29.129  48.545  32.932
   73    HB2  GLU 561           HB2      GLU 561  28.533  49.628  35.052
   74    HB3  GLU 561           HB3      GLU 561  29.220  50.750  33.874
   75    HG2  GLU 561           HG2      GLU 561  26.585  51.209  33.453
   76    HG3  GLU 561           HG3      GLU 561  26.536  50.627  35.112
   77    H    CYS 562           H        CYS 562  28.525  46.663  33.146
   78    HA   CYS 562           HA       CYS 562  25.698  45.769  33.213
   79    HB2  CYS 562           HB2      CYS 562  27.872  44.511  31.501
   80    HB3  CYS 562           HB3      CYS 562  26.132  44.179  31.408
   81    HG   CYS 562           HG       CYS 562  27.506  47.049  30.943
   82    H    PHE 563           H        PHE 563  26.072  43.065  33.307
   83    HA   PHE 563           HA       PHE 563  27.882  42.483  35.624
   84    HB2  PHE 563           HB2      PHE 563  25.003  41.754  35.160
   85    HB3  PHE 563           HB3      PHE 563  26.086  40.599  35.941
   86    HD1  PHE 563           HD1      PHE 563  27.348  41.249  38.025
   87    HD2  PHE 563           HD2      PHE 563  24.047  43.536  36.478
   88    HE1  PHE 563           HE1      PHE 563  27.240  42.584  40.166
   89    HE2  PHE 563           HE2      PHE 563  23.856  44.713  38.679
   90    HZ   PHE 563           HZ       PHE 563  25.469  44.267  40.463
   91    H    ALA 564           H        ALA 564  29.546  41.179  34.961
   92    HA   ALA 564           HA       ALA 564  29.098  39.332  32.633
   93    HB1  ALA 564           HB1      ALA 564  31.654  40.478  33.719
   94    HB2  ALA 564           HB2      ALA 564  31.411  39.374  32.332
   95    HB3  ALA 564           HB3      ALA 564  30.790  41.050  32.257
   96    H    LEU 565           H        LEU 565  29.314  37.308  32.854
   97    HA   LEU 565           HA       LEU 565  29.602  36.053  35.392
   98    HB2  LEU 565           HB2      LEU 565  28.213  35.379  33.349
   99    HB3  LEU 565           HB3      LEU 565  29.687  34.889  32.578
  100    HG   LEU 565           HG       LEU 565  30.033  33.034  34.085
  101   HD11  LEU 565          HD11      LEU 565  27.950  34.331  35.865
  102   HD12  LEU 565          HD12      LEU 565  28.261  32.580  35.887
  103   HD13  LEU 565          HD13      LEU 565  29.570  33.738  36.226
  104   HD21  LEU 565          HD21      LEU 565  28.490  32.680  32.290
  105   HD22  LEU 565          HD22      LEU 565  28.077  31.673  33.671
  106   HD23  LEU 565          HD23      LEU 565  27.092  33.097  33.329
  107    H    TYR 566           H        TYR 566  31.554  35.820  36.354
  108    HA   TYR 566           HA       TYR 566  34.108  35.696  34.998
  109    HB2  TYR 566           HB2      TYR 566  33.384  36.413  37.452
  110    HB3  TYR 566           HB3      TYR 566  33.571  34.678  37.762
  111    HD1  TYR 566           HD1      TYR 566  35.539  37.236  35.751
  112    HD2  TYR 566           HD2      TYR 566  35.514  34.349  38.941
  113    HE1  TYR 566           HE1      TYR 566  37.955  37.600  36.081
  114    HE2  TYR 566           HE2      TYR 566  37.966  34.675  39.254
  115    HH   TYR 566           HH       TYR 566  39.780  37.026  37.295
  116    H    TRP 567           H        TRP 567  35.545  33.922  35.772
  117    HA   TRP 567           HA       TRP 567  34.567  31.607  34.110
  118    HB2  TRP 567           HB2      TRP 567  36.998  31.349  33.527
  119    HB3  TRP 567           HB3      TRP 567  36.268  32.838  32.926
  120    HD1  TRP 567           HD1      TRP 567  37.205  35.076  33.827
  121    HE1  TRP 567           HE1      TRP 567  39.343  35.720  35.026
  122    HE3  TRP 567           HE3      TRP 567  38.643  30.425  35.303
  123    HZ2  TRP 567           HZ2      TRP 567  41.536  34.321  36.400
  124    HZ3  TRP 567           HZ3      TRP 567  40.658  30.108  36.698
  125    HH2  TRP 567           HH2      TRP 567  42.159  32.061  37.180
  126    H    GLU 568           H        GLU 568  36.545  32.485  36.809
  127    HA   GLU 568           HA       GLU 568  37.572  30.021  37.697
  128    HB2  GLU 568           HB2      GLU 568  38.448  32.089  38.399
  129    HB3  GLU 568           HB3      GLU 568  36.897  32.715  38.911
  130    HG2  GLU 568           HG2      GLU 568  37.986  32.328  40.963
  131    HG3  GLU 568           HG3      GLU 568  36.955  30.934  40.818
  132    H    ASP 569           H        ASP 569  34.530  31.640  38.690
  133    HA   ASP 569           HA       ASP 569  33.850  29.215  40.248
  134    HB2  ASP 569           HB2      ASP 569  32.692  30.774  41.818
  135    HB3  ASP 569           HB3      ASP 569  34.445  30.717  41.877
  136    H    ASN 570           H        ASN 570  32.948  31.307  37.790
  137    HA   ASN 570           HA       ASN 570  31.118  31.450  36.441
  138    HB2  ASN 570           HB2      ASN 570  31.234  28.919  36.948
  139    HB3  ASN 570           HB3      ASN 570  29.801  29.246  37.959
  140   HD21  ASN 570          HD22      ASN 570  27.856  29.323  36.873
  141   HD22  ASN 570          HD21      ASN 570  27.681  29.491  35.125
  142    H    LYS 571           H        LYS 571  31.169  33.190  38.769
  143    HA   LYS 571           HA       LYS 571  28.241  33.667  39.074
  144    HB2  LYS 571           HB2      LYS 571  30.529  33.827  40.994
  145    HB3  LYS 571           HB3      LYS 571  29.706  35.346  40.869
  146    HG2  LYS 571           HG2      LYS 571  28.475  32.751  41.875
  147    HG3  LYS 571           HG3      LYS 571  28.798  34.277  42.687
  148    HD2  LYS 571           HD2      LYS 571  27.132  35.409  41.298
  149    HD3  LYS 571           HD3      LYS 571  26.799  33.914  40.400
  150    HE2  LYS 571           HE2      LYS 571  25.081  34.205  41.973
  151    HE3  LYS 571           HE3      LYS 571  26.040  32.796  42.446
  152    HZ1  LYS 571           HZ1      LYS 571  25.486  34.283  44.322
  153    HZ2  LYS 571           HZ2      LYS 571  27.074  34.052  44.164
  154    HZ3  LYS 571           HZ3      LYS 571  26.351  35.450  43.717
  155    H    PHE 572           H        PHE 572  27.435  35.935  38.861
  156    HA   PHE 572           HA       PHE 572  29.004  37.324  36.805
  157    HB2  PHE 572           HB2      PHE 572  26.214  37.800  37.977
  158    HB3  PHE 572           HB3      PHE 572  26.937  38.814  36.745
  159    HD1  PHE 572           HD1      PHE 572  25.418  35.534  37.436
  160    HD2  PHE 572           HD2      PHE 572  26.988  38.195  34.427
  161    HE1  PHE 572           HE1      PHE 572  24.500  34.069  35.644
  162    HE2  PHE 572           HE2      PHE 572  26.154  36.739  32.674
  163    HZ   PHE 572           HZ       PHE 572  24.883  34.630  33.267
  164    H    TYR 573           H        TYR 573  29.798  39.405  37.055
  165    HA   TYR 573           HA       TYR 573  29.553  40.799  39.699
  166    HB2  TYR 573           HB2      TYR 573  32.070  40.284  38.127
  167    HB3  TYR 573           HB3      TYR 573  31.908  41.228  39.613
  168    HD1  TYR 573           HD1      TYR 573  31.414  40.103  41.782
  169    HD2  TYR 573           HD2      TYR 573  32.076  37.721  38.249
  170    HE1  TYR 573           HE1      TYR 573  31.643  38.031  43.175
  171    HE2  TYR 573           HE2      TYR 573  32.654  35.784  39.656
  172    HH   TYR 573           HH       TYR 573  32.854  34.997  41.801
  173    H    ARG 574           H        ARG 574  29.963  43.103  39.562
  174    HA   ARG 574           HA       ARG 574  28.915  44.229  37.140
  175    HB2  ARG 574           HB2      ARG 574  29.610  46.449  38.123
  176    HB3  ARG 574           HB3      ARG 574  28.480  45.495  39.082
  177    HG2  ARG 574           HG2      ARG 574  30.540  44.786  40.493
  178    HG3  ARG 574           HG3      ARG 574  31.472  45.962  39.577
  179    HD2  ARG 574           HD2      ARG 574  30.832  47.073  41.524
  180    HD3  ARG 574           HD3      ARG 574  29.690  47.711  40.391
  181    HE   ARG 574           HE       ARG 574  29.243  45.653  42.562
  182   HH11  ARG 574          HH11      ARG 574  27.399  47.321  39.923
  183   HH12  ARG 574          HH12      ARG 574  25.952  46.908  40.830
  184   HH21  ARG 574          HH21      ARG 574  27.381  45.332  43.371
  185   HH22  ARG 574          HH22      ARG 574  25.908  45.671  42.514
  186    H    ALA 575           H        ALA 575  29.873  44.884  35.302
  187    HA   ALA 575           HA       ALA 575  32.747  45.424  35.317
  188    HB1  ALA 575           HB1      ALA 575  31.627  43.532  33.194
  189    HB2  ALA 575           HB2      ALA 575  33.315  43.894  33.598
  190    HB3  ALA 575           HB3      ALA 575  32.345  42.895  34.673
  191    H    GLU 576           H        GLU 576  33.184  47.181  34.141
  192    HA   GLU 576           HA       GLU 576  31.215  48.548  32.433
  193    HB2  GLU 576           HB2      GLU 576  34.137  49.284  32.831
  194    HB3  GLU 576           HB3      GLU 576  32.896  50.184  31.903
  195    HG2  GLU 576           HG2      GLU 576  31.530  50.432  33.836
  196    HG3  GLU 576           HG3      GLU 576  32.852  49.708  34.835
  197    H    VAL 577           H        VAL 577  30.769  47.695  30.530
  198    HA   VAL 577           HA       VAL 577  32.257  46.005  28.875
  199    HB   VAL 577           HB       VAL 577  29.946  47.905  28.489
  200   HG11  VAL 577          HG11      VAL 577  31.458  46.527  26.334
  201   HG12  VAL 577          HG12      VAL 577  29.674  46.739  26.253
  202   HG13  VAL 577          HG13      VAL 577  30.738  48.157  26.465
  203   HG21  VAL 577          HG21      VAL 577  29.363  45.822  29.603
  204   HG22  VAL 577          HG22      VAL 577  28.683  45.833  27.972
  205   HG23  VAL 577          HG23      VAL 577  30.084  44.837  28.296
  206    H    GLU 578           H        GLU 578  33.962  46.230  27.691
  207    HA   GLU 578           HA       GLU 578  35.060  48.944  27.269
  208    HB2  GLU 578           HB2      GLU 578  36.329  47.333  28.683
  209    HB3  GLU 578           HB3      GLU 578  36.281  46.129  27.405
  210    HG2  GLU 578           HG2      GLU 578  38.503  47.202  27.507
  211    HG3  GLU 578           HG3      GLU 578  37.673  47.297  25.962
  212    H    ALA 579           H        ALA 579  34.562  45.807  25.704
  213    HA   ALA 579           HA       ALA 579  34.275  46.926  23.087
  214    HB1  ALA 579           HB1      ALA 579  36.945  45.620  23.875
  215    HB2  ALA 579           HB2      ALA 579  36.382  45.719  22.191
  216    HB3  ALA 579           HB3      ALA 579  36.672  47.209  23.153
  217    H    LEU 580           H        LEU 580  32.605  45.909  22.554
  218    HA   LEU 580           HA       LEU 580  32.578  42.944  22.914
  219    HB2  LEU 580           HB2      LEU 580  30.207  44.785  22.746
  220    HB3  LEU 580           HB3      LEU 580  30.166  43.072  23.032
  221    HG   LEU 580           HG       LEU 580  30.470  45.293  24.832
  222   HD11  LEU 580          HD11      LEU 580  29.495  42.468  25.051
  223   HD12  LEU 580          HD12      LEU 580  30.123  43.084  26.544
  224   HD13  LEU 580          HD13      LEU 580  28.890  44.021  25.734
  225   HD21  LEU 580          HD21      LEU 580  31.897  44.210  26.594
  226   HD22  LEU 580          HD22      LEU 580  32.679  43.314  25.246
  227   HD23  LEU 580          HD23      LEU 580  32.668  45.089  25.314
  228    H    HIS 581           H        HIS 581  33.887  43.380  20.892
  229    HA   HIS 581           HA       HIS 581  32.353  42.541  18.548
  230    HB2  HIS 581           HB2      HIS 581  33.300  44.354  17.110
  231    HB3  HIS 581           HB3      HIS 581  31.898  44.711  18.132
  232    HD2  HIS 581           HD2      HIS 581  35.467  45.988  17.543
  233    HE1  HIS 581           HE1      HIS 581  33.709  48.315  20.641
  234    HE2  HIS 581           HE2      HIS 581  35.663  48.103  19.023
  235    H    SER 582           H        SER 582  33.714  41.801  16.892
  236    HA   SER 582           HA       SER 582  35.493  41.202  15.722
  237    HB2  SER 582           HB2      SER 582  37.130  42.974  17.573
  238    HB3  SER 582           HB3      SER 582  37.677  42.238  16.066
  239    HG   SER 582           HG       SER 582  37.040  44.353  15.813
  240    H    SER 583           H        SER 583  35.650  40.172  19.055
  241    HA   SER 583           HA       SER 583  38.214  38.775  18.811
  242    HB2  SER 583           HB2      SER 583  36.187  37.988  20.901
  243    HB3  SER 583           HB3      SER 583  37.944  37.941  20.917
  244    HG   SER 583           HG       SER 583  36.990  39.665  22.104
  245    H    GLY 584           H        GLY 584  34.840  37.836  18.392
  246    HA2  GLY 584           HA2      GLY 584  34.682  36.164  16.443
  247    HA3  GLY 584           HA3      GLY 584  35.614  35.099  17.539
  248    H    MET 585           H        MET 585  34.571  35.310  19.888
  249    HA   MET 585           HA       MET 585  31.618  35.139  19.850
  250    HB2  MET 585           HB2      MET 585  31.685  33.045  21.203
  251    HB3  MET 585           HB3      MET 585  32.490  32.821  19.665
  252    HG2  MET 585           HG2      MET 585  34.703  33.024  20.843
  253    HG3  MET 585           HG3      MET 585  33.852  33.424  22.323
  254    HE1  MET 585           HE1      MET 585  35.094  32.117  23.563
  255    HE2  MET 585           HE2      MET 585  35.434  30.377  23.408
  256    HE3  MET 585           HE3      MET 585  36.035  31.555  22.185
  257    H    THR 586           H        THR 586  34.522  36.193  21.371
  258    HA   THR 586           HA       THR 586  33.221  36.730  23.996
  259    HB   THR 586           HB       THR 586  35.679  37.210  24.730
  260    HG1  THR 586           HG1      THR 586  36.958  37.234  23.266
  261   HG21  THR 586          HG21      THR 586  35.253  34.489  23.540
  262   HG22  THR 586          HG22      THR 586  36.085  34.888  25.069
  263   HG23  THR 586          HG23      THR 586  34.315  34.987  24.977
  264    H    ALA 587           H        ALA 587  33.708  38.523  25.142
  265    HA   ALA 587           HA       ALA 587  33.748  41.120  23.706
  266    HB1  ALA 587           HB1      ALA 587  32.012  41.446  25.821
  267    HB2  ALA 587           HB2      ALA 587  31.475  41.043  24.171
  268    HB3  ALA 587           HB3      ALA 587  31.671  39.786  25.433
  269    H    VAL 588           H        VAL 588  34.695  42.725  24.924
  270    HA   VAL 588           HA       VAL 588  36.323  41.768  27.205
  271    HB   VAL 588           HB       VAL 588  36.695  44.439  25.836
  272   HG11  VAL 588          HG11      VAL 588  38.276  42.631  27.621
  273   HG12  VAL 588          HG12      VAL 588  39.066  43.901  26.658
  274   HG13  VAL 588          HG13      VAL 588  37.782  44.338  27.804
  275   HG21  VAL 588          HG21      VAL 588  36.977  42.636  23.982
  276   HG22  VAL 588          HG22      VAL 588  38.400  43.592  24.385
  277   HG23  VAL 588          HG23      VAL 588  38.215  41.912  24.993
  278    H    VAL 589           H        VAL 589  35.974  42.478  29.202
  279    HA   VAL 589           HA       VAL 589  34.123  44.738  29.715
  280    HB   VAL 589           HB       VAL 589  33.030  43.205  31.416
  281   HG11  VAL 589          HG11      VAL 589  32.677  42.591  28.434
  282   HG12  VAL 589          HG12      VAL 589  31.459  42.365  29.712
  283   HG13  VAL 589          HG13      VAL 589  32.016  43.999  29.239
  284   HG21  VAL 589          HG21      VAL 589  33.099  40.911  31.283
  285   HG22  VAL 589          HG22      VAL 589  33.747  40.874  29.628
  286   HG23  VAL 589          HG23      VAL 589  34.813  41.289  30.965
  287    H    LYS 590           H        LYS 590  34.999  46.015  31.448
  288    HA   LYS 590           HA       LYS 590  37.208  44.912  33.075
  289    HB2  LYS 590           HB2      LYS 590  37.779  47.018  32.137
  290    HB3  LYS 590           HB3      LYS 590  36.289  47.775  32.695
  291    HG2  LYS 590           HG2      LYS 590  37.009  47.706  35.007
  292    HG3  LYS 590           HG3      LYS 590  38.389  46.690  34.629
  293    HD2  LYS 590           HD2      LYS 590  39.517  48.562  33.549
  294    HD3  LYS 590           HD3      LYS 590  38.041  49.567  33.682
  295    HE2  LYS 590           HE2      LYS 590  38.474  48.708  36.269
  296    HE3  LYS 590           HE3      LYS 590  40.132  48.965  35.708
  297    HZ1  LYS 590           HZ1      LYS 590  39.408  51.283  35.120
  298    HZ2  LYS 590           HZ2      LYS 590  37.988  50.992  35.747
  299    HZ3  LYS 590           HZ3      LYS 590  39.274  50.955  36.720
  300    H    PHE 591           H        PHE 591  36.763  43.943  34.900
  301    HA   PHE 591           HA       PHE 591  34.378  43.995  36.467
  302    HB2  PHE 591           HB2      PHE 591  37.194  43.064  36.978
  303    HB3  PHE 591           HB3      PHE 591  35.861  42.759  38.100
  304    HD1  PHE 591           HD2      PHE 591  33.871  41.464  37.456
  305    HD2  PHE 591           HD1      PHE 591  37.358  41.627  34.925
  306    HE1  PHE 591           HE2      PHE 591  32.925  39.656  36.024
  307    HE2  PHE 591           HE1      PHE 591  36.389  39.850  33.496
  308    HZ   PHE 591           HZ       PHE 591  34.178  38.886  34.019
  309    H    ILE 592           H        ILE 592  33.528  45.794  37.516
  310    HA   ILE 592           HA       ILE 592  35.139  48.156  37.724
  311    HB   ILE 592           HB       ILE 592  32.440  48.068  39.057
  312   HG12  ILE 592          HG12      ILE 592  32.935  47.886  36.087
  313   HG13  ILE 592          HG13      ILE 592  31.933  46.826  37.089
  314   HG21  ILE 592          HG21      ILE 592  33.793  50.027  37.139
  315   HG22  ILE 592          HG22      ILE 592  32.342  50.367  38.093
  316   HG23  ILE 592          HG23      ILE 592  33.877  50.182  38.920
  317   HD11  ILE 592          HD11      ILE 592  31.329  49.653  36.195
  318   HD12  ILE 592          HD12      ILE 592  30.420  48.151  35.882
  319   HD13  ILE 592          HD13      ILE 592  30.420  48.906  37.499
  320    H    ASP 593           H        ASP 593  34.573  45.676  39.961
  321    HA   ASP 593           HA       ASP 593  35.710  47.325  42.175
  322    HB2  ASP 593           HB2      ASP 593  33.435  46.163  42.379
  323    HB3  ASP 593           HB3      ASP 593  34.336  44.651  42.510
  324    H    TYR 594           H        TYR 594  37.073  45.717  39.942
  325    HA   TYR 594           HA       TYR 594  39.293  44.464  41.525
  326    HB2  TYR 594           HB2      TYR 594  37.995  43.256  39.044
  327    HB3  TYR 594           HB3      TYR 594  39.282  42.562  40.031
  328    HD1  TYR 594           HD1      TYR 594  35.661  43.510  40.038
  329    HD2  TYR 594           HD2      TYR 594  38.803  41.245  41.939
  330    HE1  TYR 594           HE1      TYR 594  33.956  42.154  41.218
  331    HE2  TYR 594           HE2      TYR 594  37.123  40.062  43.294
  332    HH   TYR 594           HH       TYR 594  33.612  40.355  42.681
  333    H    GLY 595           H        GLY 595  38.269  46.274  38.704
  334    HA2  GLY 595           HA2      GLY 595  39.489  47.992  37.930
  335    HA3  GLY 595           HA3      GLY 595  40.906  47.404  38.860
  336    H    ASN 596           H        ASN 596  39.731  45.006  36.684
  337    HA   ASN 596           HA       ASN 596  41.231  46.039  34.373
  338    HB2  ASN 596           HB2      ASN 596  42.238  43.511  34.338
  339    HB3  ASN 596           HB3      ASN 596  43.078  44.839  35.131
  340   HD21  ASN 596          HD22      ASN 596  43.701  44.333  37.303
  341   HD22  ASN 596          HD21      ASN 596  42.884  43.049  38.196
  342    H    TYR 597           H        TYR 597  41.079  44.517  32.461
  343    HA   TYR 597           HA       TYR 597  38.340  43.389  32.250
  344    HB2  TYR 597           HB2      TYR 597  38.591  44.103  29.768
  345    HB3  TYR 597           HB3      TYR 597  38.065  45.278  30.914
  346    HD1  TYR 597           HD2      TYR 597  40.011  46.672  32.114
  347    HD2  TYR 597           HD1      TYR 597  40.296  44.898  28.191
  348    HE1  TYR 597           HE2      TYR 597  41.662  48.359  31.495
  349    HE2  TYR 597           HE1      TYR 597  41.880  46.711  27.512
  350    HH   TYR 597           HH       TYR 597  42.967  48.730  28.305
  351    H    GLU 598           H        GLU 598  37.990  41.625  31.133
  352    HA   GLU 598           HA       GLU 598  40.058  40.651  29.342
  353    HB2  GLU 598           HB2      GLU 598  39.958  38.332  30.207
  354    HB3  GLU 598           HB3      GLU 598  40.689  39.456  31.330
  355    HG2  GLU 598           HG2      GLU 598  38.364  39.527  32.499
  356    HG3  GLU 598           HG3      GLU 598  37.922  38.170  31.465
  357    H    GLU 599           H        GLU 599  39.199  38.550  28.379
  358    HA   GLU 599           HA       GLU 599  36.809  39.085  26.812
  359    HB2  GLU 599           HB2      GLU 599  38.815  36.859  27.125
  360    HB3  GLU 599           HB3      GLU 599  37.563  36.792  25.905
  361    HG2  GLU 599           HG2      GLU 599  39.840  38.824  26.138
  362    HG3  GLU 599           HG3      GLU 599  39.801  37.349  25.144
  363    H    VAL 600           H        VAL 600  34.844  38.324  27.280
  364    HA   VAL 600           HA       VAL 600  34.386  35.686  28.582
  365    HB   VAL 600           HB       VAL 600  32.910  38.288  29.207
  366   HG11  VAL 600          HG11      VAL 600  32.556  35.457  30.212
  367   HG12  VAL 600          HG12      VAL 600  31.919  36.849  31.111
  368   HG13  VAL 600          HG13      VAL 600  31.372  36.573  29.452
  369   HG21  VAL 600          HG21      VAL 600  35.171  38.265  30.302
  370   HG22  VAL 600          HG22      VAL 600  33.804  38.428  31.376
  371   HG23  VAL 600          HG23      VAL 600  34.614  36.851  31.252
  372    H    LEU 601           H        LEU 601  32.460  34.650  27.672
  373    HA   LEU 601           HA       LEU 601  31.624  35.325  25.036
  374    HB2  LEU 601           HB2      LEU 601  31.093  33.265  26.892
  375    HB3  LEU 601           HB3      LEU 601  29.523  34.036  26.665
  376    HG   LEU 601           HG       LEU 601  29.678  32.111  25.315
  377   HD11  LEU 601          HD11      LEU 601  29.330  32.877  23.068
  378   HD12  LEU 601          HD12      LEU 601  28.507  33.954  24.177
  379   HD13  LEU 601          HD13      LEU 601  30.093  34.446  23.467
  380   HD21  LEU 601          HD21      LEU 601  31.441  32.055  23.451
  381   HD22  LEU 601          HD22      LEU 601  32.324  33.302  24.361
  382   HD23  LEU 601          HD23      LEU 601  32.024  31.728  25.099
  383    H    LEU 602           H        LEU 602  30.089  36.390  24.053
  384    HA   LEU 602           HA       LEU 602  28.863  38.640  25.237
  385    HB2  LEU 602           HB2      LEU 602  27.979  37.050  22.763
  386    HB3  LEU 602           HB3      LEU 602  27.343  38.589  23.238
  387    HG   LEU 602           HG       LEU 602  30.376  38.359  22.904
  388   HD11  LEU 602          HD11      LEU 602  28.415  38.904  20.668
  389   HD12  LEU 602          HD12      LEU 602  30.217  39.035  20.607
  390   HD13  LEU 602          HD13      LEU 602  29.459  37.458  20.777
  391   HD21  LEU 602          HD21      LEU 602  29.307  40.348  23.860
  392   HD22  LEU 602          HD22      LEU 602  30.060  40.732  22.284
  393   HD23  LEU 602          HD23      LEU 602  28.302  40.519  22.382
  394    H    SER 603           H        SER 603  27.727  35.277  24.941
  395    HA   SER 603           HA       SER 603  25.104  35.671  26.036
  396    HB2  SER 603           HB2      SER 603  25.114  33.204  26.120
  397    HB3  SER 603           HB3      SER 603  25.833  33.802  24.614
  398    HG   SER 603           HG       SER 603  26.917  32.133  25.922
  399    H    ASN 604           H        ASN 604  28.137  35.948  27.604
  400    HA   ASN 604           HA       ASN 604  27.249  34.833  30.229
  401    HB2  ASN 604           HB2      ASN 604  29.871  35.173  28.765
  402    HB3  ASN 604           HB3      ASN 604  29.877  35.173  30.510
  403   HD21  ASN 604          HD22      ASN 604  27.939  33.135  28.171
  404   HD22  ASN 604          HD21      ASN 604  28.442  31.658  28.984
  405    H    ILE 605           H        ILE 605  27.172  37.727  28.687
  406    HA   ILE 605           HA       ILE 605  27.561  39.211  31.260
  407    HB   ILE 605           HB       ILE 605  27.644  40.420  28.496
  408   HG12  ILE 605          HG12      ILE 605  30.263  40.036  29.965
  409   HG13  ILE 605          HG13      ILE 605  29.671  38.665  29.048
  410   HG21  ILE 605          HG21      ILE 605  27.220  41.785  30.601
  411   HG22  ILE 605          HG22      ILE 605  28.921  41.515  31.009
  412   HG23  ILE 605          HG23      ILE 605  28.500  42.313  29.469
  413   HD11  ILE 605          HD11      ILE 605  30.445  41.377  27.986
  414   HD12  ILE 605          HD12      ILE 605  31.118  39.763  27.643
  415   HD13  ILE 605          HD13      ILE 605  29.523  40.210  27.017
  416    H    LYS 606           H        LYS 606  25.782  39.872  32.114
  417    HA   LYS 606           HA       LYS 606  23.334  40.348  30.470
  418    HB2  LYS 606           HB2      LYS 606  21.998  39.448  32.245
  419    HB3  LYS 606           HB3      LYS 606  23.333  38.388  31.993
  420    HG2  LYS 606           HG2      LYS 606  24.563  39.451  33.943
  421    HG3  LYS 606           HG3      LYS 606  23.100  40.345  34.340
  422    HD2  LYS 606           HD2      LYS 606  21.936  37.982  34.373
  423    HD3  LYS 606           HD3      LYS 606  23.556  37.358  34.219
  424    HE2  LYS 606           HE2      LYS 606  23.040  37.239  36.553
  425    HE3  LYS 606           HE3      LYS 606  24.176  38.564  36.389
  426    HZ1  LYS 606           HZ1      LYS 606  22.392  40.113  36.656
  427    HZ2  LYS 606           HZ2      LYS 606  21.248  38.967  36.537
  428    HZ3  LYS 606           HZ3      LYS 606  22.217  39.050  37.838
  429    HA   PRO 607           HA       PRO 607  23.325  44.574  31.646
  430    HB2  PRO 607           HB2      PRO 607  20.708  45.271  32.229
  431    HB3  PRO 607           HB3      PRO 607  21.265  44.938  30.559
  432    HG2  PRO 607           HG2      PRO 607  19.795  43.189  32.504
  433    HG3  PRO 607           HG3      PRO 607  19.586  43.299  30.719
  434    HD2  PRO 607           HD2      PRO 607  20.967  41.279  31.945
  435    HD3  PRO 607           HD3      PRO 607  21.283  41.893  30.281
  436    H    ILE 608           H        ILE 608  22.837  46.274  33.255
  437    HA   ILE 608           HA       ILE 608  22.848  45.346  36.065
  438    HB   ILE 608           HB       ILE 608  24.230  47.345  34.434
  439   HG12  ILE 608          HG12      ILE 608  24.545  46.401  37.268
  440   HG13  ILE 608          HG13      ILE 608  25.237  45.599  35.836
  441   HG21  ILE 608          HG21      ILE 608  23.141  48.524  37.016
  442   HG22  ILE 608          HG22      ILE 608  24.447  49.196  36.050
  443   HG23  ILE 608          HG23      ILE 608  22.844  49.095  35.336
  444   HD11  ILE 608          HD11      ILE 608  26.585  47.883  35.563
  445   HD12  ILE 608          HD12      ILE 608  26.178  48.085  37.261
  446   HD13  ILE 608          HD13      ILE 608  27.079  46.647  36.737
  447    H    LEU 609           H        LEU 609  20.774  46.636  33.811
  448    HA   LEU 609           HA       LEU 609  18.739  47.281  35.867
  449    HB2  LEU 609           HB2      LEU 609  18.302  49.378  35.375
  450    HB3  LEU 609           HB3      LEU 609  20.048  49.305  35.228
  451    HG   LEU 609           HG       LEU 609  18.037  49.267  32.958
  452   HD11  LEU 609          HD11      LEU 609  19.689  51.510  34.139
  453   HD12  LEU 609          HD12      LEU 609  18.852  51.650  32.569
  454   HD13  LEU 609          HD13      LEU 609  17.910  51.351  34.024
  455   HD21  LEU 609          HD21      LEU 609  21.092  49.379  33.089
  456   HD22  LEU 609          HD22      LEU 609  20.062  48.138  32.314
  457   HD23  LEU 609          HD23      LEU 609  20.208  49.734  31.583
  458    H    GLU 610           H        GLU 610  16.829  46.809  35.512
  459    HA   GLU 610           HA       GLU 610  15.890  45.220  33.267
  460    HB2  GLU 610           HB2      GLU 610  13.725  45.218  34.578
  461    HB3  GLU 610           HB3      GLU 610  15.097  44.506  35.394
  462    HG2  GLU 610           HG2      GLU 610  14.477  47.371  36.017
  463    HG3  GLU 610           HG3      GLU 610  13.404  46.124  36.629
  464    H1   TYR 611           H1       TYR 611  49.935  30.299  40.490
  465    H2   TYR 611           H2       TYR 611  48.367  29.815  40.351
  466    H3   TYR 611           H3       TYR 611  49.534  28.717  40.560
  467    HA   TYR 611           HA       TYR 611  48.014  29.457  42.447
  468    HB2  TYR 611           HB2      TYR 611  49.220  27.914  43.458
  469    HB3  TYR 611           HB3      TYR 611  50.398  28.035  42.180
  470    HD1  TYR 611           HD2      TYR 611  52.383  29.661  42.473
  471    HD2  TYR 611           HD1      TYR 611  49.692  28.694  45.715
  472    HE1  TYR 611           HE2      TYR 611  54.058  30.464  44.160
  473    HE2  TYR 611           HE1      TYR 611  51.501  29.169  47.347
  474    HH   TYR 611           HH       TYR 611  53.598  30.085  47.582
  475    H    SER 612           H        SER 612  47.919  30.824  44.265
  476    HA   SER 612           HA       SER 612  49.375  33.393  44.130
  477    HB2  SER 612           HB2      SER 612  46.372  33.237  44.177
  478    HB3  SER 612           HB3      SER 612  47.363  34.697  44.186
  479    HG   SER 612           HG       SER 612  46.728  34.092  42.125
  480    HA   PRO 613           HA       PRO 613  49.079  32.081  48.665
  481    HB2  PRO 613           HB2      PRO 613  51.397  33.326  49.429
  482    HB3  PRO 613           HB3      PRO 613  51.404  31.796  48.497
  483    HG2  PRO 613           HG2      PRO 613  51.512  34.650  47.443
  484    HG3  PRO 613           HG3      PRO 613  52.756  33.406  47.158
  485    HD2  PRO 613           HD2      PRO 613  50.899  33.721  45.318
  486    HD3  PRO 613           HD3      PRO 613  51.212  32.066  45.866
  487    H    SER 614           H        SER 614  49.491  35.327  47.264
  488    HA   SER 614           HA       SER 614  48.628  36.585  49.770
  489    HB2  SER 614           HB2      SER 614  49.320  37.916  47.124
  490    HB3  SER 614           HB3      SER 614  49.031  38.703  48.688
  491    HG   SER 614           HG       SER 614  51.216  38.171  48.021
  492    H    SER 615           H        SER 615  46.737  34.902  47.868
  493    HA   SER 615           HA       SER 615  44.626  35.106  46.972
  494    HB2  SER 615           HB2      SER 615  43.012  35.762  48.854
  495    HB3  SER 615           HB3      SER 615  44.284  34.595  49.280
  496    HG   SER 615           HG       SER 615  44.467  37.333  49.813
  497    HA   PRO 616           HA       PRO 616  44.706  39.345  45.249
  498    HB2  PRO 616           HB2      PRO 616  44.394  37.522  42.838
  499    HB3  PRO 616           HB3      PRO 616  45.097  39.161  42.911
  500    HG2  PRO 616           HG2      PRO 616  46.737  37.006  42.960
  501    HG3  PRO 616           HG3      PRO 616  47.006  38.297  44.176
  502    HD2  PRO 616           HD2      PRO 616  45.398  35.740  44.451
  503    HD3  PRO 616           HD3      PRO 616  46.693  36.331  45.543
  504   HC11  DA2 617          HC11      DA2 617  36.925  39.125  38.023
  505   HC12  DA2 617          HC12      DA2 617  35.713  39.956  39.034
  506   HC13  DA2 617          HC13      DA2 617  37.426  40.371  39.137
  507   HC21  DA2 617          HC21      DA2 617  34.727  38.471  40.131
  508   HC22  DA2 617          HC22      DA2 617  35.531  38.126  41.663
  509   HC23  DA2 617          HC23      DA2 617  35.524  36.907  40.392
  510    H2   DA2 617           H        DA2 617  42.810  40.468  44.297
  511    HA   DA2 617           HA       DA2 617  40.662  40.941  43.846
  512   HCB1  DA2 617          HCB1      DA2 617  39.181  39.292  42.885
  513   HCB2  DA2 617          HCB2      DA2 617  40.273  38.009  43.250
  514   HCG1  DA2 617          HCG1      DA2 617  40.893  40.382  41.368
  515   HCG2  DA2 617          HCG2      DA2 617  42.096  39.176  41.832
  516   HCD1  DA2 617          HCD1      DA2 617  41.227  38.335  39.815
  517   HCD2  DA2 617          HCD2      DA2 617  40.529  37.409  41.161
  518    HNE  DA2 617           HNE      DA2 617  39.116  39.463  39.471
  519   HNH2  DA2 617          HNH2      DA2 617  38.977  36.994  42.010
  520   HNH1  DA2 617          HNH1      DA2 617  37.241  36.919  42.006
  521    H    TYR 618           H        TYR 618  41.351  38.909  46.550
  522    HA   TYR 618           HA       TYR 618  38.513  38.717  47.376
  523    HB2  TYR 618           HB2      TYR 618  41.081  37.339  48.114
  524    HB3  TYR 618           HB3      TYR 618  39.592  37.097  49.020
  525    HD1  TYR 618           HD1      TYR 618  37.451  36.658  47.258
  526    HD2  TYR 618           HD2      TYR 618  41.571  35.656  46.539
  527    HE1  TYR 618           HE1      TYR 618  36.764  35.230  45.346
  528    HE2  TYR 618           HE2      TYR 618  40.880  34.146  44.689
  529    HH   TYR 618           HH       TYR 618  37.567  33.475  43.861
  530    H    THR 619           H        THR 619  37.813  39.710  49.402
  531    HA   THR 619           HA       THR 619  39.440  41.107  51.286
  532    HB   THR 619           HB       THR 619  39.985  42.491  49.429
  533    HG1  THR 619           HG1      THR 619  39.697  44.291  50.561
  534   HG21  THR 619          HG21      THR 619  38.502  44.182  48.535
  535   HG22  THR 619          HG22      THR 619  38.124  42.512  48.004
  536   HG23  THR 619          HG23      THR 619  37.074  43.360  49.150
  537    HA   PRO 620           HA       PRO 620  35.225  39.650  51.876
  538    HB2  PRO 620           HB2      PRO 620  35.690  37.996  54.082
  539    HB3  PRO 620           HB3      PRO 620  36.051  37.519  52.377
  540    HG2  PRO 620           HG2      PRO 620  37.917  38.787  54.387
  541    HG3  PRO 620           HG3      PRO 620  38.103  37.208  53.520
  542    HD2  PRO 620           HD2      PRO 620  39.241  39.371  52.408
  543    HD3  PRO 620           HD3      PRO 620  38.235  38.316  51.409
  544    H    GLN 621           H        GLN 621  33.720  39.640  53.940
  545    HA   GLN 621           HA       GLN 621  34.597  41.279  56.166
  546    HB2  GLN 621           HB2      GLN 621  32.631  42.807  56.040
  547    HB3  GLN 621           HB3      GLN 621  33.794  43.133  54.789
  548    HG2  GLN 621           HG2      GLN 621  31.057  41.754  54.618
  549    HG3  GLN 621           HG3      GLN 621  31.447  43.359  54.038
  550   HE21  GLN 621          HE22      GLN 621  33.099  43.494  52.238
  551   HE22  GLN 621          HE21      GLN 621  33.157  42.149  51.091
  552    H    SER 622           H        SER 622  33.084  41.208  57.996
  553    HA   SER 622           HA       SER 622  31.063  39.018  57.859
  554    HB2  SER 622           HB2      SER 622  32.991  37.884  58.747
  555    HB3  SER 622           HB3      SER 622  33.321  39.199  59.879
  556    HG   SER 622           HG       SER 622  32.178  37.497  60.760
  557    HA   PRO 623           HA       PRO 623  29.361  42.860  59.665
  558    HB2  PRO 623           HB2      PRO 623  26.738  42.473  59.076
  559    HB3  PRO 623           HB3      PRO 623  27.960  43.147  57.965
  560    HG2  PRO 623           HG2      PRO 623  26.881  40.345  58.045
  561    HG3  PRO 623           HG3      PRO 623  27.287  41.342  56.608
  562    HD2  PRO 623           HD2      PRO 623  28.882  39.373  57.630
  563    HD3  PRO 623           HD3      PRO 623  29.527  40.754  56.731
  Start of MODEL    8
    1    H1   MET 553           H1       MET 553  29.577  36.368  15.474
    2    H2   MET 553           H2       MET 553  28.717  34.956  15.588
    3    H3   MET 553           H3       MET 553  29.565  35.528  16.845
    4    HA   MET 553           HA       MET 553  27.415  37.096  15.662
    5    HB2  MET 553           HB2      MET 553  26.657  34.750  16.488
    6    HB3  MET 553           HB3      MET 553  26.898  35.400  18.103
    7    HG2  MET 553           HG2      MET 553  25.249  36.844  15.965
    8    HG3  MET 553           HG3      MET 553  24.525  35.681  17.015
    9    HE1  MET 553           HE1      MET 553  23.215  39.072  18.224
   10    HE2  MET 553           HE2      MET 553  23.796  38.583  16.592
   11    HE3  MET 553           HE3      MET 553  22.846  37.445  17.593
   12    H    LYS 554           H        LYS 554  27.854  39.149  16.382
   13    HA   LYS 554           HA       LYS 554  29.150  39.801  18.931
   14    HB2  LYS 554           HB2      LYS 554  30.822  39.007  17.170
   15    HB3  LYS 554           HB3      LYS 554  30.402  40.415  16.190
   16    HG2  LYS 554           HG2      LYS 554  31.260  41.873  17.993
   17    HG3  LYS 554           HG3      LYS 554  31.446  40.410  19.027
   18    HD2  LYS 554           HD2      LYS 554  33.562  41.345  18.232
   19    HD3  LYS 554           HD3      LYS 554  33.307  39.648  17.854
   20    HE2  LYS 554           HE2      LYS 554  32.652  40.263  15.548
   21    HE3  LYS 554           HE3      LYS 554  33.030  41.946  15.839
   22    HZ1  LYS 554           HZ1      LYS 554  34.893  39.675  15.924
   23    HZ2  LYS 554           HZ2      LYS 554  34.884  40.881  14.837
   24    HZ3  LYS 554           HZ3      LYS 554  35.345  41.156  16.403
   25    H    MET 555           H        MET 555  26.714  40.424  18.728
   26    HA   MET 555           HA       MET 555  26.240  42.978  17.443
   27    HB2  MET 555           HB2      MET 555  24.515  41.333  17.600
   28    HB3  MET 555           HB3      MET 555  24.586  41.287  19.361
   29    HG2  MET 555           HG2      MET 555  23.534  43.515  19.476
   30    HG3  MET 555           HG3      MET 555  23.661  43.715  17.747
   31    HE1  MET 555           HE1      MET 555  20.917  42.308  20.495
   32    HE2  MET 555           HE2      MET 555  21.247  40.612  20.056
   33    HE3  MET 555           HE3      MET 555  22.586  41.656  20.520
   34    H    TRP 556           H        TRP 556  27.703  41.958  20.347
   35    HA   TRP 556           HA       TRP 556  27.273  44.229  22.016
   36    HB2  TRP 556           HB2      TRP 556  29.353  42.050  21.807
   37    HB3  TRP 556           HB3      TRP 556  29.639  43.438  22.880
   38    HD1  TRP 556           HD1      TRP 556  28.551  40.118  23.264
   39    HE1  TRP 556           HE1      TRP 556  27.507  39.903  25.597
   40    HE3  TRP 556           HE3      TRP 556  27.167  44.995  23.998
   41    HZ2  TRP 556           HZ2      TRP 556  26.061  41.543  27.419
   42    HZ3  TRP 556           HZ3      TRP 556  25.673  45.560  25.871
   43    HH2  TRP 556           HH2      TRP 556  25.074  43.840  27.576
   44    H    LYS 557           H        LYS 557  29.116  45.702  22.729
   45    HA   LYS 557           HA       LYS 557  30.857  46.835  20.696
   46    HB2  LYS 557           HB2      LYS 557  29.709  48.967  20.462
   47    HB3  LYS 557           HB3      LYS 557  28.735  47.627  19.826
   48    HG2  LYS 557           HG2      LYS 557  27.387  47.611  21.848
   49    HG3  LYS 557           HG3      LYS 557  28.358  48.984  22.482
   50    HD2  LYS 557           HD2      LYS 557  27.583  50.203  20.291
   51    HD3  LYS 557           HD3      LYS 557  26.475  48.820  20.090
   52    HE2  LYS 557           HE2      LYS 557  26.677  50.354  22.686
   53    HE3  LYS 557           HE3      LYS 557  25.601  50.902  21.400
   54    HZ1  LYS 557           HZ1      LYS 557  24.444  49.472  22.935
   55    HZ2  LYS 557           HZ2      LYS 557  24.527  48.692  21.520
   56    HZ3  LYS 557           HZ3      LYS 557  25.501  48.263  22.759
   57    HA   PRO 558           HA       PRO 558  32.955  48.282  24.440
   58    HB2  PRO 558           HB2      PRO 558  34.144  50.501  23.545
   59    HB3  PRO 558           HB3      PRO 558  34.642  48.845  23.085
   60    HG2  PRO 558           HG2      PRO 558  32.873  50.626  21.417
   61    HG3  PRO 558           HG3      PRO 558  34.348  49.666  20.940
   62    HD2  PRO 558           HD2      PRO 558  31.973  48.660  20.486
   63    HD3  PRO 558           HD3      PRO 558  33.248  47.640  21.189
   64    H    GLY 559           H        GLY 559  32.912  50.109  26.070
   65    HA2  GLY 559           HA2      GLY 559  31.913  51.683  27.369
   66    HA3  GLY 559           HA3      GLY 559  31.248  52.468  25.926
   67    H    ASP 560           H        ASP 560  30.770  49.472  27.829
   68    HA   ASP 560           HA       ASP 560  28.080  50.428  28.564
   69    HB2  ASP 560           HB2      ASP 560  28.097  49.016  26.321
   70    HB3  ASP 560           HB3      ASP 560  28.166  47.636  27.414
   71    H    GLU 561           H        GLU 561  28.187  50.395  30.738
   72    HA   GLU 561           HA       GLU 561  29.352  48.215  32.114
   73    HB2  GLU 561           HB2      GLU 561  27.936  48.677  34.049
   74    HB3  GLU 561           HB3      GLU 561  28.856  50.045  33.494
   75    HG2  GLU 561           HG2      GLU 561  25.869  49.629  32.933
   76    HG3  GLU 561           HG3      GLU 561  26.522  50.589  34.251
   77    H    CYS 562           H        CYS 562  28.818  46.111  32.160
   78    HA   CYS 562           HA       CYS 562  26.064  45.122  31.709
   79    HB2  CYS 562           HB2      CYS 562  28.544  44.095  30.278
   80    HB3  CYS 562           HB3      CYS 562  26.894  43.461  30.115
   81    HG   CYS 562           HG       CYS 562  28.192  46.290  29.251
   82    H    PHE 563           H        PHE 563  26.528  42.478  31.906
   83    HA   PHE 563           HA       PHE 563  27.931  42.016  34.499
   84    HB2  PHE 563           HB2      PHE 563  25.236  41.221  33.445
   85    HB3  PHE 563           HB3      PHE 563  26.156  39.980  34.250
   86    HD1  PHE 563           HD1      PHE 563  27.342  41.025  36.624
   87    HD2  PHE 563           HD2      PHE 563  23.649  42.296  34.796
   88    HE1  PHE 563           HE1      PHE 563  26.575  42.008  38.787
   89    HE2  PHE 563           HE2      PHE 563  23.069  43.531  36.872
   90    HZ   PHE 563           HZ       PHE 563  24.400  43.154  38.930
   91    H    ALA 564           H        ALA 564  29.709  40.801  34.189
   92    HA   ALA 564           HA       ALA 564  29.831  39.132  31.718
   93    HB1  ALA 564           HB1      ALA 564  32.206  39.405  31.803
   94    HB2  ALA 564           HB2      ALA 564  31.357  40.960  31.700
   95    HB3  ALA 564           HB3      ALA 564  32.082  40.436  33.247
   96    H    LEU 565           H        LEU 565  30.037  36.971  31.959
   97    HA   LEU 565           HA       LEU 565  29.954  35.615  34.468
   98    HB2  LEU 565           HB2      LEU 565  29.032  34.926  32.172
   99    HB3  LEU 565           HB3      LEU 565  30.685  34.637  31.703
  100    HG   LEU 565           HG       LEU 565  30.868  32.801  33.437
  101   HD11  LEU 565          HD11      LEU 565  29.158  33.333  35.065
  102   HD12  LEU 565          HD12      LEU 565  27.902  33.365  33.804
  103   HD13  LEU 565          HD13      LEU 565  28.719  31.838  34.241
  104   HD21  LEU 565          HD21      LEU 565  28.826  32.636  31.212
  105   HD22  LEU 565          HD22      LEU 565  30.517  32.061  31.268
  106   HD23  LEU 565          HD23      LEU 565  29.291  31.226  32.189
  107    H    TYR 566           H        TYR 566  31.586  35.386  35.753
  108    HA   TYR 566           HA       TYR 566  34.383  35.261  35.136
  109    HB2  TYR 566           HB2      TYR 566  33.216  36.135  37.242
  110    HB3  TYR 566           HB3      TYR 566  33.009  34.448  37.733
  111    HD1  TYR 566           HD1      TYR 566  35.903  36.228  36.090
  112    HD2  TYR 566           HD2      TYR 566  34.410  34.121  39.543
  113    HE1  TYR 566           HE1      TYR 566  38.086  36.528  37.211
  114    HE2  TYR 566           HE2      TYR 566  36.628  34.354  40.635
  115    HH   TYR 566           HH       TYR 566  39.342  35.878  39.056
  116    H    TRP 567           H        TRP 567  35.405  33.266  36.690
  117    HA   TRP 567           HA       TRP 567  34.575  30.793  35.165
  118    HB2  TRP 567           HB2      TRP 567  36.880  30.262  34.855
  119    HB3  TRP 567           HB3      TRP 567  36.609  31.906  34.241
  120    HD1  TRP 567           HD1      TRP 567  38.025  33.832  35.412
  121    HE1  TRP 567           HE1      TRP 567  39.659  33.898  37.419
  122    HE3  TRP 567           HE3      TRP 567  37.862  28.904  36.810
  123    HZ2  TRP 567           HZ2      TRP 567  40.820  32.117  39.184
  124    HZ3  TRP 567           HZ3      TRP 567  39.291  28.097  38.677
  125    HH2  TRP 567           HH2      TRP 567  40.850  29.645  39.811
  126    H    GLU 568           H        GLU 568  36.147  31.935  38.088
  127    HA   GLU 568           HA       GLU 568  36.634  29.561  39.533
  128    HB2  GLU 568           HB2      GLU 568  37.447  31.565  40.392
  129    HB3  GLU 568           HB3      GLU 568  35.916  32.403  40.102
  130    HG2  GLU 568           HG2      GLU 568  34.861  31.523  42.016
  131    HG3  GLU 568           HG3      GLU 568  36.061  30.291  42.275
  132    H    ASP 569           H        ASP 569  33.657  31.435  39.422
  133    HA   ASP 569           HA       ASP 569  32.291  29.042  40.493
  134    HB2  ASP 569           HB2      ASP 569  30.651  30.460  41.570
  135    HB3  ASP 569           HB3      ASP 569  32.240  30.621  42.286
  136    H    ASN 570           H        ASN 570  32.575  30.807  37.738
  137    HA   ASN 570           HA       ASN 570  31.280  31.080  35.859
  138    HB2  ASN 570           HB2      ASN 570  31.405  28.576  36.254
  139    HB3  ASN 570           HB3      ASN 570  29.708  28.659  36.757
  140   HD21  ASN 570          HD22      ASN 570  32.009  29.045  34.139
  141   HD22  ASN 570          HD21      ASN 570  30.817  28.718  32.875
  142    H    LYS 571           H        LYS 571  30.598  32.693  38.046
  143    HA   LYS 571           HA       LYS 571  27.719  33.279  37.568
  144    HB2  LYS 571           HB2      LYS 571  29.518  33.468  40.015
  145    HB3  LYS 571           HB3      LYS 571  28.439  34.820  39.797
  146    HG2  LYS 571           HG2      LYS 571  27.471  31.960  39.779
  147    HG3  LYS 571           HG3      LYS 571  27.598  32.992  41.236
  148    HD2  LYS 571           HD2      LYS 571  26.088  34.610  40.385
  149    HD3  LYS 571           HD3      LYS 571  26.033  33.915  38.782
  150    HE2  LYS 571           HE2      LYS 571  25.246  32.474  41.351
  151    HE3  LYS 571           HE3      LYS 571  24.088  33.485  40.473
  152    HZ1  LYS 571           HZ1      LYS 571  23.760  31.193  39.937
  153    HZ2  LYS 571           HZ2      LYS 571  24.359  31.907  38.594
  154    HZ3  LYS 571           HZ3      LYS 571  25.283  30.940  39.531
  155    H    PHE 572           H        PHE 572  27.183  35.738  37.790
  156    HA   PHE 572           HA       PHE 572  29.096  37.032  35.935
  157    HB2  PHE 572           HB2      PHE 572  26.157  37.708  36.391
  158    HB3  PHE 572           HB3      PHE 572  27.260  38.459  35.256
  159    HD1  PHE 572           HD1      PHE 572  25.498  35.242  35.970
  160    HD2  PHE 572           HD2      PHE 572  27.563  37.667  33.035
  161    HE1  PHE 572           HE1      PHE 572  24.841  33.667  34.155
  162    HE2  PHE 572           HE2      PHE 572  26.665  36.249  31.247
  163    HZ   PHE 572           HZ       PHE 572  25.463  34.143  31.817
  164    H    TYR 573           H        TYR 573  29.964  38.953  36.346
  165    HA   TYR 573           HA       TYR 573  29.289  40.342  38.914
  166    HB2  TYR 573           HB2      TYR 573  31.989  39.789  37.656
  167    HB3  TYR 573           HB3      TYR 573  31.640  40.762  39.107
  168    HD1  TYR 573           HD2      TYR 573  31.331  37.179  37.829
  169    HD2  TYR 573           HD1      TYR 573  31.513  39.917  41.145
  170    HE1  TYR 573           HE2      TYR 573  31.641  35.270  39.392
  171    HE2  TYR 573           HE1      TYR 573  31.845  38.018  42.708
  172    HH   TYR 573           HH       TYR 573  32.178  34.686  41.549
  173    H    ARG 574           H        ARG 574  29.300  42.585  38.766
  174    HA   ARG 574           HA       ARG 574  28.547  43.916  36.370
  175    HB2  ARG 574           HB2      ARG 574  29.744  44.994  38.939
  176    HB3  ARG 574           HB3      ARG 574  29.181  46.011  37.573
  177    HG2  ARG 574           HG2      ARG 574  26.963  45.127  37.747
  178    HG3  ARG 574           HG3      ARG 574  27.428  44.131  39.134
  179    HD2  ARG 574           HD2      ARG 574  28.176  46.549  40.166
  180    HD3  ARG 574           HD3      ARG 574  27.125  47.156  38.918
  181    HE   ARG 574           HE       ARG 574  25.250  46.163  40.028
  182   HH11  ARG 574          HH11      ARG 574  28.298  45.605  41.720
  183   HH12  ARG 574          HH12      ARG 574  27.487  45.112  43.195
  184   HH21  ARG 574          HH21      ARG 574  24.290  45.624  42.060
  185   HH22  ARG 574          HH22      ARG 574  25.353  45.123  43.339
  186    H    ALA 575           H        ALA 575  29.779  44.562  34.625
  187    HA   ALA 575           HA       ALA 575  32.557  45.377  35.084
  188    HB1  ALA 575           HB1      ALA 575  31.920  43.169  33.053
  189    HB2  ALA 575           HB2      ALA 575  33.527  43.825  33.439
  190    HB3  ALA 575           HB3      ALA 575  32.645  42.906  34.640
  191    H    GLU 576           H        GLU 576  33.122  47.117  33.896
  192    HA   GLU 576           HA       GLU 576  31.359  48.238  31.827
  193    HB2  GLU 576           HB2      GLU 576  33.836  49.243  33.270
  194    HB3  GLU 576           HB3      GLU 576  33.343  49.914  31.706
  195    HG2  GLU 576           HG2      GLU 576  31.084  50.378  32.696
  196    HG3  GLU 576           HG3      GLU 576  31.764  50.012  34.289
  197    H    VAL 577           H        VAL 577  31.325  46.979  30.191
  198    HA   VAL 577           HA       VAL 577  33.065  45.704  28.565
  199    HB   VAL 577           HB       VAL 577  30.733  47.539  27.851
  200   HG11  VAL 577          HG11      VAL 577  32.687  46.310  26.009
  201   HG12  VAL 577          HG12      VAL 577  30.934  46.254  25.627
  202   HG13  VAL 577          HG13      VAL 577  31.718  47.812  25.946
  203   HG21  VAL 577          HG21      VAL 577  30.218  45.422  28.975
  204   HG22  VAL 577          HG22      VAL 577  29.689  45.444  27.274
  205   HG23  VAL 577          HG23      VAL 577  31.158  44.536  27.747
  206    H    GLU 578           H        GLU 578  35.006  46.137  27.723
  207    HA   GLU 578           HA       GLU 578  35.955  48.944  27.436
  208    HB2  GLU 578           HB2      GLU 578  37.399  47.879  28.946
  209    HB3  GLU 578           HB3      GLU 578  37.310  46.355  28.143
  210    HG2  GLU 578           HG2      GLU 578  39.569  47.282  27.566
  211    HG3  GLU 578           HG3      GLU 578  38.621  47.433  26.160
  212    H    ALA 579           H        ALA 579  35.997  45.789  25.680
  213    HA   ALA 579           HA       ALA 579  35.707  47.106  23.093
  214    HB1  ALA 579           HB1      ALA 579  37.882  46.352  22.195
  215    HB2  ALA 579           HB2      ALA 579  38.168  47.355  23.635
  216    HB3  ALA 579           HB3      ALA 579  38.266  45.597  23.773
  217    H    LEU 580           H        LEU 580  34.129  45.900  22.275
  218    HA   LEU 580           HA       LEU 580  34.311  42.927  22.517
  219    HB2  LEU 580           HB2      LEU 580  31.712  44.381  22.301
  220    HB3  LEU 580           HB3      LEU 580  32.036  42.695  22.677
  221    HG   LEU 580           HG       LEU 580  32.047  45.169  24.255
  222   HD11  LEU 580          HD11      LEU 580  30.868  42.428  24.594
  223   HD12  LEU 580          HD12      LEU 580  31.148  43.316  26.084
  224   HD13  LEU 580          HD13      LEU 580  30.154  44.044  24.853
  225   HD21  LEU 580          HD21      LEU 580  34.163  43.198  24.866
  226   HD22  LEU 580          HD22      LEU 580  34.027  44.921  25.192
  227   HD23  LEU 580          HD23      LEU 580  33.217  43.806  26.261
  228    H    HIS 581           H        HIS 581  35.634  43.626  20.478
  229    HA   HIS 581           HA       HIS 581  34.152  43.350  17.966
  230    HB2  HIS 581           HB2      HIS 581  34.763  45.467  16.963
  231    HB3  HIS 581           HB3      HIS 581  33.608  45.627  18.269
  232    HD2  HIS 581           HD2      HIS 581  36.231  47.505  16.926
  233    HE1  HIS 581           HE1      HIS 581  36.886  48.062  21.096
  234    HE2  HIS 581           HE2      HIS 581  37.295  49.040  18.763
  235    H    SER 582           H        SER 582  37.249  44.357  19.487
  236    HA   SER 582           HA       SER 582  38.936  43.891  17.317
  237    HB2  SER 582           HB2      SER 582  39.423  43.762  20.297
  238    HB3  SER 582           HB3      SER 582  40.704  43.903  19.073
  239    HG   SER 582           HG       SER 582  40.047  46.026  19.636
  240    H    SER 583           H        SER 583  37.279  41.281  18.673
  241    HA   SER 583           HA       SER 583  39.469  39.433  17.883
  242    HB2  SER 583           HB2      SER 583  37.997  39.189  20.498
  243    HB3  SER 583           HB3      SER 583  39.163  38.020  19.792
  244    HG   SER 583           HG       SER 583  39.715  40.611  20.672
  245    H    GLY 584           H        GLY 584  38.715  37.019  17.852
  246    HA2  GLY 584           HA2      GLY 584  36.616  36.777  15.939
  247    HA3  GLY 584           HA3      GLY 584  37.566  35.449  16.647
  248    H    MET 585           H        MET 585  36.667  35.746  19.371
  249    HA   MET 585           HA       MET 585  33.736  35.614  19.209
  250    HB2  MET 585           HB2      MET 585  33.483  33.421  20.156
  251    HB3  MET 585           HB3      MET 585  34.199  33.382  18.546
  252    HG2  MET 585           HG2      MET 585  35.472  33.004  21.268
  253    HG3  MET 585           HG3      MET 585  35.009  31.706  20.175
  254    HE1  MET 585           HE1      MET 585  37.486  33.077  21.913
  255    HE2  MET 585           HE2      MET 585  37.930  31.417  21.506
  256    HE3  MET 585           HE3      MET 585  39.013  32.773  21.082
  257    H    THR 586           H        THR 586  36.371  36.505  20.990
  258    HA   THR 586           HA       THR 586  34.886  36.607  23.593
  259    HB   THR 586           HB       THR 586  37.105  37.080  24.598
  260    HG1  THR 586           HG1      THR 586  38.841  36.809  23.324
  261   HG21  THR 586          HG21      THR 586  36.392  34.669  24.691
  262   HG22  THR 586          HG22      THR 586  36.897  34.466  23.028
  263   HG23  THR 586          HG23      THR 586  38.095  34.780  24.321
  264    H    ALA 587           H        ALA 587  35.561  38.559  24.868
  265    HA   ALA 587           HA       ALA 587  35.463  41.198  23.571
  266    HB1  ALA 587           HB1      ALA 587  33.129  39.700  24.786
  267    HB2  ALA 587           HB2      ALA 587  33.275  41.356  25.247
  268    HB3  ALA 587           HB3      ALA 587  33.165  40.990  23.516
  269    H    VAL 588           H        VAL 588  36.230  42.670  24.906
  270    HA   VAL 588           HA       VAL 588  37.495  41.870  27.470
  271    HB   VAL 588           HB       VAL 588  37.910  44.517  26.025
  272   HG11  VAL 588          HG11      VAL 588  38.683  44.355  28.331
  273   HG12  VAL 588          HG12      VAL 588  39.756  43.007  27.864
  274   HG13  VAL 588          HG13      VAL 588  39.949  44.634  27.156
  275   HG21  VAL 588          HG21      VAL 588  38.379  42.764  24.337
  276   HG22  VAL 588          HG22      VAL 588  39.949  43.250  24.948
  277   HG23  VAL 588          HG23      VAL 588  39.177  41.772  25.564
  278    H    VAL 589           H        VAL 589  36.840  42.582  29.382
  279    HA   VAL 589           HA       VAL 589  35.017  44.913  29.658
  280    HB   VAL 589           HB       VAL 589  33.560  43.759  31.119
  281   HG11  VAL 589          HG11      VAL 589  33.555  41.954  28.660
  282   HG12  VAL 589          HG12      VAL 589  32.199  42.724  29.459
  283   HG13  VAL 589          HG13      VAL 589  33.310  43.675  28.475
  284   HG21  VAL 589          HG21      VAL 589  34.818  41.954  32.158
  285   HG22  VAL 589          HG22      VAL 589  33.564  41.144  31.242
  286   HG23  VAL 589          HG23      VAL 589  35.187  41.227  30.585
  287    H    LYS 590           H        LYS 590  35.497  46.195  31.452
  288    HA   LYS 590           HA       LYS 590  37.531  45.355  33.430
  289    HB2  LYS 590           HB2      LYS 590  37.792  47.559  32.277
  290    HB3  LYS 590           HB3      LYS 590  36.199  48.042  32.899
  291    HG2  LYS 590           HG2      LYS 590  36.928  48.198  35.133
  292    HG3  LYS 590           HG3      LYS 590  38.512  47.455  34.764
  293    HD2  LYS 590           HD2      LYS 590  39.267  49.276  33.594
  294    HD3  LYS 590           HD3      LYS 590  37.669  50.036  33.429
  295    HE2  LYS 590           HE2      LYS 590  38.817  49.559  36.183
  296    HE3  LYS 590           HE3      LYS 590  39.559  50.797  35.170
  297    HZ1  LYS 590           HZ1      LYS 590  37.863  51.772  36.554
  298    HZ2  LYS 590           HZ2      LYS 590  37.450  51.892  34.975
  299    HZ3  LYS 590           HZ3      LYS 590  36.685  50.841  35.896
  300    H    PHE 591           H        PHE 591  36.771  44.328  35.121
  301    HA   PHE 591           HA       PHE 591  34.268  44.467  36.359
  302    HB2  PHE 591           HB2      PHE 591  37.054  43.806  37.341
  303    HB3  PHE 591           HB3      PHE 591  35.561  43.411  38.239
  304    HD1  PHE 591           HD2      PHE 591  33.760  42.013  37.069
  305    HD2  PHE 591           HD1      PHE 591  37.864  42.147  35.784
  306    HE1  PHE 591           HE2      PHE 591  33.311  40.166  35.532
  307    HE2  PHE 591           HE1      PHE 591  37.414  40.244  34.223
  308    HZ   PHE 591           HZ       PHE 591  35.091  39.395  33.945
  309    H    ILE 592           H        ILE 592  33.256  45.837  37.450
  310    HA   ILE 592           HA       ILE 592  34.208  48.539  37.613
  311    HB   ILE 592           HB       ILE 592  31.551  47.854  38.804
  312   HG12  ILE 592          HG12      ILE 592  32.313  47.853  35.882
  313   HG13  ILE 592          HG13      ILE 592  31.572  46.502  36.830
  314   HG21  ILE 592          HG21      ILE 592  32.656  50.070  36.985
  315   HG22  ILE 592          HG22      ILE 592  30.992  50.008  37.562
  316   HG23  ILE 592          HG23      ILE 592  32.289  50.263  38.716
  317   HD11  ILE 592          HD11      ILE 592  30.409  48.994  35.640
  318   HD12  ILE 592          HD12      ILE 592  29.952  47.310  35.338
  319   HD13  ILE 592          HD13      ILE 592  29.480  48.077  36.871
  320    H    ASP 593           H        ASP 593  34.037  46.021  40.041
  321    HA   ASP 593           HA       ASP 593  34.848  47.967  42.125
  322    HB2  ASP 593           HB2      ASP 593  33.652  46.795  43.799
  323    HB3  ASP 593           HB3      ASP 593  32.601  47.185  42.453
  324    H    TYR 594           H        TYR 594  36.279  46.147  40.206
  325    HA   TYR 594           HA       TYR 594  38.465  45.486  42.157
  326    HB2  TYR 594           HB2      TYR 594  38.004  43.783  39.750
  327    HB3  TYR 594           HB3      TYR 594  39.147  43.573  41.072
  328    HD1  TYR 594           HD1      TYR 594  35.526  43.542  40.243
  329    HD2  TYR 594           HD2      TYR 594  38.519  42.328  43.108
  330    HE1  TYR 594           HE1      TYR 594  33.911  42.055  41.264
  331    HE2  TYR 594           HE2      TYR 594  36.935  40.665  44.041
  332    HH   TYR 594           HH       TYR 594  33.579  40.484  43.079
  333    H    GLY 595           H        GLY 595  37.544  46.975  39.211
  334    HA2  GLY 595           HA2      GLY 595  38.412  48.686  38.153
  335    HA3  GLY 595           HA3      GLY 595  39.860  48.681  39.136
  336    H    ASN 596           H        ASN 596  39.401  45.716  37.287
  337    HA   ASN 596           HA       ASN 596  41.208  46.770  35.141
  338    HB2  ASN 596           HB2      ASN 596  42.761  45.036  35.387
  339    HB3  ASN 596           HB3      ASN 596  42.622  45.752  36.997
  340   HD21  ASN 596          HD22      ASN 596  41.384  44.627  38.677
  341   HD22  ASN 596          HD21      ASN 596  41.195  42.888  38.487
  342    H    TYR 597           H        TYR 597  41.471  45.176  33.318
  343    HA   TYR 597           HA       TYR 597  38.966  43.649  32.937
  344    HB2  TYR 597           HB2      TYR 597  39.372  44.264  30.430
  345    HB3  TYR 597           HB3      TYR 597  38.542  45.362  31.498
  346    HD1  TYR 597           HD2      TYR 597  40.138  47.122  32.746
  347    HD2  TYR 597           HD1      TYR 597  40.956  45.280  28.926
  348    HE1  TYR 597           HE2      TYR 597  41.714  48.955  32.196
  349    HE2  TYR 597           HE1      TYR 597  42.468  47.123  28.360
  350    HH   TYR 597           HH       TYR 597  43.621  48.927  29.171
  351    H    GLU 598           H        GLU 598  38.821  42.098  31.465
  352    HA   GLU 598           HA       GLU 598  41.046  40.937  29.985
  353    HB2  GLU 598           HB2      GLU 598  40.420  38.595  30.928
  354    HB3  GLU 598           HB3      GLU 598  41.585  39.604  31.756
  355    HG2  GLU 598           HG2      GLU 598  39.953  40.253  33.450
  356    HG3  GLU 598           HG3      GLU 598  38.642  39.428  32.598
  357    H    GLU 599           H        GLU 599  40.342  39.100  28.634
  358    HA   GLU 599           HA       GLU 599  37.755  39.600  27.441
  359    HB2  GLU 599           HB2      GLU 599  38.465  38.475  25.670
  360    HB3  GLU 599           HB3      GLU 599  40.013  38.979  26.346
  361    HG2  GLU 599           HG2      GLU 599  39.973  36.601  27.505
  362    HG3  GLU 599           HG3      GLU 599  38.764  36.224  26.292
  363    H    VAL 600           H        VAL 600  36.147  38.341  27.209
  364    HA   VAL 600           HA       VAL 600  35.647  35.847  28.673
  365    HB   VAL 600           HB       VAL 600  33.864  38.339  28.905
  366   HG11  VAL 600          HG11      VAL 600  33.572  35.689  30.373
  367   HG12  VAL 600          HG12      VAL 600  32.651  37.180  30.607
  368   HG13  VAL 600          HG13      VAL 600  32.574  36.340  29.039
  369   HG21  VAL 600          HG21      VAL 600  35.597  37.182  31.106
  370   HG22  VAL 600          HG22      VAL 600  35.872  38.731  30.256
  371   HG23  VAL 600          HG23      VAL 600  34.455  38.544  31.259
  372    H    LEU 601           H        LEU 601  33.941  34.677  27.533
  373    HA   LEU 601           HA       LEU 601  33.792  35.209  24.747
  374    HB2  LEU 601           HB2      LEU 601  33.472  33.018  25.979
  375    HB3  LEU 601           HB3      LEU 601  31.843  33.579  26.395
  376    HG   LEU 601           HG       LEU 601  31.918  34.086  23.673
  377   HD11  LEU 601          HD11      LEU 601  33.073  32.310  22.503
  378   HD12  LEU 601          HD12      LEU 601  34.217  33.093  23.577
  379   HD13  LEU 601          HD13      LEU 601  33.547  31.546  24.052
  380   HD21  LEU 601          HD21      LEU 601  30.389  32.455  23.340
  381   HD22  LEU 601          HD22      LEU 601  30.970  31.394  24.659
  382   HD23  LEU 601          HD23      LEU 601  30.146  32.893  25.034
  383    H    LEU 602           H        LEU 602  32.248  36.283  23.539
  384    HA   LEU 602           HA       LEU 602  30.710  38.399  24.499
  385    HB2  LEU 602           HB2      LEU 602  30.091  36.652  22.120
  386    HB3  LEU 602           HB3      LEU 602  29.372  38.220  22.432
  387    HG   LEU 602           HG       LEU 602  32.391  38.087  22.349
  388   HD11  LEU 602          HD11      LEU 602  30.575  38.252  19.910
  389   HD12  LEU 602          HD12      LEU 602  32.364  38.303  19.915
  390   HD13  LEU 602          HD13      LEU 602  31.500  36.812  20.330
  391   HD21  LEU 602          HD21      LEU 602  30.965  40.186  22.890
  392   HD22  LEU 602          HD22      LEU 602  32.139  40.375  21.561
  393   HD23  LEU 602          HD23      LEU 602  30.442  40.124  21.190
  394    H    SER 603           H        SER 603  29.307  35.132  23.614
  395    HA   SER 603           HA       SER 603  26.745  35.539  24.674
  396    HB2  SER 603           HB2      SER 603  27.975  32.813  24.469
  397    HB3  SER 603           HB3      SER 603  26.314  33.351  24.228
  398    HG   SER 603           HG       SER 603  27.498  33.059  22.267
  399    H    ASN 604           H        ASN 604  29.379  35.686  26.568
  400    HA   ASN 604           HA       ASN 604  28.297  34.416  29.067
  401    HB2  ASN 604           HB2      ASN 604  31.193  34.611  28.198
  402    HB3  ASN 604           HB3      ASN 604  30.544  34.179  29.759
  403   HD21  ASN 604          HD22      ASN 604  32.202  32.354  28.757
  404   HD22  ASN 604          HD21      ASN 604  31.262  30.903  28.466
  405    H    ILE 605           H        ILE 605  28.439  37.269  27.505
  406    HA   ILE 605           HA       ILE 605  28.501  38.772  30.091
  407    HB   ILE 605           HB       ILE 605  28.753  40.032  27.368
  408   HG12  ILE 605          HG12      ILE 605  31.142  39.353  29.148
  409   HG13  ILE 605          HG13      ILE 605  30.738  38.355  27.764
  410   HG21  ILE 605          HG21      ILE 605  28.125  41.377  29.391
  411   HG22  ILE 605          HG22      ILE 605  29.767  41.095  30.022
  412   HG23  ILE 605          HG23      ILE 605  29.531  41.946  28.477
  413   HD11  ILE 605          HD11      ILE 605  32.477  39.905  27.181
  414   HD12  ILE 605          HD12      ILE 605  31.020  40.169  26.204
  415   HD13  ILE 605          HD13      ILE 605  31.403  41.291  27.528
  416    H    LYS 606           H        LYS 606  26.598  39.325  30.704
  417    HA   LYS 606           HA       LYS 606  24.191  39.342  28.938
  418    HB2  LYS 606           HB2      LYS 606  24.266  37.655  30.786
  419    HB3  LYS 606           HB3      LYS 606  24.630  38.925  31.937
  420    HG2  LYS 606           HG2      LYS 606  22.244  39.823  31.345
  421    HG3  LYS 606           HG3      LYS 606  22.029  38.259  30.529
  422    HD2  LYS 606           HD2      LYS 606  22.787  37.230  32.843
  423    HD3  LYS 606           HD3      LYS 606  22.598  38.904  33.406
  424    HE2  LYS 606           HE2      LYS 606  20.242  38.627  32.111
  425    HE3  LYS 606           HE3      LYS 606  20.574  36.915  32.273
  426    HZ1  LYS 606           HZ1      LYS 606  20.427  37.089  34.630
  427    HZ2  LYS 606           HZ2      LYS 606  20.527  38.740  34.590
  428    HZ3  LYS 606           HZ3      LYS 606  19.208  38.013  34.043
  429    HA   PRO 607           HA       PRO 607  23.833  43.748  29.745
  430    HB2  PRO 607           HB2      PRO 607  21.219  44.258  29.721
  431    HB3  PRO 607           HB3      PRO 607  22.149  43.848  28.249
  432    HG2  PRO 607           HG2      PRO 607  20.446  41.945  29.825
  433    HG3  PRO 607           HG3      PRO 607  20.529  42.223  28.048
  434    HD2  PRO 607           HD2      PRO 607  21.935  40.176  29.188
  435    HD3  PRO 607           HD3      PRO 607  22.653  41.132  27.876
  436    H    ILE 608           H        ILE 608  22.931  45.272  31.284
  437    HA   ILE 608           HA       ILE 608  22.879  44.281  34.076
  438    HB   ILE 608           HB       ILE 608  24.371  46.205  32.673
  439   HG12  ILE 608          HG12      ILE 608  24.199  45.595  35.646
  440   HG13  ILE 608          HG13      ILE 608  25.110  44.740  34.400
  441   HG21  ILE 608          HG21      ILE 608  22.818  47.772  34.708
  442   HG22  ILE 608          HG22      ILE 608  24.134  48.291  33.609
  443   HG23  ILE 608          HG23      ILE 608  22.567  47.833  32.948
  444   HD11  ILE 608          HD11      ILE 608  26.594  46.180  35.765
  445   HD12  ILE 608          HD12      ILE 608  26.607  46.555  34.046
  446   HD13  ILE 608          HD13      ILE 608  25.749  47.624  35.180
  447    H    LEU 609           H        LEU 609  20.678  45.564  31.816
  448    HA   LEU 609           HA       LEU 609  18.625  45.740  33.860
  449    HB2  LEU 609           HB2      LEU 609  19.813  48.068  33.726
  450    HB3  LEU 609           HB3      LEU 609  19.182  48.191  32.116
  451    HG   LEU 609           HG       LEU 609  16.851  48.151  33.019
  452   HD11  LEU 609          HD11      LEU 609  18.323  47.885  35.698
  453   HD12  LEU 609          HD12      LEU 609  16.686  48.518  35.628
  454   HD13  LEU 609          HD13      LEU 609  16.994  46.869  35.103
  455   HD21  LEU 609          HD21      LEU 609  18.322  50.242  32.782
  456   HD22  LEU 609          HD22      LEU 609  16.883  50.396  33.768
  457   HD23  LEU 609          HD23      LEU 609  18.466  50.185  34.558
  458    H    GLU 610           H        GLU 610  16.377  45.615  32.750
  459    HA   GLU 610           HA       GLU 610  16.569  44.876  29.859
  460    HB2  GLU 610           HB2      GLU 610  15.506  43.059  32.004
  461    HB3  GLU 610           HB3      GLU 610  15.514  42.751  30.239
  462    HG2  GLU 610           HG2      GLU 610  17.881  42.529  30.185
  463    HG3  GLU 610           HG3      GLU 610  18.051  43.153  31.838
  464    H1   TYR 611           H1       TYR 611  48.972  54.061  39.298
  465    H2   TYR 611           H2       TYR 611  49.136  52.975  38.084
  466    H3   TYR 611           H3       TYR 611  49.955  52.776  39.481
  467    HA   TYR 611           HA       TYR 611  47.983  52.292  40.697
  468    HB2  TYR 611           HB2      TYR 611  46.247  53.589  39.516
  469    HB3  TYR 611           HB3      TYR 611  46.660  52.817  38.004
  470    HD1  TYR 611           HD1      TYR 611  45.010  52.102  41.355
  471    HD2  TYR 611           HD2      TYR 611  45.578  50.829  37.256
  472    HE1  TYR 611           HE1      TYR 611  43.250  50.373  41.619
  473    HE2  TYR 611           HE2      TYR 611  43.866  49.082  37.576
  474    HH   TYR 611           HH       TYR 611  42.214  48.627  40.685
  475    H    SER 612           H        SER 612  47.830  50.214  41.128
  476    HA   SER 612           HA       SER 612  47.570  48.322  38.923
  477    HB2  SER 612           HB2      SER 612  49.161  46.734  39.902
  478    HB3  SER 612           HB3      SER 612  49.894  48.183  39.191
  479    HG   SER 612           HG       SER 612  50.815  47.705  41.156
  480    HA   PRO 613           HA       PRO 613  44.820  46.585  41.970
  481    HB2  PRO 613           HB2      PRO 613  44.297  44.140  40.704
  482    HB3  PRO 613           HB3      PRO 613  43.558  45.706  40.304
  483    HG2  PRO 613           HG2      PRO 613  45.831  44.281  38.927
  484    HG3  PRO 613           HG3      PRO 613  44.507  45.223  38.196
  485    HD2  PRO 613           HD2      PRO 613  47.026  46.303  38.559
  486    HD3  PRO 613           HD3      PRO 613  45.553  47.239  38.545
  487    H    SER 614           H        SER 614  44.547  44.578  43.357
  488    HA   SER 614           HA       SER 614  47.039  43.821  44.624
  489    HB2  SER 614           HB2      SER 614  45.669  42.354  45.987
  490    HB3  SER 614           HB3      SER 614  45.158  44.044  45.995
  491    HG   SER 614           HG       SER 614  43.600  42.191  45.663
  492    H    SER 615           H        SER 615  48.293  42.121  44.207
  493    HA   SER 615           HA       SER 615  48.277  40.695  41.775
  494    HB2  SER 615           HB2      SER 615  49.787  40.044  44.288
  495    HB3  SER 615           HB3      SER 615  50.218  39.573  42.631
  496    HG   SER 615           HG       SER 615  50.719  41.743  43.914
  497    HA   PRO 616           HA       PRO 616  46.581  36.775  43.881
  498    HB2  PRO 616           HB2      PRO 616  45.283  36.884  46.337
  499    HB3  PRO 616           HB3      PRO 616  47.045  36.697  46.212
  500    HG2  PRO 616           HG2      PRO 616  45.451  39.145  46.737
  501    HG3  PRO 616           HG3      PRO 616  47.020  38.576  47.465
  502    HD2  PRO 616           HD2      PRO 616  46.791  40.509  45.475
  503    HD3  PRO 616           HD3      PRO 616  48.244  39.540  45.797
  504   HC11  DA2 617          HC11      DA2 617  36.224  39.227  38.025
  505   HC12  DA2 617          HC12      DA2 617  36.454  40.706  38.976
  506   HC13  DA2 617          HC13      DA2 617  37.822  39.683  38.615
  507   HC21  DA2 617          HC21      DA2 617  34.835  37.787  40.926
  508   HC22  DA2 617          HC22      DA2 617  34.514  38.537  39.379
  509   HC23  DA2 617          HC23      DA2 617  34.574  39.537  40.825
  510    H2   DA2 617           H        DA2 617  45.203  39.485  42.970
  511    HA   DA2 617           HA       DA2 617  43.343  40.133  41.863
  512   HCB1  DA2 617          HCB1      DA2 617  42.175  37.390  42.339
  513   HCB2  DA2 617          HCB2      DA2 617  43.283  37.839  40.999
  514   HCG1  DA2 617          HCG1      DA2 617  41.389  39.543  40.407
  515   HCG2  DA2 617          HCG2      DA2 617  41.309  37.850  39.944
  516   HCD1  DA2 617          HCD1      DA2 617  39.843  37.267  41.774
  517   HCD2  DA2 617          HCD2      DA2 617  39.901  38.881  42.448
  518    HNE  DA2 617           HNE      DA2 617  38.972  39.217  39.796
  519   HNH2  DA2 617          HNH2      DA2 617  37.966  37.541  42.718
  520   HNH1  DA2 617          HNH1      DA2 617  36.284  37.527  42.331
  521    H    TYR 618           H        TYR 618  42.506  38.253  44.764
  522    HA   TYR 618           HA       TYR 618  40.027  39.565  45.285
  523    HB2  TYR 618           HB2      TYR 618  41.844  38.095  47.224
  524    HB3  TYR 618           HB3      TYR 618  40.154  38.418  47.494
  525    HD1  TYR 618           HD1      TYR 618  39.014  37.620  44.704
  526    HD2  TYR 618           HD2      TYR 618  41.983  35.787  47.257
  527    HE1  TYR 618           HE1      TYR 618  38.535  35.439  43.697
  528    HE2  TYR 618           HE2      TYR 618  41.628  33.624  46.092
  529    HH   TYR 618           HH       TYR 618  39.019  33.267  43.694
  530    H    THR 619           H        THR 619  39.485  41.196  46.885
  531    HA   THR 619           HA       THR 619  41.540  42.792  48.214
  532    HB   THR 619           HB       THR 619  41.597  43.778  46.025
  533    HG1  THR 619           HG1      THR 619  40.154  45.501  47.651
  534   HG21  THR 619          HG21      THR 619  38.603  44.347  46.277
  535   HG22  THR 619          HG22      THR 619  39.669  44.939  45.007
  536   HG23  THR 619          HG23      THR 619  39.360  43.198  45.155
  537    HA   PRO 620           HA       PRO 620  37.232  42.002  50.046
  538    HB2  PRO 620           HB2      PRO 620  37.903  40.773  52.421
  539    HB3  PRO 620           HB3      PRO 620  37.637  39.955  50.860
  540    HG2  PRO 620           HG2      PRO 620  40.230  40.873  52.113
  541    HG3  PRO 620           HG3      PRO 620  39.797  39.260  51.461
  542    HD2  PRO 620           HD2      PRO 620  41.192  41.192  49.985
  543    HD3  PRO 620           HD3      PRO 620  40.008  40.116  49.184
  544    H    GLN 621           H        GLN 621  36.264  42.823  51.930
  545    HA   GLN 621           HA       GLN 621  37.502  44.970  53.428
  546    HB2  GLN 621           HB2      GLN 621  37.148  45.774  50.982
  547    HB3  GLN 621           HB3      GLN 621  35.425  45.859  51.403
  548    HG2  GLN 621           HG2      GLN 621  35.985  47.242  53.406
  549    HG3  GLN 621           HG3      GLN 621  37.688  47.223  52.910
  550   HE21  GLN 621          HE22      GLN 621  38.256  49.078  51.943
  551   HE22  GLN 621          HE21      GLN 621  37.167  50.070  50.955
  552    H    SER 622           H        SER 622  36.488  44.974  55.288
  553    HA   SER 622           HA       SER 622  33.687  45.370  55.561
  554    HB2  SER 622           HB2      SER 622  33.764  42.965  55.103
  555    HB3  SER 622           HB3      SER 622  34.873  42.693  56.434
  556    HG   SER 622           HG       SER 622  32.309  42.592  56.424
  557    HA   PRO 623           HA       PRO 623  36.497  46.782  59.177
  558    HB2  PRO 623           HB2      PRO 623  35.985  49.494  59.026
  559    HB3  PRO 623           HB3      PRO 623  37.383  48.666  58.277
  560    HG2  PRO 623           HG2      PRO 623  34.714  49.494  57.182
  561    HG3  PRO 623           HG3      PRO 623  36.310  49.673  56.370
  562    HD2  PRO 623           HD2      PRO 623  34.565  47.637  55.708
  563    HD3  PRO 623           HD3      PRO 623  36.354  47.433  55.703
  Start of MODEL    9
    1    H1   MET 553           H1       MET 553  24.048  45.151  22.509
    2    H2   MET 553           H2       MET 553  23.027  45.133  23.777
    3    H3   MET 553           H3       MET 553  22.608  44.406  22.373
    4    HA   MET 553           HA       MET 553  24.881  43.565  24.046
    5    HB2  MET 553           HB2      MET 553  22.642  43.079  25.133
    6    HB3  MET 553           HB3      MET 553  22.190  42.154  23.706
    7    HG2  MET 553           HG2      MET 553  24.292  40.712  24.078
    8    HG3  MET 553           HG3      MET 553  24.435  41.493  25.640
    9    HE1  MET 553           HE1      MET 553  21.319  38.475  24.087
   10    HE2  MET 553           HE2      MET 553  21.106  40.154  23.548
   11    HE3  MET 553           HE3      MET 553  22.599  39.286  23.159
   12    H    LYS 554           H        LYS 554  22.754  42.406  21.383
   13    HA   LYS 554           HA       LYS 554  24.281  40.125  20.873
   14    HB2  LYS 554           HB2      LYS 554  21.919  40.549  20.043
   15    HB3  LYS 554           HB3      LYS 554  22.622  41.711  18.900
   16    HG2  LYS 554           HG2      LYS 554  22.055  39.387  18.006
   17    HG3  LYS 554           HG3      LYS 554  23.706  39.905  17.693
   18    HD2  LYS 554           HD2      LYS 554  24.518  38.497  19.607
   19    HD3  LYS 554           HD3      LYS 554  22.861  38.076  20.013
   20    HE2  LYS 554           HE2      LYS 554  22.625  37.063  17.707
   21    HE3  LYS 554           HE3      LYS 554  24.352  37.424  17.434
   22    HZ1  LYS 554           HZ1      LYS 554  23.335  35.748  19.610
   23    HZ2  LYS 554           HZ2      LYS 554  23.950  35.207  18.194
   24    HZ3  LYS 554           HZ3      LYS 554  24.896  36.036  19.234
   25    H    MET 555           H        MET 555  24.772  43.367  19.554
   26    HA   MET 555           HA       MET 555  27.300  42.360  18.337
   27    HB2  MET 555           HB2      MET 555  27.210  44.300  16.780
   28    HB3  MET 555           HB3      MET 555  26.025  43.006  16.549
   29    HG2  MET 555           HG2      MET 555  24.281  44.280  17.557
   30    HG3  MET 555           HG3      MET 555  25.388  45.546  18.078
   31    HE1  MET 555           HE1      MET 555  26.236  47.367  14.633
   32    HE2  MET 555           HE2      MET 555  26.561  47.273  16.384
   33    HE3  MET 555           HE3      MET 555  27.128  45.991  15.281
   34    H    TRP 556           H        TRP 556  28.107  42.440  20.464
   35    HA   TRP 556           HA       TRP 556  28.605  44.646  22.090
   36    HB2  TRP 556           HB2      TRP 556  30.066  42.052  21.533
   37    HB3  TRP 556           HB3      TRP 556  30.788  43.256  22.582
   38    HD1  TRP 556           HD1      TRP 556  29.818  40.309  23.439
   39    HE1  TRP 556           HE1      TRP 556  28.456  40.120  25.583
   40    HE3  TRP 556           HE3      TRP 556  27.886  45.126  23.693
   41    HZ2  TRP 556           HZ2      TRP 556  26.854  41.800  27.232
   42    HZ3  TRP 556           HZ3      TRP 556  26.373  45.710  25.462
   43    HH2  TRP 556           HH2      TRP 556  25.903  44.168  27.305
   44    H    LYS 557           H        LYS 557  30.315  46.048  22.453
   45    HA   LYS 557           HA       LYS 557  32.283  46.751  20.372
   46    HB2  LYS 557           HB2      LYS 557  31.287  49.025  19.974
   47    HB3  LYS 557           HB3      LYS 557  30.282  47.727  19.435
   48    HG2  LYS 557           HG2      LYS 557  28.904  47.892  21.494
   49    HG3  LYS 557           HG3      LYS 557  29.933  49.198  22.117
   50    HD2  LYS 557           HD2      LYS 557  29.404  50.479  19.993
   51    HD3  LYS 557           HD3      LYS 557  28.110  49.271  19.713
   52    HE2  LYS 557           HE2      LYS 557  28.362  51.079  22.160
   53    HE3  LYS 557           HE3      LYS 557  27.432  51.466  20.700
   54    HZ1  LYS 557           HZ1      LYS 557  26.977  49.096  22.393
   55    HZ2  LYS 557           HZ2      LYS 557  26.188  50.521  22.559
   56    HZ3  LYS 557           HZ3      LYS 557  25.988  49.651  21.218
   57    HA   PRO 558           HA       PRO 558  34.596  48.168  23.933
   58    HB2  PRO 558           HB2      PRO 558  36.221  50.015  22.876
   59    HB3  PRO 558           HB3      PRO 558  36.280  48.288  22.397
   60    HG2  PRO 558           HG2      PRO 558  35.041  50.578  20.873
   61    HG3  PRO 558           HG3      PRO 558  36.033  49.221  20.254
   62    HD2  PRO 558           HD2      PRO 558  33.286  49.294  20.193
   63    HD3  PRO 558           HD3      PRO 558  34.234  47.797  20.198
   64    H    GLY 559           H        GLY 559  34.983  49.810  25.570
   65    HA2  GLY 559           HA2      GLY 559  34.343  51.571  26.908
   66    HA3  GLY 559           HA3      GLY 559  33.735  52.377  25.489
   67    H    ASP 560           H        ASP 560  32.639  49.479  27.489
   68    HA   ASP 560           HA       ASP 560  29.944  50.693  27.782
   69    HB2  ASP 560           HB2      ASP 560  30.564  48.377  25.961
   70    HB3  ASP 560           HB3      ASP 560  29.227  48.129  27.025
   71    H    GLU 561           H        GLU 561  29.654  50.622  30.017
   72    HA   GLU 561           HA       GLU 561  30.372  48.316  31.509
   73    HB2  GLU 561           HB2      GLU 561  28.837  49.129  33.240
   74    HB3  GLU 561           HB3      GLU 561  30.007  50.307  32.670
   75    HG2  GLU 561           HG2      GLU 561  27.410  50.420  31.216
   76    HG3  GLU 561           HG3      GLU 561  27.249  50.653  32.945
   77    H    CYS 562           H        CYS 562  29.608  46.419  31.747
   78    HA   CYS 562           HA       CYS 562  26.908  45.445  31.100
   79    HB2  CYS 562           HB2      CYS 562  29.451  44.303  29.750
   80    HB3  CYS 562           HB3      CYS 562  27.795  43.726  29.504
   81    HG   CYS 562           HG       CYS 562  29.092  46.649  28.971
   82    H    PHE 563           H        PHE 563  27.110  42.709  31.414
   83    HA   PHE 563           HA       PHE 563  28.351  42.399  34.102
   84    HB2  PHE 563           HB2      PHE 563  25.699  41.498  32.985
   85    HB3  PHE 563           HB3      PHE 563  26.584  40.475  34.127
   86    HD1  PHE 563           HD1      PHE 563  27.508  41.492  36.207
   87    HD2  PHE 563           HD2      PHE 563  24.145  43.014  34.070
   88    HE1  PHE 563           HE1      PHE 563  26.900  42.876  38.206
   89    HE2  PHE 563           HE2      PHE 563  23.493  44.401  36.114
   90    HZ   PHE 563           HZ       PHE 563  24.935  44.390  38.094
   91    H    ALA 564           H        ALA 564  30.177  41.102  33.879
   92    HA   ALA 564           HA       ALA 564  30.262  39.141  31.621
   93    HB1  ALA 564           HB1      ALA 564  32.619  39.441  31.683
   94    HB2  ALA 564           HB2      ALA 564  31.865  41.051  31.611
   95    HB3  ALA 564           HB3      ALA 564  32.533  40.449  33.151
   96    H    LEU 565           H        LEU 565  30.448  37.134  31.920
   97    HA   LEU 565           HA       LEU 565  30.108  35.901  34.440
   98    HB2  LEU 565           HB2      LEU 565  29.251  35.144  32.172
   99    HB3  LEU 565           HB3      LEU 565  30.900  34.730  31.724
  100    HG   LEU 565           HG       LEU 565  30.985  32.951  33.382
  101   HD11  LEU 565          HD11      LEU 565  28.149  33.817  34.000
  102   HD12  LEU 565          HD12      LEU 565  28.880  32.269  34.506
  103   HD13  LEU 565          HD13      LEU 565  29.544  33.792  35.123
  104   HD21  LEU 565          HD21      LEU 565  29.349  31.514  32.220
  105   HD22  LEU 565          HD22      LEU 565  28.479  32.955  31.623
  106   HD23  LEU 565          HD23      LEU 565  30.130  32.618  31.071
  107    H    TYR 566           H        TYR 566  31.564  35.160  35.803
  108    HA   TYR 566           HA       TYR 566  34.430  35.158  35.191
  109    HB2  TYR 566           HB2      TYR 566  33.282  36.156  37.271
  110    HB3  TYR 566           HB3      TYR 566  33.195  34.483  37.852
  111    HD1  TYR 566           HD1      TYR 566  35.951  36.254  35.978
  112    HD2  TYR 566           HD2      TYR 566  34.706  34.620  39.776
  113    HE1  TYR 566           HE1      TYR 566  38.297  36.389  36.833
  114    HE2  TYR 566           HE2      TYR 566  37.018  34.849  40.621
  115    HH   TYR 566           HH       TYR 566  39.639  36.009  38.635
  116    H    TRP 567           H        TRP 567  35.448  33.231  36.861
  117    HA   TRP 567           HA       TRP 567  34.695  30.663  35.528
  118    HB2  TRP 567           HB2      TRP 567  37.068  30.294  35.160
  119    HB3  TRP 567           HB3      TRP 567  36.591  31.834  34.426
  120    HD1  TRP 567           HD1      TRP 567  37.825  34.044  35.349
  121    HE1  TRP 567           HE1      TRP 567  39.640  34.480  37.072
  122    HE3  TRP 567           HE3      TRP 567  38.647  29.238  37.025
  123    HZ2  TRP 567           HZ2      TRP 567  41.106  33.090  39.014
  124    HZ3  TRP 567           HZ3      TRP 567  40.299  28.872  38.851
  125    HH2  TRP 567           HH2      TRP 567  41.502  30.779  39.854
  126    H    GLU 568           H        GLU 568  36.053  32.172  38.438
  127    HA   GLU 568           HA       GLU 568  36.748  29.799  39.875
  128    HB2  GLU 568           HB2      GLU 568  37.709  31.781  40.571
  129    HB3  GLU 568           HB3      GLU 568  36.240  32.726  40.346
  130    HG2  GLU 568           HG2      GLU 568  35.281  32.206  42.306
  131    HG3  GLU 568           HG3      GLU 568  36.207  30.709  42.539
  132    H    ASP 569           H        ASP 569  33.853  31.801  39.769
  133    HA   ASP 569           HA       ASP 569  32.291  29.728  41.168
  134    HB2  ASP 569           HB2      ASP 569  31.005  31.733  42.097
  135    HB3  ASP 569           HB3      ASP 569  32.581  31.365  42.809
  136    H    ASN 570           H        ASN 570  32.615  31.217  38.237
  137    HA   ASN 570           HA       ASN 570  31.254  31.716  36.435
  138    HB2  ASN 570           HB2      ASN 570  31.097  29.205  36.939
  139    HB3  ASN 570           HB3      ASN 570  29.434  29.521  37.424
  140   HD21  ASN 570          HD22      ASN 570  27.836  29.596  35.825
  141   HD22  ASN 570          HD21      ASN 570  28.208  29.659  34.114
  142    H    LYS 571           H        LYS 571  30.702  33.494  38.616
  143    HA   LYS 571           HA       LYS 571  27.809  34.186  38.236
  144    HB2  LYS 571           HB2      LYS 571  29.831  34.682  40.347
  145    HB3  LYS 571           HB3      LYS 571  29.039  36.140  39.872
  146    HG2  LYS 571           HG2      LYS 571  27.404  33.675  40.661
  147    HG3  LYS 571           HG3      LYS 571  27.913  34.943  41.779
  148    HD2  LYS 571           HD2      LYS 571  26.701  36.618  40.457
  149    HD3  LYS 571           HD3      LYS 571  26.215  35.374  39.281
  150    HE2  LYS 571           HE2      LYS 571  24.883  34.241  41.042
  151    HE3  LYS 571           HE3      LYS 571  25.449  35.420  42.219
  152    HZ1  LYS 571           HZ1      LYS 571  24.343  37.145  40.857
  153    HZ2  LYS 571           HZ2      LYS 571  23.841  36.043  39.808
  154    HZ3  LYS 571           HZ3      LYS 571  23.258  36.020  41.340
  155    H    PHE 572           H        PHE 572  27.122  36.274  37.664
  156    HA   PHE 572           HA       PHE 572  28.911  37.396  35.588
  157    HB2  PHE 572           HB2      PHE 572  25.983  38.110  36.119
  158    HB3  PHE 572           HB3      PHE 572  27.019  38.653  34.826
  159    HD1  PHE 572           HD1      PHE 572  25.463  35.541  36.268
  160    HD2  PHE 572           HD2      PHE 572  27.109  37.428  32.756
  161    HE1  PHE 572           HE1      PHE 572  24.768  33.599  34.889
  162    HE2  PHE 572           HE2      PHE 572  26.476  35.439  31.414
  163    HZ   PHE 572           HZ       PHE 572  25.193  33.623  32.405
  164    H    TYR 573           H        TYR 573  30.012  39.353  36.024
  165    HA   TYR 573           HA       TYR 573  29.287  40.787  38.547
  166    HB2  TYR 573           HB2      TYR 573  32.062  40.310  37.402
  167    HB3  TYR 573           HB3      TYR 573  31.628  41.371  38.733
  168    HD1  TYR 573           HD2      TYR 573  31.953  37.786  37.756
  169    HD2  TYR 573           HD1      TYR 573  31.275  40.609  40.897
  170    HE1  TYR 573           HE2      TYR 573  32.188  35.945  39.428
  171    HE2  TYR 573           HE1      TYR 573  31.540  38.745  42.611
  172    HH   TYR 573           HH       TYR 573  32.334  35.464  41.744
  173    H    ARG 574           H        ARG 574  29.358  43.169  38.342
  174    HA   ARG 574           HA       ARG 574  28.950  44.337  35.805
  175    HB2  ARG 574           HB2      ARG 574  29.203  46.470  36.950
  176    HB3  ARG 574           HB3      ARG 574  28.182  45.323  37.855
  177    HG2  ARG 574           HG2      ARG 574  30.493  44.845  39.145
  178    HG3  ARG 574           HG3      ARG 574  31.016  46.327  38.375
  179    HD2  ARG 574           HD2      ARG 574  28.930  45.908  40.512
  180    HD3  ARG 574           HD3      ARG 574  30.462  46.791  40.578
  181    HE   ARG 574           HE       ARG 574  27.921  47.594  39.138
  182   HH11  ARG 574          HH11      ARG 574  30.672  48.654  41.118
  183   HH12  ARG 574          HH12      ARG 574  30.551  50.278  40.530
  184   HH21  ARG 574          HH21      ARG 574  27.542  49.795  38.907
  185   HH22  ARG 574          HH22      ARG 574  28.570  50.934  39.725
  186    H    ALA 575           H        ALA 575  30.247  45.081  34.233
  187    HA   ALA 575           HA       ALA 575  33.059  45.691  34.828
  188    HB1  ALA 575           HB1      ALA 575  32.253  43.570  32.788
  189    HB2  ALA 575           HB2      ALA 575  33.894  44.152  33.058
  190    HB3  ALA 575           HB3      ALA 575  33.036  43.310  34.374
  191    H    GLU 576           H        GLU 576  33.990  47.157  33.621
  192    HA   GLU 576           HA       GLU 576  32.545  48.639  31.518
  193    HB2  GLU 576           HB2      GLU 576  35.112  49.100  33.050
  194    HB3  GLU 576           HB3      GLU 576  34.666  49.996  31.560
  195    HG2  GLU 576           HG2      GLU 576  32.479  50.520  32.636
  196    HG3  GLU 576           HG3      GLU 576  33.163  49.929  34.162
  197    H    VAL 577           H        VAL 577  32.535  47.436  29.676
  198    HA   VAL 577           HA       VAL 577  34.393  45.770  28.485
  199    HB   VAL 577           HB       VAL 577  32.334  47.708  27.539
  200   HG11  VAL 577          HG11      VAL 577  34.372  46.467  25.775
  201   HG12  VAL 577          HG12      VAL 577  32.703  46.332  25.230
  202   HG13  VAL 577          HG13      VAL 577  33.339  47.930  25.625
  203   HG21  VAL 577          HG21      VAL 577  31.511  45.639  28.560
  204   HG22  VAL 577          HG22      VAL 577  31.173  45.689  26.825
  205   HG23  VAL 577          HG23      VAL 577  32.499  44.664  27.482
  206    H    GLU 578           H        GLU 578  36.409  46.030  27.831
  207    HA   GLU 578           HA       GLU 578  37.495  48.734  27.217
  208    HB2  GLU 578           HB2      GLU 578  38.792  47.142  28.685
  209    HB3  GLU 578           HB3      GLU 578  38.856  45.983  27.373
  210    HG2  GLU 578           HG2      GLU 578  40.941  47.304  27.826
  211    HG3  GLU 578           HG3      GLU 578  40.440  47.246  26.161
  212    H    ALA 579           H        ALA 579  37.049  45.553  25.741
  213    HA   ALA 579           HA       ALA 579  37.186  46.621  23.019
  214    HB1  ALA 579           HB1      ALA 579  39.451  44.968  24.246
  215    HB2  ALA 579           HB2      ALA 579  39.303  45.420  22.533
  216    HB3  ALA 579           HB3      ALA 579  39.557  46.658  23.821
  217    H    LEU 580           H        LEU 580  35.707  45.394  21.934
  218    HA   LEU 580           HA       LEU 580  35.562  42.473  22.436
  219    HB2  LEU 580           HB2      LEU 580  33.045  44.068  21.957
  220    HB3  LEU 580           HB3      LEU 580  33.218  42.463  22.591
  221    HG   LEU 580           HG       LEU 580  33.718  45.136  23.875
  222   HD11  LEU 580          HD11      LEU 580  31.805  42.829  24.371
  223   HD12  LEU 580          HD12      LEU 580  31.969  44.001  25.628
  224   HD13  LEU 580          HD13      LEU 580  31.438  44.585  24.070
  225   HD21  LEU 580          HD21      LEU 580  33.954  43.288  25.990
  226   HD22  LEU 580          HD22      LEU 580  35.131  42.816  24.711
  227   HD23  LEU 580          HD23      LEU 580  35.137  44.440  25.385
  228    H    HIS 581           H        HIS 581  35.582  41.329  20.795
  229    HA   HIS 581           HA       HIS 581  35.340  40.401  18.737
  230    HB2  HIS 581           HB2      HIS 581  32.978  40.886  19.510
  231    HB3  HIS 581           HB3      HIS 581  32.971  42.231  18.382
  232    HD2  HIS 581           HD2      HIS 581  30.924  40.007  17.829
  233    HE1  HIS 581           HE1      HIS 581  33.570  38.319  14.961
  234    HE2  HIS 581           HE2      HIS 581  31.180  38.350  15.841
  235    H    SER 582           H        SER 582  37.386  41.484  17.915
  236    HA   SER 582           HA       SER 582  36.609  42.809  15.346
  237    HB2  SER 582           HB2      SER 582  39.002  43.124  14.964
  238    HB3  SER 582           HB3      SER 582  38.334  44.047  16.312
  239    HG   SER 582           HG       SER 582  40.353  42.869  16.738
  240    H    SER 583           H        SER 583  35.507  40.687  14.888
  241    HA   SER 583           HA       SER 583  35.341  38.685  13.838
  242    HB2  SER 583           HB2      SER 583  38.145  39.077  12.844
  243    HB3  SER 583           HB3      SER 583  36.818  38.103  12.165
  244    HG   SER 583           HG       SER 583  37.215  40.278  11.282
  245    H    GLY 584           H        GLY 584  36.424  38.667  16.599
  246    HA2  GLY 584           HA2      GLY 584  37.765  35.976  16.674
  247    HA3  GLY 584           HA3      GLY 584  38.096  37.311  17.777
  248    H    MET 585           H        MET 585  37.771  35.162  18.909
  249    HA   MET 585           HA       MET 585  35.134  34.175  19.516
  250    HB2  MET 585           HB2      MET 585  37.238  32.821  19.272
  251    HB3  MET 585           HB3      MET 585  37.870  33.558  20.734
  252    HG2  MET 585           HG2      MET 585  36.130  32.682  22.092
  253    HG3  MET 585           HG3      MET 585  35.235  32.043  20.703
  254    HE1  MET 585           HE1      MET 585  39.024  30.588  22.775
  255    HE2  MET 585           HE2      MET 585  38.634  32.258  22.263
  256    HE3  MET 585           HE3      MET 585  37.683  31.501  23.538
  257    H    THR 586           H        THR 586  37.157  36.607  21.006
  258    HA   THR 586           HA       THR 586  35.714  36.461  23.612
  259    HB   THR 586           HB       THR 586  38.001  37.243  24.572
  260    HG1  THR 586           HG1      THR 586  39.184  37.363  22.730
  261   HG21  THR 586          HG21      THR 586  38.602  34.881  24.898
  262   HG22  THR 586          HG22      THR 586  36.831  35.081  24.967
  263   HG23  THR 586          HG23      THR 586  37.605  34.441  23.492
  264    H    ALA 587           H        ALA 587  36.113  38.205  24.950
  265    HA   ALA 587           HA       ALA 587  36.232  40.919  23.805
  266    HB1  ALA 587           HB1      ALA 587  33.894  40.951  24.162
  267    HB2  ALA 587           HB2      ALA 587  33.953  39.509  25.246
  268    HB3  ALA 587           HB3      ALA 587  34.400  41.088  25.847
  269    H    VAL 588           H        VAL 588  37.070  42.297  25.185
  270    HA   VAL 588           HA       VAL 588  38.307  41.256  27.706
  271    HB   VAL 588           HB       VAL 588  39.108  43.775  26.271
  272   HG11  VAL 588          HG11      VAL 588  39.755  43.477  28.636
  273   HG12  VAL 588          HG12      VAL 588  40.742  42.058  28.189
  274   HG13  VAL 588          HG13      VAL 588  41.133  43.661  27.558
  275   HG21  VAL 588          HG21      VAL 588  39.551  41.985  24.619
  276   HG22  VAL 588          HG22      VAL 588  41.041  42.660  25.301
  277   HG23  VAL 588          HG23      VAL 588  40.444  41.059  25.833
  278    H    VAL 589           H        VAL 589  37.712  42.243  29.566
  279    HA   VAL 589           HA       VAL 589  36.057  44.699  29.624
  280    HB   VAL 589           HB       VAL 589  34.243  43.514  30.840
  281   HG11  VAL 589          HG11      VAL 589  34.487  43.720  28.175
  282   HG12  VAL 589          HG12      VAL 589  34.676  41.971  28.281
  283   HG13  VAL 589          HG13      VAL 589  33.178  42.765  28.847
  284   HG21  VAL 589          HG21      VAL 589  35.260  41.568  31.828
  285   HG22  VAL 589          HG22      VAL 589  34.116  40.963  30.626
  286   HG23  VAL 589          HG23      VAL 589  35.845  40.976  30.278
  287    H    LYS 590           H        LYS 590  36.060  45.787  31.642
  288    HA   LYS 590           HA       LYS 590  38.123  44.900  33.592
  289    HB2  LYS 590           HB2      LYS 590  38.421  46.966  32.411
  290    HB3  LYS 590           HB3      LYS 590  36.887  47.596  33.030
  291    HG2  LYS 590           HG2      LYS 590  37.718  47.475  35.360
  292    HG3  LYS 590           HG3      LYS 590  39.186  46.660  34.817
  293    HD2  LYS 590           HD2      LYS 590  39.944  48.606  33.625
  294    HD3  LYS 590           HD3      LYS 590  38.338  49.398  33.817
  295    HE2  LYS 590           HE2      LYS 590  38.826  49.299  36.312
  296    HE3  LYS 590           HE3      LYS 590  40.525  48.947  35.856
  297    HZ1  LYS 590           HZ1      LYS 590  40.248  51.290  36.182
  298    HZ2  LYS 590           HZ2      LYS 590  40.283  51.130  34.536
  299    HZ3  LYS 590           HZ3      LYS 590  38.885  51.304  35.312
  300    H    PHE 591           H        PHE 591  37.098  43.796  35.357
  301    HA   PHE 591           HA       PHE 591  34.450  44.111  36.272
  302    HB2  PHE 591           HB2      PHE 591  37.024  43.307  37.664
  303    HB3  PHE 591           HB3      PHE 591  35.423  43.036  38.386
  304    HD1  PHE 591           HD2      PHE 591  33.733  41.650  37.153
  305    HD2  PHE 591           HD1      PHE 591  37.937  41.578  36.282
  306    HE1  PHE 591           HE2      PHE 591  33.414  39.608  35.726
  307    HE2  PHE 591           HE1      PHE 591  37.582  39.706  34.688
  308    HZ   PHE 591           HZ       PHE 591  35.363  38.714  34.418
  309    H    ILE 592           H        ILE 592  33.387  45.841  37.257
  310    HA   ILE 592           HA       ILE 592  34.935  48.187  37.995
  311    HB   ILE 592           HB       ILE 592  32.002  48.234  38.397
  312   HG12  ILE 592          HG12      ILE 592  33.154  47.928  35.612
  313   HG13  ILE 592          HG13      ILE 592  31.933  46.921  36.433
  314   HG21  ILE 592          HG21      ILE 592  33.693  50.088  36.704
  315   HG22  ILE 592          HG22      ILE 592  32.232  50.468  37.664
  316   HG23  ILE 592          HG23      ILE 592  33.778  50.236  38.462
  317   HD11  ILE 592          HD11      ILE 592  31.510  49.787  35.545
  318   HD12  ILE 592          HD12      ILE 592  30.994  48.330  34.698
  319   HD13  ILE 592          HD13      ILE 592  30.309  48.708  36.311
  320    H    ASP 593           H        ASP 593  34.520  45.564  39.857
  321    HA   ASP 593           HA       ASP 593  34.465  47.315  42.280
  322    HB2  ASP 593           HB2      ASP 593  32.422  45.754  42.091
  323    HB3  ASP 593           HB3      ASP 593  33.553  44.423  42.255
  324    H    TYR 594           H        TYR 594  36.539  45.910  40.341
  325    HA   TYR 594           HA       TYR 594  38.450  45.019  42.429
  326    HB2  TYR 594           HB2      TYR 594  37.808  43.590  39.854
  327    HB3  TYR 594           HB3      TYR 594  38.999  43.094  41.065
  328    HD1  TYR 594           HD1      TYR 594  35.305  43.598  40.550
  329    HD2  TYR 594           HD2      TYR 594  38.314  41.352  42.625
  330    HE1  TYR 594           HE1      TYR 594  33.530  42.222  41.601
  331    HE2  TYR 594           HE2      TYR 594  36.561  39.876  43.571
  332    HH   TYR 594           HH       TYR 594  33.110  40.405  43.122
  333    H    GLY 595           H        GLY 595  37.865  46.089  39.032
  334    HA2  GLY 595           HA2      GLY 595  38.692  47.890  37.996
  335    HA3  GLY 595           HA3      GLY 595  39.874  48.188  39.262
  336    H    ASN 596           H        ASN 596  39.579  45.148  37.397
  337    HA   ASN 596           HA       ASN 596  41.529  46.069  35.433
  338    HB2  ASN 596           HB2      ASN 596  43.179  44.386  35.877
  339    HB3  ASN 596           HB3      ASN 596  42.865  45.177  37.428
  340   HD21  ASN 596          HD22      ASN 596  43.344  42.166  36.054
  341   HD22  ASN 596          HD21      ASN 596  42.377  41.246  37.190
  342    H    TYR 597           H        TYR 597  41.894  44.481  33.720
  343    HA   TYR 597           HA       TYR 597  39.346  43.119  33.128
  344    HB2  TYR 597           HB2      TYR 597  39.965  43.765  30.669
  345    HB3  TYR 597           HB3      TYR 597  39.211  44.963  31.678
  346    HD1  TYR 597           HD2      TYR 597  40.773  46.565  32.976
  347    HD2  TYR 597           HD1      TYR 597  41.853  44.481  29.378
  348    HE1  TYR 597           HE2      TYR 597  42.498  48.269  32.548
  349    HE2  TYR 597           HE1      TYR 597  43.674  46.070  28.977
  350    HH   TYR 597           HH       TYR 597  44.540  47.908  29.533
  351    H    GLU 598           H        GLU 598  39.212  41.472  31.715
  352    HA   GLU 598           HA       GLU 598  41.576  40.044  30.720
  353    HB2  GLU 598           HB2      GLU 598  40.894  37.842  31.818
  354    HB3  GLU 598           HB3      GLU 598  41.587  39.092  32.846
  355    HG2  GLU 598           HG2      GLU 598  39.522  39.664  33.741
  356    HG3  GLU 598           HG3      GLU 598  38.598  38.638  32.605
  357    H    GLU 599           H        GLU 599  40.898  38.010  29.474
  358    HA   GLU 599           HA       GLU 599  38.839  38.689  27.546
  359    HB2  GLU 599           HB2      GLU 599  40.157  35.968  27.858
  360    HB3  GLU 599           HB3      GLU 599  39.308  36.629  26.478
  361    HG2  GLU 599           HG2      GLU 599  41.526  36.769  25.826
  362    HG3  GLU 599           HG3      GLU 599  41.188  38.394  26.310
  363    H    VAL 600           H        VAL 600  36.736  37.893  27.420
  364    HA   VAL 600           HA       VAL 600  35.631  35.787  29.143
  365    HB   VAL 600           HB       VAL 600  34.355  38.579  28.989
  366   HG11  VAL 600          HG11      VAL 600  33.380  36.168  30.590
  367   HG12  VAL 600          HG12      VAL 600  32.595  37.740  30.395
  368   HG13  VAL 600          HG13      VAL 600  32.709  36.661  29.025
  369   HG21  VAL 600          HG21      VAL 600  36.193  38.630  30.605
  370   HG22  VAL 600          HG22      VAL 600  34.684  38.598  31.508
  371   HG23  VAL 600          HG23      VAL 600  35.628  37.106  31.330
  372    H    LEU 601           H        LEU 601  34.245  34.613  27.856
  373    HA   LEU 601           HA       LEU 601  34.206  35.124  25.118
  374    HB2  LEU 601           HB2      LEU 601  33.349  32.980  26.781
  375    HB3  LEU 601           HB3      LEU 601  31.863  33.586  26.036
  376    HG   LEU 601           HG       LEU 601  32.980  33.401  23.819
  377   HD11  LEU 601          HD11      LEU 601  35.425  33.360  24.449
  378   HD12  LEU 601          HD12      LEU 601  35.101  32.043  25.579
  379   HD13  LEU 601          HD13      LEU 601  35.002  31.755  23.830
  380   HD21  LEU 601          HD21      LEU 601  31.498  31.668  24.567
  381   HD22  LEU 601          HD22      LEU 601  32.922  30.956  23.750
  382   HD23  LEU 601          HD23      LEU 601  32.774  30.890  25.525
  383    H    LEU 602           H        LEU 602  32.457  35.740  23.650
  384    HA   LEU 602           HA       LEU 602  31.364  38.236  24.562
  385    HB2  LEU 602           HB2      LEU 602  30.860  36.643  22.023
  386    HB3  LEU 602           HB3      LEU 602  30.299  38.282  22.314
  387    HG   LEU 602           HG       LEU 602  33.265  37.718  22.557
  388   HD11  LEU 602          HD11      LEU 602  33.386  38.565  20.125
  389   HD12  LEU 602          HD12      LEU 602  33.044  36.864  20.431
  390   HD13  LEU 602          HD13      LEU 602  31.719  37.968  19.966
  391   HD21  LEU 602          HD21      LEU 602  32.172  39.907  23.246
  392   HD22  LEU 602          HD22      LEU 602  33.454  40.017  22.021
  393   HD23  LEU 602          HD23      LEU 602  31.740  40.143  21.535
  394    H    SER 603           H        SER 603  29.844  35.124  23.765
  395    HA   SER 603           HA       SER 603  27.176  35.750  24.627
  396    HB2  SER 603           HB2      SER 603  27.028  33.201  24.716
  397    HB3  SER 603           HB3      SER 603  27.512  33.851  23.140
  398    HG   SER 603           HG       SER 603  28.859  32.153  24.062
  399    H    ASN 604           H        ASN 604  29.976  35.658  26.448
  400    HA   ASN 604           HA       ASN 604  28.718  34.551  28.933
  401    HB2  ASN 604           HB2      ASN 604  31.638  34.700  28.133
  402    HB3  ASN 604           HB3      ASN 604  31.039  34.443  29.737
  403   HD21  ASN 604          HD22      ASN 604  32.397  32.363  29.191
  404   HD22  ASN 604          HD21      ASN 604  31.425  31.007  28.597
  405    H    ILE 605           H        ILE 605  28.753  37.296  27.419
  406    HA   ILE 605           HA       ILE 605  28.883  38.806  29.971
  407    HB   ILE 605           HB       ILE 605  29.523  39.913  27.203
  408   HG12  ILE 605          HG12      ILE 605  31.630  39.588  29.376
  409   HG13  ILE 605          HG13      ILE 605  31.454  38.410  28.096
  410   HG21  ILE 605          HG21      ILE 605  28.461  41.485  28.772
  411   HG22  ILE 605          HG22      ILE 605  29.747  41.149  29.962
  412   HG23  ILE 605          HG23      ILE 605  30.087  41.972  28.398
  413   HD11  ILE 605          HD11      ILE 605  31.633  40.112  26.356
  414   HD12  ILE 605          HD12      ILE 605  32.002  41.354  27.561
  415   HD13  ILE 605          HD13      ILE 605  33.106  39.985  27.336
  416    H    LYS 606           H        LYS 606  26.965  39.294  30.529
  417    HA   LYS 606           HA       LYS 606  24.587  39.569  28.718
  418    HB2  LYS 606           HB2      LYS 606  25.062  39.191  31.670
  419    HB3  LYS 606           HB3      LYS 606  23.529  39.921  31.176
  420    HG2  LYS 606           HG2      LYS 606  24.605  37.305  30.114
  421    HG3  LYS 606           HG3      LYS 606  23.489  37.435  31.494
  422    HD2  LYS 606           HD2      LYS 606  21.711  38.287  29.983
  423    HD3  LYS 606           HD3      LYS 606  22.858  38.305  28.638
  424    HE2  LYS 606           HE2      LYS 606  22.148  35.759  30.162
  425    HE3  LYS 606           HE3      LYS 606  21.344  36.314  28.685
  426    HZ1  LYS 606           HZ1      LYS 606  23.615  36.465  27.728
  427    HZ2  LYS 606           HZ2      LYS 606  24.152  35.515  28.934
  428    HZ3  LYS 606           HZ3      LYS 606  23.001  34.990  27.882
  429    HA   PRO 607           HA       PRO 607  24.837  44.003  29.004
  430    HB2  PRO 607           HB2      PRO 607  22.259  44.915  28.986
  431    HB3  PRO 607           HB3      PRO 607  23.022  44.244  27.529
  432    HG2  PRO 607           HG2      PRO 607  20.997  42.951  29.313
  433    HG3  PRO 607           HG3      PRO 607  21.291  42.707  27.580
  434    HD2  PRO 607           HD2      PRO 607  22.222  41.030  29.676
  435    HD3  PRO 607           HD3      PRO 607  22.787  40.996  27.974
  436    H    ILE 608           H        ILE 608  24.143  45.917  30.400
  437    HA   ILE 608           HA       ILE 608  23.774  45.051  33.206
  438    HB   ILE 608           HB       ILE 608  25.557  46.911  32.009
  439   HG12  ILE 608          HG12      ILE 608  24.798  46.254  34.868
  440   HG13  ILE 608          HG13      ILE 608  25.803  45.234  33.832
  441   HG21  ILE 608          HG21      ILE 608  23.824  48.413  34.005
  442   HG22  ILE 608          HG22      ILE 608  25.273  48.995  33.163
  443   HG23  ILE 608          HG23      ILE 608  23.798  48.751  32.264
  444   HD11  ILE 608          HD11      ILE 608  27.209  46.338  35.329
  445   HD12  ILE 608          HD12      ILE 608  27.490  47.047  33.722
  446   HD13  ILE 608          HD13      ILE 608  26.501  47.931  34.940
  447    H    LEU 609           H        LEU 609  22.218  46.972  30.796
  448    HA   LEU 609           HA       LEU 609  19.720  46.880  32.380
  449    HB2  LEU 609           HB2      LEU 609  19.444  49.051  32.781
  450    HB3  LEU 609           HB3      LEU 609  21.183  49.060  32.740
  451    HG   LEU 609           HG       LEU 609  19.273  49.978  30.559
  452   HD11  LEU 609          HD11      LEU 609  20.067  52.188  31.235
  453   HD12  LEU 609          HD12      LEU 609  19.505  51.308  32.632
  454   HD13  LEU 609          HD13      LEU 609  21.247  51.424  32.356
  455   HD21  LEU 609          HD21      LEU 609  21.301  48.831  29.558
  456   HD22  LEU 609          HD22      LEU 609  21.263  50.537  29.204
  457   HD23  LEU 609          HD23      LEU 609  22.347  49.883  30.476
  458    H    GLU 610           H        GLU 610  17.938  48.143  31.121
  459    HA   GLU 610           HA       GLU 610  17.873  47.610  28.302
  460    HB2  GLU 610           HB2      GLU 610  15.994  46.004  28.410
  461    HB3  GLU 610           HB3      GLU 610  17.376  45.322  29.275
  462    HG2  GLU 610           HG2      GLU 610  16.346  46.062  31.436
  463    HG3  GLU 610           HG3      GLU 610  14.940  46.603  30.548
  464    H1   TYR 611           H1       TYR 611  51.026  48.808  35.404
  465    H2   TYR 611           H2       TYR 611  51.734  50.080  34.669
  466    H3   TYR 611           H3       TYR 611  50.572  50.378  35.736
  467    HA   TYR 611           HA       TYR 611  53.162  49.099  36.288
  468    HB2  TYR 611           HB2      TYR 611  53.361  51.387  35.365
  469    HB3  TYR 611           HB3      TYR 611  52.331  51.985  36.647
  470    HD1  TYR 611           HD1      TYR 611  55.666  50.418  35.942
  471    HD2  TYR 611           HD2      TYR 611  53.186  52.429  38.831
  472    HE1  TYR 611           HE1      TYR 611  57.707  51.116  37.221
  473    HE2  TYR 611           HE2      TYR 611  55.193  53.004  40.163
  474    HH   TYR 611           HH       TYR 611  58.433  52.058  39.175
  475    H    SER 612           H        SER 612  53.341  48.240  38.249
  476    HA   SER 612           HA       SER 612  52.532  47.174  40.138
  477    HB2  SER 612           HB2      SER 612  53.234  49.960  41.042
  478    HB3  SER 612           HB3      SER 612  53.236  48.505  42.058
  479    HG   SER 612           HG       SER 612  55.055  47.932  41.220
  480    HA   PRO 613           HA       PRO 613  47.998  48.141  40.637
  481    HB2  PRO 613           HB2      PRO 613  48.122  45.134  40.726
  482    HB3  PRO 613           HB3      PRO 613  46.902  46.230  39.988
  483    HG2  PRO 613           HG2      PRO 613  48.712  44.960  38.470
  484    HG3  PRO 613           HG3      PRO 613  48.265  46.685  38.169
  485    HD2  PRO 613           HD2      PRO 613  50.747  45.623  39.547
  486    HD3  PRO 613           HD3      PRO 613  50.590  46.907  38.333
  487    H    SER 614           H        SER 614  46.581  47.531  42.464
  488    HA   SER 614           HA       SER 614  48.032  47.943  44.930
  489    HB2  SER 614           HB2      SER 614  45.078  47.260  44.680
  490    HB3  SER 614           HB3      SER 614  45.909  48.094  46.005
  491    HG   SER 614           HG       SER 614  45.927  49.820  44.860
  492    H    SER 615           H        SER 615  46.130  45.136  43.680
  493    HA   SER 615           HA       SER 615  47.340  43.376  45.714
  494    HB2  SER 615           HB2      SER 615  44.365  43.995  45.589
  495    HB3  SER 615           HB3      SER 615  45.042  42.571  46.371
  496    HG   SER 615           HG       SER 615  44.840  44.299  47.765
  497    HA   PRO 616           HA       PRO 616  46.906  40.499  42.233
  498    HB2  PRO 616           HB2      PRO 616  46.820  38.014  43.469
  499    HB3  PRO 616           HB3      PRO 616  48.285  38.978  43.239
  500    HG2  PRO 616           HG2      PRO 616  46.511  38.699  45.660
  501    HG3  PRO 616           HG3      PRO 616  48.295  38.816  45.626
  502    HD2  PRO 616           HD2      PRO 616  46.710  40.957  46.281
  503    HD3  PRO 616           HD3      PRO 616  48.285  41.106  45.469
  504   HC11  DA2 617          HC11      DA2 617  35.689  40.522  39.475
  505   HC12  DA2 617          HC12      DA2 617  37.428  40.435  39.656
  506   HC13  DA2 617          HC13      DA2 617  36.628  39.467  38.414
  507   HC21  DA2 617          HC21      DA2 617  34.256  38.942  40.218
  508   HC22  DA2 617          HC22      DA2 617  34.774  38.007  41.607
  509   HC23  DA2 617          HC23      DA2 617  34.862  37.307  39.993
  510    H2   DA2 617           H        DA2 617  44.786  41.060  41.412
  511    HA   DA2 617           HA       DA2 617  42.764  40.463  40.581
  512   HCB1  DA2 617          HCB1      DA2 617  42.302  38.369  42.714
  513   HCB2  DA2 617          HCB2      DA2 617  43.292  38.132  41.278
  514   HCG1  DA2 617          HCG1      DA2 617  41.046  39.061  40.063
  515   HCG2  DA2 617          HCG2      DA2 617  41.452  37.360  40.385
  516   HCD1  DA2 617          HCD1      DA2 617  39.803  37.020  41.675
  517   HCD2  DA2 617          HCD2      DA2 617  40.017  38.557  42.614
  518    HNE  DA2 617           HNE      DA2 617  38.868  39.511  40.384
  519   HNH2  DA2 617          HNH2      DA2 617  38.001  36.817  42.521
  520   HNH1  DA2 617          HNH1      DA2 617  36.318  36.894  42.143
  521    H    TYR 618           H        TYR 618  43.361  41.983  43.489
  522    HA   TYR 618           HA       TYR 618  40.628  43.174  43.481
  523    HB2  TYR 618           HB2      TYR 618  41.961  42.332  46.103
  524    HB3  TYR 618           HB3      TYR 618  40.355  42.960  45.872
  525    HD1  TYR 618           HD2      TYR 618  42.467  39.885  45.454
  526    HD2  TYR 618           HD1      TYR 618  38.484  41.603  45.329
  527    HE1  TYR 618           HE2      TYR 618  41.481  37.629  45.446
  528    HE2  TYR 618           HE1      TYR 618  37.522  39.352  45.531
  529    HH   TYR 618           HH       TYR 618  38.005  37.195  45.685
  530    H    THR 619           H        THR 619  40.666  44.959  45.258
  531    HA   THR 619           HA       THR 619  43.192  46.260  45.734
  532    HB   THR 619           HB       THR 619  42.644  47.181  43.603
  533    HG1  THR 619           HG1      THR 619  43.325  48.906  44.452
  534   HG21  THR 619          HG21      THR 619  40.175  46.737  43.656
  535   HG22  THR 619          HG22      THR 619  39.933  48.114  44.712
  536   HG23  THR 619          HG23      THR 619  40.597  48.360  43.078
  537    HA   PRO 620           HA       PRO 620  40.844  46.937  49.463
  538    HB2  PRO 620           HB2      PRO 620  42.257  49.598  49.789
  539    HB3  PRO 620           HB3      PRO 620  42.207  48.203  50.903
  540    HG2  PRO 620           HG2      PRO 620  44.410  48.752  49.386
  541    HG3  PRO 620           HG3      PRO 620  43.844  47.071  49.743
  542    HD2  PRO 620           HD2      PRO 620  43.449  48.729  47.260
  543    HD3  PRO 620           HD3      PRO 620  43.948  47.008  47.436
  544    H    GLN 621           H        GLN 621  39.241  48.382  50.487
  545    HA   GLN 621           HA       GLN 621  38.240  50.647  48.840
  546    HB2  GLN 621           HB2      GLN 621  36.554  48.783  50.571
  547    HB3  GLN 621           HB3      GLN 621  35.949  50.018  49.451
  548    HG2  GLN 621           HG2      GLN 621  37.385  47.477  48.601
  549    HG3  GLN 621           HG3      GLN 621  35.657  47.626  48.874
  550   HE21  GLN 621          HE22      GLN 621  38.163  48.023  46.618
  551   HE22  GLN 621          HE21      GLN 621  37.243  48.901  45.387
  552    H    SER 622           H        SER 622  39.108  49.739  52.212
  553    HA   SER 622           HA       SER 622  37.615  51.503  53.644
  554    HB2  SER 622           HB2      SER 622  40.428  50.532  54.072
  555    HB3  SER 622           HB3      SER 622  39.605  51.612  55.237
  556    HG   SER 622           HG       SER 622  39.285  49.091  55.076
  557    HA   PRO 623           HA       PRO 623  41.026  55.093  53.206
  558    HB2  PRO 623           HB2      PRO 623  41.533  54.743  50.289
  559    HB3  PRO 623           HB3      PRO 623  42.596  55.354  51.596
  560    HG2  PRO 623           HG2      PRO 623  42.873  52.782  50.692
  561    HG3  PRO 623           HG3      PRO 623  43.067  53.279  52.422
  562    HD2  PRO 623           HD2      PRO 623  40.793  51.831  51.117
  563    HD3  PRO 623           HD3      PRO 623  41.518  51.643  52.729
  Start of MODEL   10
    1    H1   MET 553           H1       MET 553  19.445  49.938  17.703
    2    H2   MET 553           H2       MET 553  19.798  48.522  17.031
    3    H3   MET 553           H3       MET 553  20.546  49.882  16.525
    4    HA   MET 553           HA       MET 553  22.143  48.762  17.808
    5    HB2  MET 553           HB2      MET 553  20.829  50.970  19.452
    6    HB3  MET 553           HB3      MET 553  22.232  50.129  20.006
    7    HG2  MET 553           HG2      MET 553  23.383  50.660  17.782
    8    HG3  MET 553           HG3      MET 553  22.032  51.710  17.393
    9    HE1  MET 553           HE1      MET 553  24.579  53.254  17.123
   10    HE2  MET 553           HE2      MET 553  22.979  54.008  17.181
   11    HE3  MET 553           HE3      MET 553  24.274  54.647  18.204
   12    H    LYS 554           H        LYS 554  22.018  46.677  18.425
   13    HA   LYS 554           HA       LYS 554  20.440  45.761  20.758
   14    HB2  LYS 554           HB2      LYS 554  20.396  44.325  18.072
   15    HB3  LYS 554           HB3      LYS 554  19.764  43.743  19.590
   16    HG2  LYS 554           HG2      LYS 554  18.233  45.759  19.700
   17    HG3  LYS 554           HG3      LYS 554  18.687  46.094  18.014
   18    HD2  LYS 554           HD2      LYS 554  17.974  43.824  17.384
   19    HD3  LYS 554           HD3      LYS 554  17.434  43.485  19.034
   20    HE2  LYS 554           HE2      LYS 554  15.517  44.074  17.880
   21    HE3  LYS 554           HE3      LYS 554  15.876  45.449  18.929
   22    HZ1  LYS 554           HZ1      LYS 554  15.362  46.203  16.696
   23    HZ2  LYS 554           HZ2      LYS 554  16.962  46.449  16.910
   24    HZ3  LYS 554           HZ3      LYS 554  16.422  45.132  16.067
   25    H    MET 555           H        MET 555  23.527  45.820  19.316
   26    HA   MET 555           HA       MET 555  24.350  43.342  20.773
   27    HB2  MET 555           HB2      MET 555  25.309  44.102  17.985
   28    HB3  MET 555           HB3      MET 555  25.943  42.822  18.995
   29    HG2  MET 555           HG2      MET 555  24.532  41.644  17.552
   30    HG3  MET 555           HG3      MET 555  23.572  41.802  19.013
   31    HE1  MET 555           HE1      MET 555  21.276  41.222  17.894
   32    HE2  MET 555           HE2      MET 555  20.728  41.858  16.343
   33    HE3  MET 555           HE3      MET 555  22.152  40.823  16.388
   34    H    TRP 556           H        TRP 556  26.445  43.343  21.542
   35    HA   TRP 556           HA       TRP 556  27.001  45.534  22.999
   36    HB2  TRP 556           HB2      TRP 556  28.709  43.202  22.040
   37    HB3  TRP 556           HB3      TRP 556  29.325  44.331  23.181
   38    HD1  TRP 556           HD1      TRP 556  28.167  41.038  23.533
   39    HE1  TRP 556           HE1      TRP 556  27.544  40.628  25.898
   40    HE3  TRP 556           HE3      TRP 556  26.983  45.861  24.942
   41    HZ2  TRP 556           HZ2      TRP 556  26.226  42.053  28.064
   42    HZ3  TRP 556           HZ3      TRP 556  25.815  46.214  27.084
   43    HH2  TRP 556           HH2      TRP 556  25.389  44.315  28.620
   44    H    LYS 557           H        LYS 557  28.664  47.037  23.125
   45    HA   LYS 557           HA       LYS 557  30.525  47.810  21.077
   46    HB2  LYS 557           HB2      LYS 557  29.406  49.760  20.224
   47    HB3  LYS 557           HB3      LYS 557  28.297  48.410  20.033
   48    HG2  LYS 557           HG2      LYS 557  27.158  49.139  22.185
   49    HG3  LYS 557           HG3      LYS 557  28.200  50.578  22.166
   50    HD2  LYS 557           HD2      LYS 557  27.133  51.070  19.853
   51    HD3  LYS 557           HD3      LYS 557  26.034  49.728  20.211
   52    HE2  LYS 557           HE2      LYS 557  24.834  51.513  21.126
   53    HE3  LYS 557           HE3      LYS 557  25.719  50.957  22.544
   54    HZ1  LYS 557           HZ1      LYS 557  26.802  53.019  20.773
   55    HZ2  LYS 557           HZ2      LYS 557  25.836  53.394  22.025
   56    HZ3  LYS 557           HZ3      LYS 557  27.266  52.692  22.325
   57    HA   PRO 558           HA       PRO 558  32.494  49.534  24.542
   58    HB2  PRO 558           HB2      PRO 558  33.977  51.569  23.598
   59    HB3  PRO 558           HB3      PRO 558  34.184  49.917  23.032
   60    HG2  PRO 558           HG2      PRO 558  32.504  52.022  21.648
   61    HG3  PRO 558           HG3      PRO 558  33.800  51.005  20.937
   62    HD2  PRO 558           HD2      PRO 558  31.243  50.279  20.730
   63    HD3  PRO 558           HD3      PRO 558  32.485  49.027  21.093
   64    H    GLY 559           H        GLY 559  32.381  51.031  26.214
   65    HA2  GLY 559           HA2      GLY 559  31.776  52.922  27.385
   66    HA3  GLY 559           HA3      GLY 559  30.995  53.608  25.940
   67    H    ASP 560           H        ASP 560  30.683  50.688  28.007
   68    HA   ASP 560           HA       ASP 560  27.973  51.468  28.809
   69    HB2  ASP 560           HB2      ASP 560  28.308  49.634  26.771
   70    HB3  ASP 560           HB3      ASP 560  28.291  48.542  28.127
   71    H    GLU 561           H        GLU 561  27.343  49.619  30.188
   72    HA   GLU 561           HA       GLU 561  29.158  48.891  32.397
   73    HB2  GLU 561           HB2      GLU 561  26.700  50.659  32.417
   74    HB3  GLU 561           HB3      GLU 561  26.849  49.582  33.765
   75    HG2  GLU 561           HG2      GLU 561  28.905  50.603  34.540
   76    HG3  GLU 561           HG3      GLU 561  29.184  51.346  32.980
   77    H    CYS 562           H        CYS 562  28.803  46.784  32.763
   78    HA   CYS 562           HA       CYS 562  26.231  45.482  32.279
   79    HB2  CYS 562           HB2      CYS 562  28.734  44.516  30.793
   80    HB3  CYS 562           HB3      CYS 562  27.069  43.930  30.624
   81    HG   CYS 562           HG       CYS 562  27.491  45.197  28.508
   82    H    PHE 563           H        PHE 563  26.800  42.886  32.401
   83    HA   PHE 563           HA       PHE 563  28.358  42.386  34.895
   84    HB2  PHE 563           HB2      PHE 563  25.572  41.476  34.054
   85    HB3  PHE 563           HB3      PHE 563  26.605  40.400  34.935
   86    HD1  PHE 563           HD1      PHE 563  27.418  40.747  37.129
   87    HD2  PHE 563           HD2      PHE 563  24.454  43.377  35.432
   88    HE1  PHE 563           HE1      PHE 563  26.897  41.645  39.393
   89    HE2  PHE 563           HE2      PHE 563  24.109  44.409  37.665
   90    HZ   PHE 563           HZ       PHE 563  25.380  43.611  39.613
   91    H    ALA 564           H        ALA 564  30.069  41.227  34.385
   92    HA   ALA 564           HA       ALA 564  30.007  39.541  31.926
   93    HB1  ALA 564           HB1      ALA 564  32.242  41.062  33.312
   94    HB2  ALA 564           HB2      ALA 564  32.392  39.989  31.885
   95    HB3  ALA 564           HB3      ALA 564  31.407  41.473  31.808
   96    H    LEU 565           H        LEU 565  30.222  37.453  32.181
   97    HA   LEU 565           HA       LEU 565  30.127  36.020  34.651
   98    HB2  LEU 565           HB2      LEU 565  29.244  35.396  32.344
   99    HB3  LEU 565           HB3      LEU 565  30.903  35.078  31.858
  100    HG   LEU 565           HG       LEU 565  31.026  33.114  33.391
  101   HD11  LEU 565          HD11      LEU 565  28.252  34.010  34.226
  102   HD12  LEU 565          HD12      LEU 565  28.970  32.401  34.564
  103   HD13  LEU 565          HD13      LEU 565  29.725  33.869  35.205
  104   HD21  LEU 565          HD21      LEU 565  28.624  32.938  31.579
  105   HD22  LEU 565          HD22      LEU 565  30.346  32.640  31.209
  106   HD23  LEU 565          HD23      LEU 565  29.529  31.628  32.379
  107    H    TYR 566           H        TYR 566  31.486  34.906  35.759
  108    HA   TYR 566           HA       TYR 566  34.327  35.340  35.278
  109    HB2  TYR 566           HB2      TYR 566  32.924  35.576  37.564
  110    HB3  TYR 566           HB3      TYR 566  33.195  33.837  37.642
  111    HD1  TYR 566           HD1      TYR 566  35.546  36.488  36.338
  112    HD2  TYR 566           HD2      TYR 566  34.661  33.811  39.625
  113    HE1  TYR 566           HE1      TYR 566  37.803  36.822  37.231
  114    HE2  TYR 566           HE2      TYR 566  36.948  34.203  40.510
  115    HH   TYR 566           HH       TYR 566  39.341  36.044  38.798
  116    H    TRP 567           H        TRP 567  35.583  33.323  36.366
  117    HA   TRP 567           HA       TRP 567  34.976  30.928  34.637
  118    HB2  TRP 567           HB2      TRP 567  37.457  30.547  34.450
  119    HB3  TRP 567           HB3      TRP 567  36.982  32.020  33.667
  120    HD1  TRP 567           HD1      TRP 567  37.708  34.298  34.793
  121    HE1  TRP 567           HE1      TRP 567  39.639  34.935  36.293
  122    HE3  TRP 567           HE3      TRP 567  38.985  29.643  36.576
  123    HZ2  TRP 567           HZ2      TRP 567  41.098  33.751  38.424
  124    HZ3  TRP 567           HZ3      TRP 567  40.514  29.491  38.556
  125    HH2  TRP 567           HH2      TRP 567  41.536  31.467  39.502
  126    H    GLU 568           H        GLU 568  36.801  31.893  37.537
  127    HA   GLU 568           HA       GLU 568  37.282  29.496  38.828
  128    HB2  GLU 568           HB2      GLU 568  38.019  31.636  39.478
  129    HB3  GLU 568           HB3      GLU 568  36.348  32.218  39.734
  130    HG2  GLU 568           HG2      GLU 568  37.098  31.931  41.848
  131    HG3  GLU 568           HG3      GLU 568  36.200  30.446  41.610
  132    H    ASP 569           H        ASP 569  34.336  31.462  39.286
  133    HA   ASP 569           HA       ASP 569  33.014  29.057  40.396
  134    HB2  ASP 569           HB2      ASP 569  31.692  30.499  41.775
  135    HB3  ASP 569           HB3      ASP 569  33.374  30.896  42.082
  136    H    ASN 570           H        ASN 570  32.834  31.391  37.985
  137    HA   ASN 570           HA       ASN 570  31.492  31.497  36.113
  138    HB2  ASN 570           HB2      ASN 570  31.525  28.930  36.403
  139    HB3  ASN 570           HB3      ASN 570  29.901  29.070  37.095
  140   HD21  ASN 570          HD22      ASN 570  31.621  30.447  34.262
  141   HD22  ASN 570          HD21      ASN 570  30.418  29.802  33.145
  142    H    LYS 571           H        LYS 571  30.861  33.025  38.601
  143    HA   LYS 571           HA       LYS 571  27.971  33.588  38.123
  144    HB2  LYS 571           HB2      LYS 571  29.795  33.838  40.432
  145    HB3  LYS 571           HB3      LYS 571  28.952  35.334  40.108
  146    HG2  LYS 571           HG2      LYS 571  27.392  32.727  40.215
  147    HG3  LYS 571           HG3      LYS 571  27.687  33.719  41.639
  148    HD2  LYS 571           HD2      LYS 571  26.595  35.681  40.328
  149    HD3  LYS 571           HD3      LYS 571  26.258  34.535  39.048
  150    HE2  LYS 571           HE2      LYS 571  24.333  34.693  40.282
  151    HE3  LYS 571           HE3      LYS 571  25.000  33.098  40.663
  152    HZ1  LYS 571           HZ1      LYS 571  25.566  33.844  42.816
  153    HZ2  LYS 571           HZ2      LYS 571  25.352  35.434  42.420
  154    HZ3  LYS 571           HZ3      LYS 571  24.094  34.423  42.543
  155    H    PHE 572           H        PHE 572  27.314  35.716  37.588
  156    HA   PHE 572           HA       PHE 572  29.329  37.191  36.035
  157    HB2  PHE 572           HB2      PHE 572  26.438  37.845  36.627
  158    HB3  PHE 572           HB3      PHE 572  27.535  38.607  35.432
  159    HD1  PHE 572           HD1      PHE 572  25.799  35.426  36.379
  160    HD2  PHE 572           HD2      PHE 572  27.711  37.682  33.230
  161    HE1  PHE 572           HE1      PHE 572  25.067  33.735  34.703
  162    HE2  PHE 572           HE2      PHE 572  26.894  36.032  31.574
  163    HZ   PHE 572           HZ       PHE 572  25.484  34.129  32.295
  164    H    TYR 573           H        TYR 573  30.043  39.357  36.480
  165    HA   TYR 573           HA       TYR 573  29.359  40.555  39.116
  166    HB2  TYR 573           HB2      TYR 573  32.087  39.984  37.927
  167    HB3  TYR 573           HB3      TYR 573  31.804  41.017  39.327
  168    HD1  TYR 573           HD1      TYR 573  30.922  40.036  41.458
  169    HD2  TYR 573           HD2      TYR 573  31.977  37.542  38.125
  170    HE1  TYR 573           HE1      TYR 573  31.085  38.085  42.976
  171    HE2  TYR 573           HE2      TYR 573  32.230  35.582  39.650
  172    HH   TYR 573           HH       TYR 573  31.912  34.869  42.050
  173    H    ARG 574           H        ARG 574  29.455  42.905  39.089
  174    HA   ARG 574           HA       ARG 574  28.781  44.260  36.701
  175    HB2  ARG 574           HB2      ARG 574  30.012  45.408  39.238
  176    HB3  ARG 574           HB3      ARG 574  29.311  46.359  37.922
  177    HG2  ARG 574           HG2      ARG 574  27.123  45.625  38.332
  178    HG3  ARG 574           HG3      ARG 574  27.673  44.281  39.371
  179    HD2  ARG 574           HD2      ARG 574  28.432  45.862  41.056
  180    HD3  ARG 574           HD3      ARG 574  27.889  47.229  40.105
  181    HE   ARG 574           HE       ARG 574  26.334  45.342  41.716
  182   HH11  ARG 574          HH11      ARG 574  26.006  47.526  38.948
  183   HH12  ARG 574          HH12      ARG 574  24.277  47.509  39.018
  184   HH21  ARG 574          HH21      ARG 574  24.174  45.747  41.985
  185   HH22  ARG 574          HH22      ARG 574  23.231  46.635  40.808
  186    H    ALA 575           H        ALA 575  29.903  45.157  35.082
  187    HA   ALA 575           HA       ALA 575  32.681  45.942  35.418
  188    HB1  ALA 575           HB1      ALA 575  33.405  44.554  33.396
  189    HB2  ALA 575           HB2      ALA 575  32.836  43.469  34.663
  190    HB3  ALA 575           HB3      ALA 575  31.768  43.861  33.324
  191    H    GLU 576           H        GLU 576  33.220  47.718  34.183
  192    HA   GLU 576           HA       GLU 576  31.169  48.753  32.357
  193    HB2  GLU 576           HB2      GLU 576  33.935  49.860  32.846
  194    HB3  GLU 576           HB3      GLU 576  32.472  50.579  32.001
  195    HG2  GLU 576           HG2      GLU 576  31.315  50.677  34.066
  196    HG3  GLU 576           HG3      GLU 576  32.761  50.071  34.937
  197    H    VAL 577           H        VAL 577  31.066  48.317  30.450
  198    HA   VAL 577           HA       VAL 577  32.839  46.682  28.956
  199    HB   VAL 577           HB       VAL 577  30.550  48.580  28.293
  200   HG11  VAL 577          HG11      VAL 577  32.595  47.381  26.438
  201   HG12  VAL 577          HG12      VAL 577  30.907  47.634  25.893
  202   HG13  VAL 577          HG13      VAL 577  31.888  49.009  26.463
  203   HG21  VAL 577          HG21      VAL 577  30.045  46.439  29.226
  204   HG22  VAL 577          HG22      VAL 577  29.603  46.504  27.492
  205   HG23  VAL 577          HG23      VAL 577  31.090  45.634  28.030
  206    H    GLU 578           H        GLU 578  34.846  47.168  28.145
  207    HA   GLU 578           HA       GLU 578  35.493  50.019  27.665
  208    HB2  GLU 578           HB2      GLU 578  37.057  48.517  29.120
  209    HB3  GLU 578           HB3      GLU 578  37.370  47.613  27.660
  210    HG2  GLU 578           HG2      GLU 578  39.142  49.212  28.193
  211    HG3  GLU 578           HG3      GLU 578  38.460  49.445  26.597
  212    H    ALA 579           H        ALA 579  35.646  46.827  25.883
  213    HA   ALA 579           HA       ALA 579  35.585  48.338  23.333
  214    HB1  ALA 579           HB1      ALA 579  37.928  48.441  24.045
  215    HB2  ALA 579           HB2      ALA 579  37.990  46.672  24.137
  216    HB3  ALA 579           HB3      ALA 579  37.732  47.485  22.573
  217    H    LEU 580           H        LEU 580  33.904  47.281  22.399
  218    HA   LEU 580           HA       LEU 580  33.888  44.263  22.393
  219    HB2  LEU 580           HB2      LEU 580  31.427  45.985  22.342
  220    HB3  LEU 580           HB3      LEU 580  31.524  44.280  22.643
  221    HG   LEU 580           HG       LEU 580  32.056  46.610  24.416
  222   HD11  LEU 580          HD11      LEU 580  30.626  43.983  24.887
  223   HD12  LEU 580          HD12      LEU 580  30.697  45.251  26.088
  224   HD13  LEU 580          HD13      LEU 580  29.877  45.606  24.591
  225   HD21  LEU 580          HD21      LEU 580  33.862  45.794  25.478
  226   HD22  LEU 580          HD22      LEU 580  32.801  44.582  26.157
  227   HD23  LEU 580          HD23      LEU 580  33.753  44.222  24.700
  228    H    HIS 581           H        HIS 581  34.975  44.005  20.293
  229    HA   HIS 581           HA       HIS 581  33.345  44.954  17.970
  230    HB2  HIS 581           HB2      HIS 581  35.564  46.131  18.321
  231    HB3  HIS 581           HB3      HIS 581  36.346  44.577  17.891
  232    HD2  HIS 581           HD2      HIS 581  37.412  45.716  15.583
  233    HE1  HIS 581           HE1      HIS 581  33.659  46.484  13.715
  234    HE2  HIS 581           HE2      HIS 581  36.197  46.526  13.404
  235    H    SER 582           H        SER 582  33.878  43.786  15.847
  236    HA   SER 582           HA       SER 582  33.213  41.029  15.927
  237    HB2  SER 582           HB2      SER 582  33.440  41.249  13.400
  238    HB3  SER 582           HB3      SER 582  32.350  42.427  14.118
  239    HG   SER 582           HG       SER 582  34.909  42.933  13.213
  240    H    SER 583           H        SER 583  35.952  41.717  17.064
  241    HA   SER 583           HA       SER 583  38.126  40.865  15.666
  242    HB2  SER 583           HB2      SER 583  37.344  40.655  18.547
  243    HB3  SER 583           HB3      SER 583  38.992  40.304  17.969
  244    HG   SER 583           HG       SER 583  38.813  42.442  18.568
  245    H    GLY 584           H        GLY 584  35.619  38.624  16.905
  246    HA2  GLY 584           HA2      GLY 584  36.347  36.403  15.503
  247    HA3  GLY 584           HA3      GLY 584  37.328  36.242  16.935
  248    H    MET 585           H        MET 585  35.814  36.975  18.996
  249    HA   MET 585           HA       MET 585  33.166  35.798  19.135
  250    HB2  MET 585           HB2      MET 585  33.709  33.815  20.490
  251    HB3  MET 585           HB3      MET 585  34.566  33.776  18.974
  252    HG2  MET 585           HG2      MET 585  36.611  34.583  20.014
  253    HG3  MET 585           HG3      MET 585  35.811  34.664  21.605
  254    HE1  MET 585           HE1      MET 585  38.619  33.280  21.104
  255    HE2  MET 585           HE2      MET 585  37.956  33.150  22.725
  256    HE3  MET 585           HE3      MET 585  38.451  31.675  21.852
  257    H    THR 586           H        THR 586  35.642  37.736  20.653
  258    HA   THR 586           HA       THR 586  34.196  37.727  23.285
  259    HB   THR 586           HB       THR 586  36.370  38.204  24.350
  260    HG1  THR 586           HG1      THR 586  38.025  37.470  22.619
  261   HG21  THR 586          HG21      THR 586  36.954  35.743  22.766
  262   HG22  THR 586          HG22      THR 586  37.177  36.071  24.456
  263   HG23  THR 586          HG23      THR 586  35.515  35.832  23.866
  264    H    ALA 587           H        ALA 587  34.846  39.549  24.660
  265    HA   ALA 587           HA       ALA 587  34.824  42.227  23.424
  266    HB1  ALA 587           HB1      ALA 587  32.665  40.736  24.918
  267    HB2  ALA 587           HB2      ALA 587  32.875  42.411  25.348
  268    HB3  ALA 587           HB3      ALA 587  32.517  41.984  23.645
  269    H    VAL 588           H        VAL 588  35.862  43.736  24.815
  270    HA   VAL 588           HA       VAL 588  37.158  42.613  27.258
  271    HB   VAL 588           HB       VAL 588  37.835  45.340  26.219
  272   HG11  VAL 588          HG11      VAL 588  39.935  45.036  27.296
  273   HG12  VAL 588          HG12      VAL 588  38.756  44.458  28.463
  274   HG13  VAL 588          HG13      VAL 588  39.698  43.302  27.493
  275   HG21  VAL 588          HG21      VAL 588  39.783  44.088  24.996
  276   HG22  VAL 588          HG22      VAL 588  38.840  42.607  25.269
  277   HG23  VAL 588          HG23      VAL 588  38.206  43.890  24.225
  278    H    VAL 589           H        VAL 589  36.871  43.300  29.277
  279    HA   VAL 589           HA       VAL 589  34.954  45.476  29.848
  280    HB   VAL 589           HB       VAL 589  33.480  44.018  31.141
  281   HG11  VAL 589          HG11      VAL 589  32.951  44.663  28.785
  282   HG12  VAL 589          HG12      VAL 589  33.488  43.041  28.293
  283   HG13  VAL 589          HG13      VAL 589  32.168  43.231  29.468
  284   HG21  VAL 589          HG21      VAL 589  35.214  41.740  30.092
  285   HG22  VAL 589          HG22      VAL 589  34.521  41.967  31.695
  286   HG23  VAL 589          HG23      VAL 589  33.482  41.510  30.339
  287    H    LYS 590           H        LYS 590  35.485  46.580  31.623
  288    HA   LYS 590           HA       LYS 590  37.478  45.537  33.542
  289    HB2  LYS 590           HB2      LYS 590  37.876  47.749  32.453
  290    HB3  LYS 590           HB3      LYS 590  36.353  48.333  33.079
  291    HG2  LYS 590           HG2      LYS 590  37.219  48.232  35.410
  292    HG3  LYS 590           HG3      LYS 590  38.619  47.340  34.878
  293    HD2  LYS 590           HD2      LYS 590  39.600  49.275  33.820
  294    HD3  LYS 590           HD3      LYS 590  38.074  50.132  33.770
  295    HE2  LYS 590           HE2      LYS 590  39.311  49.454  36.453
  296    HE3  LYS 590           HE3      LYS 590  39.904  50.799  35.468
  297    HZ1  LYS 590           HZ1      LYS 590  37.571  51.555  35.371
  298    HZ2  LYS 590           HZ2      LYS 590  37.155  50.509  36.517
  299    HZ3  LYS 590           HZ3      LYS 590  38.250  51.694  36.813
  300    H    PHE 591           H        PHE 591  36.733  44.474  35.157
  301    HA   PHE 591           HA       PHE 591  34.124  44.668  36.272
  302    HB2  PHE 591           HB2      PHE 591  36.797  43.735  37.423
  303    HB3  PHE 591           HB3      PHE 591  35.237  43.317  38.138
  304    HD1  PHE 591           HD2      PHE 591  33.556  42.051  36.940
  305    HD2  PHE 591           HD1      PHE 591  37.678  42.052  35.674
  306    HE1  PHE 591           HE2      PHE 591  33.151  40.006  35.521
  307    HE2  PHE 591           HE1      PHE 591  37.273  40.017  34.361
  308    HZ   PHE 591           HZ       PHE 591  35.015  39.012  34.245
  309    H    ILE 592           H        ILE 592  33.243  45.988  37.946
  310    HA   ILE 592           HA       ILE 592  34.745  48.497  37.918
  311    HB   ILE 592           HB       ILE 592  32.040  48.423  39.270
  312   HG12  ILE 592          HG12      ILE 592  32.601  48.157  36.315
  313   HG13  ILE 592          HG13      ILE 592  31.554  47.200  37.391
  314   HG21  ILE 592          HG21      ILE 592  33.617  50.391  37.589
  315   HG22  ILE 592          HG22      ILE 592  32.042  50.722  38.362
  316   HG23  ILE 592          HG23      ILE 592  33.454  50.418  39.370
  317   HD11  ILE 592          HD11      ILE 592  31.003  49.916  36.190
  318   HD12  ILE 592          HD12      ILE 592  30.079  48.415  36.066
  319   HD13  ILE 592          HD13      ILE 592  30.093  49.305  37.598
  320    H    ASP 593           H        ASP 593  33.754  46.124  40.328
  321    HA   ASP 593           HA       ASP 593  34.817  47.647  42.580
  322    HB2  ASP 593           HB2      ASP 593  32.723  46.244  42.662
  323    HB3  ASP 593           HB3      ASP 593  33.750  44.807  42.548
  324    H    TYR 594           H        TYR 594  36.317  45.915  40.159
  325    HA   TYR 594           HA       TYR 594  38.567  45.079  41.978
  326    HB2  TYR 594           HB2      TYR 594  37.927  43.830  39.294
  327    HB3  TYR 594           HB3      TYR 594  39.218  43.430  40.431
  328    HD1  TYR 594           HD1      TYR 594  35.480  43.630  40.165
  329    HD2  TYR 594           HD2      TYR 594  38.856  41.751  42.082
  330    HE1  TYR 594           HE1      TYR 594  33.940  42.252  41.544
  331    HE2  TYR 594           HE2      TYR 594  37.319  40.244  43.299
  332    HH   TYR 594           HH       TYR 594  33.791  40.435  42.877
  333    H    GLY 595           H        GLY 595  37.723  46.732  38.923
  334    HA2  GLY 595           HA2      GLY 595  38.667  48.669  38.123
  335    HA3  GLY 595           HA3      GLY 595  40.050  48.505  39.227
  336    H    ASN 596           H        ASN 596  39.443  45.654  37.287
  337    HA   ASN 596           HA       ASN 596  41.318  46.638  35.186
  338    HB2  ASN 596           HB2      ASN 596  41.870  44.427  37.151
  339    HB3  ASN 596           HB3      ASN 596  42.558  44.379  35.503
  340   HD21  ASN 596          HD22      ASN 596  43.221  45.485  38.566
  341   HD22  ASN 596          HD21      ASN 596  44.547  46.520  38.054
  342    H    TYR 597           H        TYR 597  41.626  45.020  33.428
  343    HA   TYR 597           HA       TYR 597  38.982  43.796  32.884
  344    HB2  TYR 597           HB2      TYR 597  39.414  44.742  30.440
  345    HB3  TYR 597           HB3      TYR 597  38.480  45.590  31.602
  346    HD1  TYR 597           HD2      TYR 597  40.250  47.138  33.263
  347    HD2  TYR 597           HD1      TYR 597  40.511  46.409  29.017
  348    HE1  TYR 597           HE2      TYR 597  41.839  48.958  33.072
  349    HE2  TYR 597           HE1      TYR 597  42.044  48.270  28.785
  350    HH   TYR 597           HH       TYR 597  43.192  49.938  29.904
  351    H    GLU 598           H        GLU 598  38.745  42.406  31.168
  352    HA   GLU 598           HA       GLU 598  40.978  41.587  29.533
  353    HB2  GLU 598           HB2      GLU 598  40.799  39.217  30.066
  354    HB3  GLU 598           HB3      GLU 598  41.298  40.120  31.521
  355    HG2  GLU 598           HG2      GLU 598  39.091  39.856  32.508
  356    HG3  GLU 598           HG3      GLU 598  38.455  39.143  31.029
  357    H    GLU 599           H        GLU 599  40.212  39.726  28.004
  358    HA   GLU 599           HA       GLU 599  37.648  40.452  26.810
  359    HB2  GLU 599           HB2      GLU 599  38.116  38.928  25.118
  360    HB3  GLU 599           HB3      GLU 599  39.564  39.827  25.394
  361    HG2  GLU 599           HG2      GLU 599  38.952  36.943  26.281
  362    HG3  GLU 599           HG3      GLU 599  40.066  37.451  25.042
  363    H    VAL 600           H        VAL 600  35.856  39.105  26.603
  364    HA   VAL 600           HA       VAL 600  35.741  36.426  27.786
  365    HB   VAL 600           HB       VAL 600  33.477  38.316  28.519
  366   HG11  VAL 600          HG11      VAL 600  34.538  35.924  30.083
  367   HG12  VAL 600          HG12      VAL 600  33.014  36.775  30.311
  368   HG13  VAL 600          HG13      VAL 600  33.250  35.788  28.864
  369   HG21  VAL 600          HG21      VAL 600  35.939  37.983  30.256
  370   HG22  VAL 600          HG22      VAL 600  35.387  39.465  29.469
  371   HG23  VAL 600          HG23      VAL 600  34.385  38.731  30.738
  372    H    LEU 601           H        LEU 601  34.126  35.186  26.752
  373    HA   LEU 601           HA       LEU 601  33.260  35.768  24.172
  374    HB2  LEU 601           HB2      LEU 601  33.259  33.582  25.548
  375    HB3  LEU 601           HB3      LEU 601  31.668  34.112  26.127
  376    HG   LEU 601           HG       LEU 601  30.971  34.267  23.652
  377   HD11  LEU 601          HD11      LEU 601  32.335  32.926  22.070
  378   HD12  LEU 601          HD12      LEU 601  33.293  34.324  22.603
  379   HD13  LEU 601          HD13      LEU 601  33.603  32.732  23.300
  380   HD21  LEU 601          HD21      LEU 601  30.586  31.990  23.287
  381   HD22  LEU 601          HD22      LEU 601  31.955  31.491  24.268
  382   HD23  LEU 601          HD23      LEU 601  30.492  32.205  25.047
  383    H    LEU 602           H        LEU 602  31.533  36.980  23.267
  384    HA   LEU 602           HA       LEU 602  30.415  39.128  24.708
  385    HB2  LEU 602           HB2      LEU 602  29.506  37.617  22.256
  386    HB3  LEU 602           HB3      LEU 602  28.744  39.104  22.743
  387    HG   LEU 602           HG       LEU 602  31.775  39.123  22.393
  388   HD11  LEU 602          HD11      LEU 602  29.887  39.533  20.019
  389   HD12  LEU 602          HD12      LEU 602  31.648  39.555  20.057
  390   HD13  LEU 602          HD13      LEU 602  30.759  38.027  20.352
  391   HD21  LEU 602          HD21      LEU 602  30.517  41.117  23.230
  392   HD22  LEU 602          HD22      LEU 602  31.448  41.405  21.743
  393   HD23  LEU 602          HD23      LEU 602  29.702  41.186  21.622
  394    H    SER 603           H        SER 603  28.950  36.097  23.718
  395    HA   SER 603           HA       SER 603  26.486  36.166  25.100
  396    HB2  SER 603           HB2      SER 603  27.925  33.607  24.315
  397    HB3  SER 603           HB3      SER 603  26.219  33.844  24.583
  398    HG   SER 603           HG       SER 603  26.750  33.826  22.429
  399    H    ASN 604           H        ASN 604  29.172  36.415  26.757
  400    HA   ASN 604           HA       ASN 604  28.279  34.918  29.195
  401    HB2  ASN 604           HB2      ASN 604  31.150  35.439  28.201
  402    HB3  ASN 604           HB3      ASN 604  30.801  35.221  29.859
  403   HD21  ASN 604          HD22      ASN 604  28.540  33.270  28.376
  404   HD22  ASN 604          HD21      ASN 604  29.491  31.797  28.262
  405    H    ILE 605           H        ILE 605  28.205  37.794  27.836
  406    HA   ILE 605           HA       ILE 605  28.426  39.282  30.439
  407    HB   ILE 605           HB       ILE 605  28.374  40.534  27.708
  408   HG12  ILE 605          HG12      ILE 605  30.943  39.762  29.139
  409   HG13  ILE 605          HG13      ILE 605  30.295  39.034  27.688
  410   HG21  ILE 605          HG21      ILE 605  29.572  41.522  30.349
  411   HG22  ILE 605          HG22      ILE 605  29.230  42.501  28.901
  412   HG23  ILE 605          HG23      ILE 605  27.901  41.864  29.868
  413   HD11  ILE 605          HD11      ILE 605  30.845  42.027  27.603
  414   HD12  ILE 605          HD12      ILE 605  32.123  40.814  27.411
  415   HD13  ILE 605          HD13      ILE 605  30.710  40.846  26.319
  416    H    LYS 606           H        LYS 606  26.572  39.510  31.249
  417    HA   LYS 606           HA       LYS 606  24.044  39.897  29.725
  418    HB2  LYS 606           HB2      LYS 606  24.843  39.346  32.600
  419    HB3  LYS 606           HB3      LYS 606  23.165  39.692  32.153
  420    HG2  LYS 606           HG2      LYS 606  24.871  37.392  31.096
  421    HG3  LYS 606           HG3      LYS 606  23.620  37.270  32.308
  422    HD2  LYS 606           HD2      LYS 606  21.973  38.238  30.505
  423    HD3  LYS 606           HD3      LYS 606  23.270  37.923  29.331
  424    HE2  LYS 606           HE2      LYS 606  23.336  35.644  29.829
  425    HE3  LYS 606           HE3      LYS 606  22.104  35.800  31.120
  426    HZ1  LYS 606           HZ1      LYS 606  21.541  36.541  28.316
  427    HZ2  LYS 606           HZ2      LYS 606  21.208  35.064  28.955
  428    HZ3  LYS 606           HZ3      LYS 606  20.491  36.365  29.547
  429    HA   PRO 607           HA       PRO 607  23.901  44.296  30.432
  430    HB2  PRO 607           HB2      PRO 607  21.285  44.792  30.990
  431    HB3  PRO 607           HB3      PRO 607  21.907  44.292  29.367
  432    HG2  PRO 607           HG2      PRO 607  20.560  42.591  31.496
  433    HG3  PRO 607           HG3      PRO 607  20.275  42.569  29.724
  434    HD2  PRO 607           HD2      PRO 607  21.816  40.841  31.113
  435    HD3  PRO 607           HD3      PRO 607  22.135  41.243  29.386
  436    H    ILE 608           H        ILE 608  23.833  45.947  32.037
  437    HA   ILE 608           HA       ILE 608  23.299  45.183  34.867
  438    HB   ILE 608           HB       ILE 608  24.972  47.118  33.401
  439   HG12  ILE 608          HG12      ILE 608  24.992  46.133  36.260
  440   HG13  ILE 608          HG13      ILE 608  25.921  45.545  34.881
  441   HG21  ILE 608          HG21      ILE 608  23.430  48.403  35.644
  442   HG22  ILE 608          HG22      ILE 608  24.771  49.125  34.720
  443   HG23  ILE 608          HG23      ILE 608  23.299  48.787  33.891
  444   HD11  ILE 608          HD11      ILE 608  26.262  48.382  35.927
  445   HD12  ILE 608          HD12      ILE 608  27.183  46.992  36.518
  446   HD13  ILE 608          HD13      ILE 608  27.311  47.475  34.817
  447    H    LEU 609           H        LEU 609  21.914  46.962  32.272
  448    HA   LEU 609           HA       LEU 609  19.477  47.678  33.801
  449    HB2  LEU 609           HB2      LEU 609  20.933  49.594  33.912
  450    HB3  LEU 609           HB3      LEU 609  21.305  49.504  32.194
  451    HG   LEU 609           HG       LEU 609  18.786  50.064  31.791
  452   HD11  LEU 609          HD11      LEU 609  19.071  50.557  34.777
  453   HD12  LEU 609          HD12      LEU 609  17.723  51.174  33.796
  454   HD13  LEU 609          HD13      LEU 609  17.950  49.418  34.005
  455   HD21  LEU 609          HD21      LEU 609  19.016  52.403  32.147
  456   HD22  LEU 609          HD22      LEU 609  20.261  52.199  33.393
  457   HD23  LEU 609          HD23      LEU 609  20.637  51.819  31.705
  458    H    GLU 610           H        GLU 610  17.946  46.615  32.574
  459    HA   GLU 610           HA       GLU 610  17.822  46.832  29.601
  460    HB2  GLU 610           HB2      GLU 610  17.430  44.472  29.231
  461    HB3  GLU 610           HB3      GLU 610  18.985  44.745  29.902
  462    HG2  GLU 610           HG2      GLU 610  18.313  44.047  32.083
  463    HG3  GLU 610           HG3      GLU 610  16.609  44.125  31.692
  464    H1   TYR 611           H1       TYR 611  59.101  41.583  31.298
  465    H2   TYR 611           H2       TYR 611  59.725  41.308  32.809
  466    H3   TYR 611           H3       TYR 611  59.236  42.803  32.403
  467    HA   TYR 611           HA       TYR 611  57.014  42.195  32.205
  468    HB2  TYR 611           HB2      TYR 611  58.032  39.393  32.864
  469    HB3  TYR 611           HB3      TYR 611  56.329  39.840  32.910
  470    HD1  TYR 611           HD2      TYR 611  55.257  40.981  30.926
  471    HD2  TYR 611           HD1      TYR 611  58.941  38.733  30.730
  472    HE1  TYR 611           HE2      TYR 611  54.931  40.667  28.493
  473    HE2  TYR 611           HE1      TYR 611  58.532  38.301  28.309
  474    HH   TYR 611           HH       TYR 611  57.164  38.923  26.497
  475    H    SER 612           H        SER 612  55.617  41.657  33.959
  476    HA   SER 612           HA       SER 612  56.384  41.176  36.600
  477    HB2  SER 612           HB2      SER 612  56.677  43.951  35.773
  478    HB3  SER 612           HB3      SER 612  55.274  43.855  36.839
  479    HG   SER 612           HG       SER 612  56.998  43.867  38.212
  480    HA   PRO 613           HA       PRO 613  52.127  40.168  36.694
  481    HB2  PRO 613           HB2      PRO 613  51.085  40.874  39.146
  482    HB3  PRO 613           HB3      PRO 613  52.242  39.535  38.855
  483    HG2  PRO 613           HG2      PRO 613  52.830  42.313  39.873
  484    HG3  PRO 613           HG3      PRO 613  53.459  40.733  40.445
  485    HD2  PRO 613           HD2      PRO 613  54.912  42.264  38.866
  486    HD3  PRO 613           HD3      PRO 613  54.892  40.480  38.711
  487    H    SER 614           H        SER 614  49.863  40.812  37.067
  488    HA   SER 614           HA       SER 614  49.303  43.429  35.745
  489    HB2  SER 614           HB2      SER 614  47.715  40.906  35.309
  490    HB3  SER 614           HB3      SER 614  47.839  42.363  34.297
  491    HG   SER 614           HG       SER 614  50.053  41.737  34.003
  492    H    SER 615           H        SER 615  49.122  43.501  38.508
  493    HA   SER 615           HA       SER 615  47.932  43.600  40.439
  494    HB2  SER 615           HB2      SER 615  45.776  44.618  38.612
  495    HB3  SER 615           HB3      SER 615  45.942  44.955  40.351
  496    HG   SER 615           HG       SER 615  46.702  46.534  38.923
  497    HA   PRO 616           HA       PRO 616  45.109  39.846  39.577
  498    HB2  PRO 616           HB2      PRO 616  46.373  37.886  40.907
  499    HB3  PRO 616           HB3      PRO 616  46.801  38.329  39.238
  500    HG2  PRO 616           HG2      PRO 616  48.220  39.354  41.761
  501    HG3  PRO 616           HG3      PRO 616  48.953  38.574  40.322
  502    HD2  PRO 616           HD2      PRO 616  48.844  41.270  40.501
  503    HD3  PRO 616           HD3      PRO 616  48.447  40.454  38.956
  504   HC11  DA2 617          HC11      DA2 617  35.955  39.803  37.883
  505   HC12  DA2 617          HC12      DA2 617  37.057  40.717  38.889
  506   HC13  DA2 617          HC13      DA2 617  37.644  39.345  37.894
  507   HC21  DA2 617          HC21      DA2 617  34.649  38.488  38.858
  508   HC22  DA2 617          HC22      DA2 617  34.736  38.632  40.619
  509   HC23  DA2 617          HC23      DA2 617  35.311  37.152  39.814
  510    H2   DA2 617           H        DA2 617  43.710  39.002  41.022
  511    HA   DA2 617           HA       DA2 617  42.926  40.564  43.257
  512   HCB1  DA2 617          HCB1      DA2 617  41.267  38.682  43.523
  513   HCB2  DA2 617          HCB2      DA2 617  42.190  37.735  42.363
  514   HCG1  DA2 617          HCG1      DA2 617  40.777  40.364  41.759
  515   HCG2  DA2 617          HCG2      DA2 617  41.717  39.387  40.592
  516   HCD1  DA2 617          HCD1      DA2 617  40.279  37.476  40.919
  517   HCD2  DA2 617          HCD2      DA2 617  39.531  38.224  42.347
  518    HNE  DA2 617           HNE      DA2 617  39.040  39.655  39.835
  519   HNH2  DA2 617          HNH2      DA2 617  37.809  37.453  42.361
  520   HNH1  DA2 617          HNH1      DA2 617  36.407  37.009  41.476
  521    H    TYR 618           H        TYR 618  44.926  37.632  43.171
  522    HA   TYR 618           HA       TYR 618  44.979  37.241  45.962
  523    HB2  TYR 618           HB2      TYR 618  47.406  37.025  44.153
  524    HB3  TYR 618           HB3      TYR 618  47.086  36.136  45.643
  525    HD1  TYR 618           HD1      TYR 618  45.017  34.594  45.659
  526    HD2  TYR 618           HD2      TYR 618  46.753  36.202  42.088
  527    HE1  TYR 618           HE1      TYR 618  44.041  32.696  44.349
  528    HE2  TYR 618           HE2      TYR 618  45.655  34.368  40.730
  529    HH   TYR 618           HH       TYR 618  43.998  31.721  42.251
  530    H    THR 619           H        THR 619  46.675  39.703  44.005
  531    HA   THR 619           HA       THR 619  47.217  41.254  46.381
  532    HB   THR 619           HB       THR 619  49.097  39.821  46.506
  533    HG1  THR 619           HG1      THR 619  50.417  41.896  45.357
  534   HG21  THR 619          HG21      THR 619  50.759  39.309  44.898
  535   HG22  THR 619          HG22      THR 619  49.209  38.952  44.184
  536   HG23  THR 619          HG23      THR 619  50.099  40.396  43.672
  537    HA   PRO 620           HA       PRO 620  46.740  43.818  42.576
  538    HB2  PRO 620           HB2      PRO 620  44.402  45.235  43.116
  539    HB3  PRO 620           HB3      PRO 620  44.471  43.639  42.307
  540    HG2  PRO 620           HG2      PRO 620  43.940  44.387  45.151
  541    HG3  PRO 620           HG3      PRO 620  43.086  43.158  44.165
  542    HD2  PRO 620           HD2      PRO 620  45.024  42.627  46.064
  543    HD3  PRO 620           HD3      PRO 620  44.728  41.538  44.693
  544    H    GLN 621           H        GLN 621  47.674  44.449  45.683
  545    HA   GLN 621           HA       GLN 621  48.798  46.982  44.993
  546    HB2  GLN 621           HB2      GLN 621  47.568  48.473  46.467
  547    HB3  GLN 621           HB3      GLN 621  46.409  47.587  45.527
  548    HG2  GLN 621           HG2      GLN 621  46.477  45.908  47.605
  549    HG3  GLN 621           HG3      GLN 621  47.129  47.330  48.449
  550   HE21  GLN 621          HE22      GLN 621  45.862  49.028  48.931
  551   HE22  GLN 621          HE21      GLN 621  44.113  49.069  48.721
  552    H    SER 622           H        SER 622  49.734  47.948  47.132
  553    HA   SER 622           HA       SER 622  50.895  45.884  48.914
  554    HB2  SER 622           HB2      SER 622  52.227  48.087  47.277
  555    HB3  SER 622           HB3      SER 622  53.049  47.399  48.674
  556    HG   SER 622           HG       SER 622  52.922  45.415  47.671
  557    HA   PRO 623           HA       PRO 623  50.040  48.897  52.081
  558    HB2  PRO 623           HB2      PRO 623  51.620  48.001  54.173
  559    HB3  PRO 623           HB3      PRO 623  50.235  47.055  53.576
  560    HG2  PRO 623           HG2      PRO 623  53.164  46.804  52.897
  561    HG3  PRO 623           HG3      PRO 623  51.999  45.479  53.221
  562    HD2  PRO 623           HD2      PRO 623  52.861  46.394  50.753
  563    HD3  PRO 623           HD3      PRO 623  51.269  45.562  50.958
  Start of MODEL   11
    1    H1   MET 553           H1       MET 553  23.575  35.516  21.123
    2    H2   MET 553           H2       MET 553  24.790  34.891  22.023
    3    H3   MET 553           H3       MET 553  24.994  35.228  20.420
    4    HA   MET 553           HA       MET 553  24.329  37.560  20.960
    5    HB2  MET 553           HB2      MET 553  23.454  37.412  23.023
    6    HB3  MET 553           HB3      MET 553  24.877  36.574  23.720
    7    HG2  MET 553           HG2      MET 553  24.544  38.954  24.447
    8    HG3  MET 553           HG3      MET 553  26.112  38.536  23.822
    9    HE1  MET 553           HE1      MET 553  22.620  40.226  22.892
   10    HE2  MET 553           HE2      MET 553  23.464  41.736  23.295
   11    HE3  MET 553           HE3      MET 553  23.094  41.367  21.621
   12    H    LYS 554           H        LYS 554  25.739  38.292  19.722
   13    HA   LYS 554           HA       LYS 554  28.492  38.814  20.698
   14    HB2  LYS 554           HB2      LYS 554  29.603  38.177  18.735
   15    HB3  LYS 554           HB3      LYS 554  28.601  36.814  19.232
   16    HG2  LYS 554           HG2      LYS 554  26.879  37.516  17.563
   17    HG3  LYS 554           HG3      LYS 554  27.944  38.830  17.026
   18    HD2  LYS 554           HD2      LYS 554  29.661  36.946  16.467
   19    HD3  LYS 554           HD3      LYS 554  28.302  35.845  16.775
   20    HE2  LYS 554           HE2      LYS 554  26.935  37.269  15.157
   21    HE3  LYS 554           HE3      LYS 554  28.402  38.094  14.676
   22    HZ1  LYS 554           HZ1      LYS 554  29.299  35.851  14.063
   23    HZ2  LYS 554           HZ2      LYS 554  27.782  35.273  14.220
   24    HZ3  LYS 554           HZ3      LYS 554  28.114  36.440  13.138
   25    H    MET 555           H        MET 555  25.702  40.217  19.330
   26    HA   MET 555           HA       MET 555  26.773  42.330  17.740
   27    HB2  MET 555           HB2      MET 555  24.292  42.330  19.530
   28    HB3  MET 555           HB3      MET 555  24.663  43.564  18.352
   29    HG2  MET 555           HG2      MET 555  24.679  41.965  16.539
   30    HG3  MET 555           HG3      MET 555  24.184  40.672  17.671
   31    HE1  MET 555           HE1      MET 555  22.534  41.419  14.937
   32    HE2  MET 555           HE2      MET 555  22.022  40.140  16.083
   33    HE3  MET 555           HE3      MET 555  20.878  41.387  15.548
   34    H    TRP 556           H        TRP 556  27.034  42.014  21.171
   35    HA   TRP 556           HA       TRP 556  27.526  44.232  22.398
   36    HB2  TRP 556           HB2      TRP 556  29.268  41.856  21.913
   37    HB3  TRP 556           HB3      TRP 556  29.947  43.170  22.854
   38    HD1  TRP 556           HD1      TRP 556  28.687  40.119  23.742
   39    HE1  TRP 556           HE1      TRP 556  27.560  40.115  26.009
   40    HE3  TRP 556           HE3      TRP 556  27.826  45.167  24.288
   41    HZ2  TRP 556           HZ2      TRP 556  26.016  41.940  27.632
   42    HZ3  TRP 556           HZ3      TRP 556  26.450  45.962  26.227
   43    HH2  TRP 556           HH2      TRP 556  25.446  44.367  27.775
   44    H    LYS 557           H        LYS 557  29.209  45.762  22.860
   45    HA   LYS 557           HA       LYS 557  31.056  46.734  20.802
   46    HB2  LYS 557           HB2      LYS 557  28.569  48.384  21.491
   47    HB3  LYS 557           HB3      LYS 557  29.951  48.958  20.583
   48    HG2  LYS 557           HG2      LYS 557  29.485  47.337  18.755
   49    HG3  LYS 557           HG3      LYS 557  28.122  46.698  19.660
   50    HD2  LYS 557           HD2      LYS 557  28.288  49.596  18.763
   51    HD3  LYS 557           HD3      LYS 557  27.484  48.300  17.844
   52    HE2  LYS 557           HE2      LYS 557  26.159  47.848  19.987
   53    HE3  LYS 557           HE3      LYS 557  26.772  49.403  20.544
   54    HZ1  LYS 557           HZ1      LYS 557  25.062  48.928  18.165
   55    HZ2  LYS 557           HZ2      LYS 557  24.756  49.946  19.404
   56    HZ3  LYS 557           HZ3      LYS 557  25.903  50.309  18.346
   57    HA   PRO 558           HA       PRO 558  33.392  47.973  24.200
   58    HB2  PRO 558           HB2      PRO 558  35.042  49.898  23.196
   59    HB3  PRO 558           HB3      PRO 558  35.149  48.196  22.789
   60    HG2  PRO 558           HG2      PRO 558  33.543  50.398  21.419
   61    HG3  PRO 558           HG3      PRO 558  34.791  49.381  20.627
   62    HD2  PRO 558           HD2      PRO 558  32.158  48.869  20.373
   63    HD3  PRO 558           HD3      PRO 558  33.179  47.489  20.669
   64    H    GLY 559           H        GLY 559  33.572  49.595  25.895
   65    HA2  GLY 559           HA2      GLY 559  33.278  51.555  26.971
   66    HA3  GLY 559           HA3      GLY 559  32.609  52.271  25.520
   67    H    ASP 560           H        ASP 560  31.366  49.463  27.542
   68    HA   ASP 560           HA       ASP 560  29.061  51.021  28.471
   69    HB2  ASP 560           HB2      ASP 560  28.581  49.997  26.068
   70    HB3  ASP 560           HB3      ASP 560  28.332  48.514  26.971
   71    H    GLU 561           H        GLU 561  29.032  50.677  30.467
   72    HA   GLU 561           HA       GLU 561  29.889  48.421  31.910
   73    HB2  GLU 561           HB2      GLU 561  28.857  49.422  33.818
   74    HB3  GLU 561           HB3      GLU 561  29.652  50.657  32.850
   75    HG2  GLU 561           HG2      GLU 561  27.433  51.449  32.031
   76    HG3  GLU 561           HG3      GLU 561  26.628  50.258  33.028
   77    H    CYS 562           H        CYS 562  29.214  46.483  32.080
   78    HA   CYS 562           HA       CYS 562  26.387  45.701  32.004
   79    HB2  CYS 562           HB2      CYS 562  28.603  44.732  30.108
   80    HB3  CYS 562           HB3      CYS 562  27.055  43.925  30.311
   81    HG   CYS 562           HG       CYS 562  27.954  46.793  29.077
   82    H    PHE 563           H        PHE 563  26.822  42.904  32.109
   83    HA   PHE 563           HA       PHE 563  28.444  42.527  34.577
   84    HB2  PHE 563           HB2      PHE 563  25.645  41.657  33.773
   85    HB3  PHE 563           HB3      PHE 563  26.594  40.687  34.886
   86    HD1  PHE 563           HD1      PHE 563  27.475  41.648  36.977
   87    HD2  PHE 563           HD2      PHE 563  24.327  43.443  34.701
   88    HE1  PHE 563           HE1      PHE 563  26.882  43.083  38.955
   89    HE2  PHE 563           HE2      PHE 563  23.681  44.833  36.694
   90    HZ   PHE 563           HZ       PHE 563  24.955  44.661  38.780
   91    H    ALA 564           H        ALA 564  29.859  40.807  34.427
   92    HA   ALA 564           HA       ALA 564  29.704  39.123  31.955
   93    HB1  ALA 564           HB1      ALA 564  31.482  40.634  31.696
   94    HB2  ALA 564           HB2      ALA 564  31.952  40.503  33.430
   95    HB3  ALA 564           HB3      ALA 564  32.237  39.140  32.338
   96    H    LEU 565           H        LEU 565  29.765  37.056  32.249
   97    HA   LEU 565           HA       LEU 565  29.543  35.861  34.826
   98    HB2  LEU 565           HB2      LEU 565  28.464  35.196  32.624
   99    HB3  LEU 565           HB3      LEU 565  30.058  34.723  32.062
  100    HG   LEU 565           HG       LEU 565  30.081  32.854  33.716
  101   HD11  LEU 565          HD11      LEU 565  27.472  34.073  34.673
  102   HD12  LEU 565          HD12      LEU 565  28.090  32.472  35.154
  103   HD13  LEU 565          HD13      LEU 565  29.047  33.906  35.519
  104   HD21  LEU 565          HD21      LEU 565  28.053  31.615  32.873
  105   HD22  LEU 565          HD22      LEU 565  27.559  33.078  31.982
  106   HD23  LEU 565          HD23      LEU 565  29.097  32.292  31.619
  107    H    TYR 566           H        TYR 566  31.301  35.540  36.107
  108    HA   TYR 566           HA       TYR 566  34.000  35.226  34.987
  109    HB2  TYR 566           HB2      TYR 566  33.317  36.479  37.094
  110    HB3  TYR 566           HB3      TYR 566  33.120  34.910  37.872
  111    HD1  TYR 566           HD1      TYR 566  35.756  36.370  35.617
  112    HD2  TYR 566           HD2      TYR 566  34.836  34.579  39.393
  113    HE1  TYR 566           HE1      TYR 566  38.164  36.557  36.275
  114    HE2  TYR 566           HE2      TYR 566  37.243  34.704  40.053
  115    HH   TYR 566           HH       TYR 566  39.764  35.846  37.870
  116    H    TRP 567           H        TRP 567  35.195  33.364  36.533
  117    HA   TRP 567           HA       TRP 567  34.073  30.797  35.392
  118    HB2  TRP 567           HB2      TRP 567  36.382  30.199  35.012
  119    HB3  TRP 567           HB3      TRP 567  35.818  31.601  34.105
  120    HD1  TRP 567           HD1      TRP 567  37.282  33.897  34.528
  121    HE1  TRP 567           HE1      TRP 567  39.384  34.420  35.919
  122    HE3  TRP 567           HE3      TRP 567  37.865  29.477  37.177
  123    HZ2  TRP 567           HZ2      TRP 567  41.038  33.287  37.658
  124    HZ3  TRP 567           HZ3      TRP 567  39.703  29.345  38.834
  125    HH2  TRP 567           HH2      TRP 567  41.341  31.207  39.066
  126    H    GLU 568           H        GLU 568  35.836  32.211  38.119
  127    HA   GLU 568           HA       GLU 568  36.487  29.936  39.590
  128    HB2  GLU 568           HB2      GLU 568  37.521  31.721  40.055
  129    HB3  GLU 568           HB3      GLU 568  36.130  32.824  39.876
  130    HG2  GLU 568           HG2      GLU 568  35.248  32.121  42.037
  131    HG3  GLU 568           HG3      GLU 568  36.723  31.124  42.293
  132    H    ASP 569           H        ASP 569  33.407  31.869  39.811
  133    HA   ASP 569           HA       ASP 569  32.249  29.410  41.018
  134    HB2  ASP 569           HB2      ASP 569  30.832  30.617  42.501
  135    HB3  ASP 569           HB3      ASP 569  32.529  30.993  42.791
  136    H    ASN 570           H        ASN 570  32.237  31.199  38.358
  137    HA   ASN 570           HA       ASN 570  30.907  31.499  36.593
  138    HB2  ASN 570           HB2      ASN 570  31.000  29.031  36.904
  139    HB3  ASN 570           HB3      ASN 570  29.377  29.110  37.619
  140   HD21  ASN 570          HD22      ASN 570  28.061  28.193  36.011
  141   HD22  ASN 570          HD21      ASN 570  28.073  28.812  34.354
  142    H    LYS 571           H        LYS 571  30.259  33.292  38.657
  143    HA   LYS 571           HA       LYS 571  27.351  33.728  38.237
  144    HB2  LYS 571           HB2      LYS 571  29.084  33.915  40.626
  145    HB3  LYS 571           HB3      LYS 571  28.529  35.494  40.250
  146    HG2  LYS 571           HG2      LYS 571  26.752  33.086  40.784
  147    HG3  LYS 571           HG3      LYS 571  27.037  34.481  41.810
  148    HD2  LYS 571           HD2      LYS 571  25.951  35.939  39.952
  149    HD3  LYS 571           HD3      LYS 571  25.585  34.445  39.092
  150    HE2  LYS 571           HE2      LYS 571  24.300  33.566  40.812
  151    HE3  LYS 571           HE3      LYS 571  24.642  34.926  41.917
  152    HZ1  LYS 571           HZ1      LYS 571  23.381  35.258  39.277
  153    HZ2  LYS 571           HZ2      LYS 571  22.495  35.025  40.625
  154    HZ3  LYS 571           HZ3      LYS 571  23.395  36.358  40.496
  155    H    PHE 572           H        PHE 572  26.754  36.079  37.792
  156    HA   PHE 572           HA       PHE 572  28.781  37.234  35.961
  157    HB2  PHE 572           HB2      PHE 572  26.048  38.308  36.695
  158    HB3  PHE 572           HB3      PHE 572  27.154  38.883  35.439
  159    HD1  PHE 572           HD1      PHE 572  25.135  35.823  36.386
  160    HD2  PHE 572           HD2      PHE 572  27.093  38.082  33.273
  161    HE1  PHE 572           HE1      PHE 572  24.153  34.357  34.675
  162    HE2  PHE 572           HE2      PHE 572  26.548  36.308  31.656
  163    HZ   PHE 572           HZ       PHE 572  25.095  34.377  32.364
  164    H    TYR 573           H        TYR 573  29.880  39.258  36.322
  165    HA   TYR 573           HA       TYR 573  29.392  40.631  38.909
  166    HB2  TYR 573           HB2      TYR 573  32.073  39.893  37.711
  167    HB3  TYR 573           HB3      TYR 573  31.832  40.957  39.086
  168    HD1  TYR 573           HD2      TYR 573  31.484  37.382  37.948
  169    HD2  TYR 573           HD1      TYR 573  31.612  40.063  41.322
  170    HE1  TYR 573           HE2      TYR 573  31.716  35.437  39.491
  171    HE2  TYR 573           HE1      TYR 573  31.995  38.090  42.838
  172    HH   TYR 573           HH       TYR 573  31.821  34.823  41.747
  173    H    ARG 574           H        ARG 574  29.583  42.856  38.765
  174    HA   ARG 574           HA       ARG 574  28.974  44.201  36.353
  175    HB2  ARG 574           HB2      ARG 574  29.234  46.198  37.535
  176    HB3  ARG 574           HB3      ARG 574  28.384  45.009  38.504
  177    HG2  ARG 574           HG2      ARG 574  30.229  44.633  39.970
  178    HG3  ARG 574           HG3      ARG 574  31.362  45.558  38.967
  179    HD2  ARG 574           HD2      ARG 574  30.041  47.575  39.283
  180    HD3  ARG 574           HD3      ARG 574  28.920  46.691  40.325
  181    HE   ARG 574           HE       ARG 574  31.282  46.295  41.678
  182   HH11  ARG 574          HH11      ARG 574  29.946  49.307  40.292
  183   HH12  ARG 574          HH12      ARG 574  30.839  50.275  41.399
  184   HH21  ARG 574          HH21      ARG 574  32.116  47.771  43.261
  185   HH22  ARG 574          HH22      ARG 574  31.936  49.491  43.017
  186    H    ALA 575           H        ALA 575  30.082  44.898  34.670
  187    HA   ALA 575           HA       ALA 575  32.916  45.509  34.959
  188    HB1  ALA 575           HB1      ALA 575  32.020  43.542  32.792
  189    HB2  ALA 575           HB2      ALA 575  33.659  43.869  33.426
  190    HB3  ALA 575           HB3      ALA 575  32.436  42.982  34.390
  191    H    GLU 576           H        GLU 576  33.512  47.242  33.897
  192    HA   GLU 576           HA       GLU 576  31.906  48.541  31.848
  193    HB2  GLU 576           HB2      GLU 576  34.432  49.151  33.357
  194    HB3  GLU 576           HB3      GLU 576  34.126  49.941  31.774
  195    HG2  GLU 576           HG2      GLU 576  31.929  50.652  32.573
  196    HG3  GLU 576           HG3      GLU 576  32.377  50.136  34.223
  197    H    VAL 577           H        VAL 577  31.815  47.394  30.075
  198    HA   VAL 577           HA       VAL 577  33.585  45.873  28.628
  199    HB   VAL 577           HB       VAL 577  31.322  47.685  27.783
  200   HG11  VAL 577          HG11      VAL 577  33.192  46.143  26.038
  201   HG12  VAL 577          HG12      VAL 577  31.458  46.250  25.623
  202   HG13  VAL 577          HG13      VAL 577  32.365  47.734  25.814
  203   HG21  VAL 577          HG21      VAL 577  30.811  45.592  29.060
  204   HG22  VAL 577          HG22      VAL 577  30.239  45.515  27.373
  205   HG23  VAL 577          HG23      VAL 577  31.706  44.647  27.834
  206    H    GLU 578           H        GLU 578  35.446  46.122  27.759
  207    HA   GLU 578           HA       GLU 578  36.546  48.797  27.008
  208    HB2  GLU 578           HB2      GLU 578  37.730  47.310  28.697
  209    HB3  GLU 578           HB3      GLU 578  37.919  46.103  27.430
  210    HG2  GLU 578           HG2      GLU 578  40.005  47.269  27.684
  211    HG3  GLU 578           HG3      GLU 578  39.355  47.591  26.123
  212    H    ALA 579           H        ALA 579  36.187  45.515  25.638
  213    HA   ALA 579           HA       ALA 579  36.301  46.621  22.906
  214    HB1  ALA 579           HB1      ALA 579  38.472  44.758  23.910
  215    HB2  ALA 579           HB2      ALA 579  38.270  45.419  22.259
  216    HB3  ALA 579           HB3      ALA 579  38.642  46.491  23.661
  217    H    LEU 580           H        LEU 580  34.485  45.395  21.991
  218    HA   LEU 580           HA       LEU 580  34.345  42.439  22.532
  219    HB2  LEU 580           HB2      LEU 580  31.890  44.056  22.149
  220    HB3  LEU 580           HB3      LEU 580  32.089  42.407  22.714
  221    HG   LEU 580           HG       LEU 580  32.680  45.026  24.054
  222   HD11  LEU 580          HD11      LEU 580  30.758  42.765  24.838
  223   HD12  LEU 580          HD12      LEU 580  31.208  43.990  25.960
  224   HD13  LEU 580          HD13      LEU 580  30.428  44.477  24.431
  225   HD21  LEU 580          HD21      LEU 580  34.036  44.284  25.700
  226   HD22  LEU 580          HD22      LEU 580  33.078  42.884  25.988
  227   HD23  LEU 580          HD23      LEU 580  34.299  42.852  24.675
  228    H    HIS 581           H        HIS 581  35.580  42.379  20.622
  229    HA   HIS 581           HA       HIS 581  34.668  42.790  17.950
  230    HB2  HIS 581           HB2      HIS 581  36.930  42.438  18.836
  231    HB3  HIS 581           HB3      HIS 581  36.612  40.708  18.974
  232    HD2  HIS 581           HD2      HIS 581  36.647  39.275  16.710
  233    HE1  HIS 581           HE1      HIS 581  37.840  42.400  14.075
  234    HE2  HIS 581           HE2      HIS 581  37.605  39.868  14.365
  235    H    SER 582           H        SER 582  32.794  42.125  17.207
  236    HA   SER 582           HA       SER 582  31.293  39.905  18.036
  237    HB2  SER 582           HB2      SER 582  31.333  41.400  15.386
  238    HB3  SER 582           HB3      SER 582  30.020  40.332  15.946
  239    HG   SER 582           HG       SER 582  29.816  41.718  17.722
  240    H    SER 583           H        SER 583  33.561  40.215  15.328
  241    HA   SER 583           HA       SER 583  33.147  37.556  14.286
  242    HB2  SER 583           HB2      SER 583  35.095  39.804  13.577
  243    HB3  SER 583           HB3      SER 583  35.069  38.281  12.713
  244    HG   SER 583           HG       SER 583  32.927  38.742  12.142
  245    H    GLY 584           H        GLY 584  33.986  37.204  16.916
  246    HA2  GLY 584           HA2      GLY 584  36.299  35.455  16.775
  247    HA3  GLY 584           HA3      GLY 584  36.670  36.943  17.628
  248    H    MET 585           H        MET 585  36.848  34.617  19.064
  249    HA   MET 585           HA       MET 585  34.370  33.656  20.081
  250    HB2  MET 585           HB2      MET 585  36.328  32.341  19.806
  251    HB3  MET 585           HB3      MET 585  37.186  33.216  21.083
  252    HG2  MET 585           HG2      MET 585  35.511  32.507  22.729
  253    HG3  MET 585           HG3      MET 585  34.613  31.620  21.500
  254    HE1  MET 585           HE1      MET 585  37.608  31.967  23.706
  255    HE2  MET 585           HE2      MET 585  38.671  30.558  23.329
  256    HE3  MET 585           HE3      MET 585  38.570  31.948  22.230
  257    H    THR 586           H        THR 586  36.240  36.453  21.274
  258    HA   THR 586           HA       THR 586  34.858  36.240  23.929
  259    HB   THR 586           HB       THR 586  37.151  37.046  24.897
  260    HG1  THR 586           HG1      THR 586  38.814  36.201  23.765
  261   HG21  THR 586          HG21      THR 586  36.475  34.967  25.603
  262   HG22  THR 586          HG22      THR 586  36.510  34.270  23.945
  263   HG23  THR 586          HG23      THR 586  38.013  34.598  24.832
  264    H    ALA 587           H        ALA 587  35.357  38.152  25.370
  265    HA   ALA 587           HA       ALA 587  35.463  40.743  24.013
  266    HB1  ALA 587           HB1      ALA 587  33.206  40.872  24.210
  267    HB2  ALA 587           HB2      ALA 587  33.093  39.386  25.192
  268    HB3  ALA 587           HB3      ALA 587  33.457  40.903  25.983
  269    H    VAL 588           H        VAL 588  36.365  42.274  25.181
  270    HA   VAL 588           HA       VAL 588  37.694  41.437  27.698
  271    HB   VAL 588           HB       VAL 588  38.263  44.009  26.281
  272   HG11  VAL 588          HG11      VAL 588  40.379  43.816  27.378
  273   HG12  VAL 588          HG12      VAL 588  39.178  43.330  28.610
  274   HG13  VAL 588          HG13      VAL 588  40.140  42.112  27.746
  275   HG21  VAL 588          HG21      VAL 588  38.555  42.177  24.532
  276   HG22  VAL 588          HG22      VAL 588  40.093  42.911  25.058
  277   HG23  VAL 588          HG23      VAL 588  39.599  41.317  25.663
  278    H    VAL 589           H        VAL 589  37.016  42.165  29.562
  279    HA   VAL 589           HA       VAL 589  35.451  44.671  29.802
  280    HB   VAL 589           HB       VAL 589  33.724  43.569  31.100
  281   HG11  VAL 589          HG11      VAL 589  33.834  42.132  28.421
  282   HG12  VAL 589          HG12      VAL 589  32.462  42.743  29.335
  283   HG13  VAL 589          HG13      VAL 589  33.626  43.874  28.570
  284   HG21  VAL 589          HG21      VAL 589  34.533  41.571  32.022
  285   HG22  VAL 589          HG22      VAL 589  33.563  40.971  30.642
  286   HG23  VAL 589          HG23      VAL 589  35.343  41.072  30.554
  287    H    LYS 590           H        LYS 590  36.123  45.869  31.566
  288    HA   LYS 590           HA       LYS 590  37.973  44.835  33.602
  289    HB2  LYS 590           HB2      LYS 590  38.554  46.936  32.527
  290    HB3  LYS 590           HB3      LYS 590  36.980  47.624  32.821
  291    HG2  LYS 590           HG2      LYS 590  37.407  47.923  35.176
  292    HG3  LYS 590           HG3      LYS 590  38.845  46.904  35.100
  293    HD2  LYS 590           HD2      LYS 590  40.087  48.503  33.877
  294    HD3  LYS 590           HD3      LYS 590  38.739  49.537  33.532
  295    HE2  LYS 590           HE2      LYS 590  39.625  49.147  36.422
  296    HE3  LYS 590           HE3      LYS 590  40.526  50.136  35.286
  297    HZ1  LYS 590           HZ1      LYS 590  38.894  51.383  36.609
  298    HZ2  LYS 590           HZ2      LYS 590  38.582  51.526  35.001
  299    HZ3  LYS 590           HZ3      LYS 590  37.676  50.572  35.940
  300    H    PHE 591           H        PHE 591  37.109  43.906  35.391
  301    HA   PHE 591           HA       PHE 591  34.480  44.232  36.396
  302    HB2  PHE 591           HB2      PHE 591  37.010  43.463  37.796
  303    HB3  PHE 591           HB3      PHE 591  35.344  43.188  38.387
  304    HD1  PHE 591           HD2      PHE 591  33.689  42.046  36.820
  305    HD2  PHE 591           HD1      PHE 591  37.940  41.779  36.307
  306    HE1  PHE 591           HE2      PHE 591  33.383  39.989  35.425
  307    HE2  PHE 591           HE1      PHE 591  37.648  39.679  34.983
  308    HZ   PHE 591           HZ       PHE 591  35.360  38.896  34.402
  309    H    ILE 592           H        ILE 592  33.542  45.994  37.304
  310    HA   ILE 592           HA       ILE 592  34.902  48.437  37.727
  311    HB   ILE 592           HB       ILE 592  32.155  48.006  38.832
  312   HG12  ILE 592          HG12      ILE 592  32.909  47.760  35.923
  313   HG13  ILE 592          HG13      ILE 592  31.944  46.688  36.956
  314   HG21  ILE 592          HG21      ILE 592  33.134  50.211  36.974
  315   HG22  ILE 592          HG22      ILE 592  31.753  50.258  38.088
  316   HG23  ILE 592          HG23      ILE 592  33.408  50.334  38.699
  317   HD11  ILE 592          HD11      ILE 592  31.136  49.326  35.730
  318   HD12  ILE 592          HD12      ILE 592  30.648  47.690  35.260
  319   HD13  ILE 592          HD13      ILE 592  30.080  48.365  36.811
  320    H    ASP 593           H        ASP 593  34.447  45.814  39.710
  321    HA   ASP 593           HA       ASP 593  34.935  47.067  42.388
  322    HB2  ASP 593           HB2      ASP 593  33.147  45.074  41.509
  323    HB3  ASP 593           HB3      ASP 593  34.431  44.142  42.244
  324    H    TYR 594           H        TYR 594  36.835  45.572  40.021
  325    HA   TYR 594           HA       TYR 594  39.002  44.921  41.963
  326    HB2  TYR 594           HB2      TYR 594  38.291  43.116  39.635
  327    HB3  TYR 594           HB3      TYR 594  39.518  42.853  40.849
  328    HD1  TYR 594           HD1      TYR 594  35.806  42.976  40.294
  329    HD2  TYR 594           HD2      TYR 594  38.971  41.570  42.828
  330    HE1  TYR 594           HE1      TYR 594  34.175  41.587  41.527
  331    HE2  TYR 594           HE2      TYR 594  37.277  40.308  44.208
  332    HH   TYR 594           HH       TYR 594  33.823  40.301  43.412
  333    H    GLY 595           H        GLY 595  38.166  46.682  39.300
  334    HA2  GLY 595           HA2      GLY 595  39.325  48.260  38.180
  335    HA3  GLY 595           HA3      GLY 595  40.703  47.905  39.217
  336    H    ASN 596           H        ASN 596  40.263  45.045  37.616
  337    HA   ASN 596           HA       ASN 596  41.973  45.889  35.312
  338    HB2  ASN 596           HB2      ASN 596  42.436  43.427  37.044
  339    HB3  ASN 596           HB3      ASN 596  43.222  43.831  35.498
  340   HD21  ASN 596          HD22      ASN 596  43.662  44.085  38.855
  341   HD22  ASN 596          HD21      ASN 596  44.913  45.331  38.707
  342    H    TYR 597           H        TYR 597  41.896  44.520  33.433
  343    HA   TYR 597           HA       TYR 597  39.231  43.282  33.016
  344    HB2  TYR 597           HB2      TYR 597  40.359  43.644  30.510
  345    HB3  TYR 597           HB3      TYR 597  39.068  44.602  31.118
  346    HD1  TYR 597           HD2      TYR 597  40.869  46.476  33.013
  347    HD2  TYR 597           HD1      TYR 597  41.176  44.993  28.979
  348    HE1  TYR 597           HE2      TYR 597  42.502  48.173  32.548
  349    HE2  TYR 597           HE1      TYR 597  42.692  46.828  28.403
  350    HH   TYR 597           HH       TYR 597  43.950  48.553  29.270
  351    H    GLU 598           H        GLU 598  38.977  41.664  31.509
  352    HA   GLU 598           HA       GLU 598  41.167  40.170  30.328
  353    HB2  GLU 598           HB2      GLU 598  40.445  38.037  31.443
  354    HB3  GLU 598           HB3      GLU 598  41.398  39.208  32.410
  355    HG2  GLU 598           HG2      GLU 598  39.465  39.948  33.604
  356    HG3  GLU 598           HG3      GLU 598  38.396  38.912  32.616
  357    H    GLU 599           H        GLU 599  40.410  38.487  28.954
  358    HA   GLU 599           HA       GLU 599  38.015  38.613  27.467
  359    HB2  GLU 599           HB2      GLU 599  39.923  36.371  28.091
  360    HB3  GLU 599           HB3      GLU 599  38.562  36.214  26.950
  361    HG2  GLU 599           HG2      GLU 599  39.388  38.065  25.621
  362    HG3  GLU 599           HG3      GLU 599  40.710  38.344  26.761
  363    H    VAL 600           H        VAL 600  36.016  38.167  27.975
  364    HA   VAL 600           HA       VAL 600  35.265  35.649  29.347
  365    HB   VAL 600           HB       VAL 600  33.624  38.261  29.423
  366   HG11  VAL 600          HG11      VAL 600  33.160  35.444  30.422
  367   HG12  VAL 600          HG12      VAL 600  32.219  36.807  31.045
  368   HG13  VAL 600          HG13      VAL 600  32.163  36.452  29.334
  369   HG21  VAL 600          HG21      VAL 600  35.602  38.523  30.778
  370   HG22  VAL 600          HG22      VAL 600  34.228  38.369  31.831
  371   HG23  VAL 600          HG23      VAL 600  35.318  36.965  31.573
  372    H    LEU 601           H        LEU 601  33.497  34.537  28.143
  373    HA   LEU 601           HA       LEU 601  33.534  34.933  25.282
  374    HB2  LEU 601           HB2      LEU 601  32.570  32.860  26.945
  375    HB3  LEU 601           HB3      LEU 601  31.115  33.589  26.335
  376    HG   LEU 601           HG       LEU 601  32.221  33.328  23.951
  377   HD11  LEU 601          HD11      LEU 601  33.728  31.500  23.737
  378   HD12  LEU 601          HD12      LEU 601  34.454  32.711  24.834
  379   HD13  LEU 601          HD13      LEU 601  33.758  31.218  25.497
  380   HD21  LEU 601          HD21      LEU 601  30.237  32.156  24.725
  381   HD22  LEU 601          HD22      LEU 601  31.298  31.014  23.876
  382   HD23  LEU 601          HD23      LEU 601  31.206  31.018  25.658
  383    H    LEU 602           H        LEU 602  31.767  35.788  23.866
  384    HA   LEU 602           HA       LEU 602  30.649  38.234  24.909
  385    HB2  LEU 602           HB2      LEU 602  30.194  36.594  22.401
  386    HB3  LEU 602           HB3      LEU 602  29.459  38.164  22.678
  387    HG   LEU 602           HG       LEU 602  32.457  38.064  23.054
  388   HD11  LEU 602          HD11      LEU 602  31.220  37.854  20.288
  389   HD12  LEU 602          HD12      LEU 602  32.946  38.004  20.655
  390   HD13  LEU 602          HD13      LEU 602  32.098  36.525  21.103
  391   HD21  LEU 602          HD21      LEU 602  31.087  40.222  23.005
  392   HD22  LEU 602          HD22      LEU 602  32.356  40.141  21.767
  393   HD23  LEU 602          HD23      LEU 602  30.670  39.809  21.319
  394    H    SER 603           H        SER 603  29.349  35.043  24.356
  395    HA   SER 603           HA       SER 603  26.614  35.701  25.142
  396    HB2  SER 603           HB2      SER 603  27.949  33.107  24.293
  397    HB3  SER 603           HB3      SER 603  26.219  33.247  24.696
  398    HG   SER 603           HG       SER 603  27.594  34.718  22.743
  399    H    ASN 604           H        ASN 604  29.108  35.613  26.994
  400    HA   ASN 604           HA       ASN 604  27.900  34.443  29.488
  401    HB2  ASN 604           HB2      ASN 604  30.721  34.604  28.417
  402    HB3  ASN 604           HB3      ASN 604  30.398  34.455  30.110
  403   HD21  ASN 604          HD22      ASN 604  31.860  32.458  29.450
  404   HD22  ASN 604          HD21      ASN 604  30.973  30.989  29.141
  405    H    ILE 605           H        ILE 605  28.204  37.306  27.779
  406    HA   ILE 605           HA       ILE 605  28.312  38.798  30.376
  407    HB   ILE 605           HB       ILE 605  28.549  40.035  27.600
  408   HG12  ILE 605          HG12      ILE 605  30.818  39.536  29.588
  409   HG13  ILE 605          HG13      ILE 605  30.528  38.386  28.305
  410   HG21  ILE 605          HG21      ILE 605  27.796  41.591  29.276
  411   HG22  ILE 605          HG22      ILE 605  29.229  41.201  30.274
  412   HG23  ILE 605          HG23      ILE 605  29.397  41.979  28.670
  413   HD11  ILE 605          HD11      ILE 605  32.275  39.723  27.532
  414   HD12  ILE 605          HD12      ILE 605  30.880  40.234  26.599
  415   HD13  ILE 605          HD13      ILE 605  31.440  41.241  27.962
  416    H    LYS 606           H        LYS 606  26.447  39.516  31.134
  417    HA   LYS 606           HA       LYS 606  24.116  39.924  29.310
  418    HB2  LYS 606           HB2      LYS 606  24.296  39.413  32.304
  419    HB3  LYS 606           HB3      LYS 606  22.811  39.942  31.489
  420    HG2  LYS 606           HG2      LYS 606  23.076  37.969  29.920
  421    HG3  LYS 606           HG3      LYS 606  24.455  37.443  30.941
  422    HD2  LYS 606           HD2      LYS 606  22.962  37.424  32.885
  423    HD3  LYS 606           HD3      LYS 606  21.593  37.813  31.859
  424    HE2  LYS 606           HE2      LYS 606  23.234  35.213  31.821
  425    HE3  LYS 606           HE3      LYS 606  21.595  35.418  32.404
  426    HZ1  LYS 606           HZ1      LYS 606  21.545  34.432  30.274
  427    HZ2  LYS 606           HZ2      LYS 606  20.919  35.888  30.096
  428    HZ3  LYS 606           HZ3      LYS 606  22.469  35.529  29.596
  429    HA   PRO 607           HA       PRO 607  24.711  44.294  29.949
  430    HB2  PRO 607           HB2      PRO 607  22.199  45.344  29.549
  431    HB3  PRO 607           HB3      PRO 607  23.206  44.700  28.228
  432    HG2  PRO 607           HG2      PRO 607  21.165  43.149  29.931
  433    HG3  PRO 607           HG3      PRO 607  21.115  43.287  28.137
  434    HD2  PRO 607           HD2      PRO 607  22.191  41.177  29.365
  435    HD3  PRO 607           HD3      PRO 607  23.105  41.928  27.993
  436    H    ILE 608           H        ILE 608  23.723  46.110  31.313
  437    HA   ILE 608           HA       ILE 608  23.191  45.224  34.083
  438    HB   ILE 608           HB       ILE 608  24.877  47.017  32.839
  439   HG12  ILE 608          HG12      ILE 608  24.216  46.903  35.753
  440   HG13  ILE 608          HG13      ILE 608  25.217  45.800  34.752
  441   HG21  ILE 608          HG21      ILE 608  22.754  48.735  34.114
  442   HG22  ILE 608          HG22      ILE 608  24.419  49.262  33.748
  443   HG23  ILE 608          HG23      ILE 608  23.365  48.803  32.433
  444   HD11  ILE 608          HD11      ILE 608  25.828  48.734  35.323
  445   HD12  ILE 608          HD12      ILE 608  26.783  47.364  35.864
  446   HD13  ILE 608          HD13      ILE 608  26.689  47.693  34.140
  447    H    LEU 609           H        LEU 609  21.353  46.541  31.453
  448    HA   LEU 609           HA       LEU 609  19.024  47.202  33.237
  449    HB2  LEU 609           HB2      LEU 609  20.635  49.067  32.214
  450    HB3  LEU 609           HB3      LEU 609  19.926  48.566  30.705
  451    HG   LEU 609           HG       LEU 609  17.643  49.229  31.605
  452   HD11  LEU 609          HD11      LEU 609  19.310  50.069  34.020
  453   HD12  LEU 609          HD12      LEU 609  17.695  50.735  33.654
  454   HD13  LEU 609          HD13      LEU 609  17.913  49.006  33.969
  455   HD21  LEU 609          HD21      LEU 609  19.077  50.614  30.197
  456   HD22  LEU 609          HD22      LEU 609  18.104  51.629  31.261
  457   HD23  LEU 609          HD23      LEU 609  19.827  51.345  31.631
  458    H    GLU 610           H        GLU 610  16.949  47.166  32.204
  459    HA   GLU 610           HA       GLU 610  16.576  45.379  29.876
  460    HB2  GLU 610           HB2      GLU 610  15.247  43.891  31.065
  461    HB3  GLU 610           HB3      GLU 610  16.745  44.023  31.958
  462    HG2  GLU 610           HG2      GLU 610  14.152  45.429  32.729
  463    HG3  GLU 610           HG3      GLU 610  14.708  43.917  33.393
  464    H1   TYR 611           H1       TYR 611  53.823  47.506  52.820
  465    H2   TYR 611           H2       TYR 611  52.572  46.623  53.427
  466    H3   TYR 611           H3       TYR 611  52.405  47.490  52.044
  467    HA   TYR 611           HA       TYR 611  54.022  46.071  50.916
  468    HB2  TYR 611           HB2      TYR 611  53.817  44.492  53.493
  469    HB3  TYR 611           HB3      TYR 611  54.450  43.872  51.978
  470    HD1  TYR 611           HD2      TYR 611  55.104  46.487  54.580
  471    HD2  TYR 611           HD1      TYR 611  56.634  44.129  51.332
  472    HE1  TYR 611           HE2      TYR 611  57.406  47.407  54.987
  473    HE2  TYR 611           HE1      TYR 611  58.945  44.942  51.809
  474    HH   TYR 611           HH       TYR 611  60.190  46.615  53.023
  475    H    SER 612           H        SER 612  52.906  45.032  49.380
  476    HA   SER 612           HA       SER 612  50.984  42.989  50.081
  477    HB2  SER 612           HB2      SER 612  49.032  44.117  48.875
  478    HB3  SER 612           HB3      SER 612  49.597  44.894  50.336
  479    HG   SER 612           HG       SER 612  49.447  46.424  49.029
  480    HA   PRO 613           HA       PRO 613  53.434  41.989  46.238
  481    HB2  PRO 613           HB2      PRO 613  53.990  39.366  46.864
  482    HB3  PRO 613           HB3      PRO 613  54.968  40.738  47.394
  483    HG2  PRO 613           HG2      PRO 613  52.701  39.382  48.912
  484    HG3  PRO 613           HG3      PRO 613  54.376  39.703  49.474
  485    HD2  PRO 613           HD2      PRO 613  52.409  41.418  50.140
  486    HD3  PRO 613           HD3      PRO 613  53.974  42.045  49.566
  487    H    SER 614           H        SER 614  50.468  40.665  47.555
  488    HA   SER 614           HA       SER 614  49.541  39.695  44.973
  489    HB2  SER 614           HB2      SER 614  49.960  37.646  47.184
  490    HB3  SER 614           HB3      SER 614  48.999  37.372  45.740
  491    HG   SER 614           HG       SER 614  51.285  38.348  44.943
  492    H    SER 615           H        SER 615  48.340  41.607  45.809
  493    HA   SER 615           HA       SER 615  45.860  40.732  47.195
  494    HB2  SER 615           HB2      SER 615  47.359  43.356  47.579
  495    HB3  SER 615           HB3      SER 615  45.748  42.998  48.230
  496    HG   SER 615           HG       SER 615  47.228  42.599  49.719
  497    HA   PRO 616           HA       PRO 616  45.311  43.687  43.440
  498    HB2  PRO 616           HB2      PRO 616  45.342  42.502  41.097
  499    HB3  PRO 616           HB3      PRO 616  46.870  42.859  41.963
  500    HG2  PRO 616           HG2      PRO 616  45.359  40.239  41.996
  501    HG3  PRO 616           HG3      PRO 616  47.079  40.444  41.561
  502    HD2  PRO 616           HD2      PRO 616  46.527  39.836  44.111
  503    HD3  PRO 616           HD3      PRO 616  47.702  41.142  43.745
  504   HC11  DA2 617          HC11      DA2 617  37.150  39.007  38.035
  505   HC12  DA2 617          HC12      DA2 617  35.403  39.190  38.105
  506   HC13  DA2 617          HC13      DA2 617  36.461  40.410  38.850
  507   HC21  DA2 617          HC21      DA2 617  34.628  38.762  41.152
  508   HC22  DA2 617          HC22      DA2 617  35.074  37.081  40.679
  509   HC23  DA2 617          HC23      DA2 617  34.250  38.125  39.538
  510    H2   DA2 617           H        DA2 617  43.788  40.463  43.979
  511    HA   DA2 617           HA       DA2 617  41.268  41.506  42.784
  512   HCB1  DA2 617          HCB1      DA2 617  42.108  38.678  42.160
  513   HCB2  DA2 617          HCB2      DA2 617  42.872  39.977  41.302
  514   HCG1  DA2 617          HCG1      DA2 617  40.262  40.714  40.911
  515   HCG2  DA2 617          HCG2      DA2 617  41.264  39.710  39.827
  516   HCD1  DA2 617          HCD1      DA2 617  40.292  37.698  40.697
  517   HCD2  DA2 617          HCD2      DA2 617  39.588  38.625  42.073
  518    HNE  DA2 617           HNE      DA2 617  38.629  39.307  39.363
  519   HNH2  DA2 617          HNH2      DA2 617  38.176  37.490  42.383
  520   HNH1  DA2 617          HNH1      DA2 617  36.476  37.267  42.160
  521    H    TYR 618           H        TYR 618  42.501  40.239  45.686
  522    HA   TYR 618           HA       TYR 618  39.872  39.066  46.417
  523    HB2  TYR 618           HB2      TYR 618  42.511  37.588  46.667
  524    HB3  TYR 618           HB3      TYR 618  40.974  37.049  47.297
  525    HD1  TYR 618           HD1      TYR 618  39.025  36.682  45.587
  526    HD2  TYR 618           HD2      TYR 618  43.141  37.138  44.391
  527    HE1  TYR 618           HE1      TYR 618  38.528  35.596  43.408
  528    HE2  TYR 618           HE2      TYR 618  42.688  35.739  42.354
  529    HH   TYR 618           HH       TYR 618  39.583  34.258  41.863
  530    H    THR 619           H        THR 619  39.656  38.554  48.734
  531    HA   THR 619           HA       THR 619  39.355  39.426  50.850
  532    HB   THR 619           HB       THR 619  42.356  39.627  50.773
  533    HG1  THR 619           HG1      THR 619  42.202  37.462  51.498
  534   HG21  THR 619          HG21      THR 619  42.285  38.859  53.180
  535   HG22  THR 619          HG22      THR 619  41.532  40.432  52.966
  536   HG23  THR 619          HG23      THR 619  40.536  39.001  53.195
  537    HA   PRO 620           HA       PRO 620  40.409  43.693  49.364
  538    HB2  PRO 620           HB2      PRO 620  38.000  44.712  48.518
  539    HB3  PRO 620           HB3      PRO 620  38.928  43.497  47.559
  540    HG2  PRO 620           HG2      PRO 620  36.687  43.034  49.561
  541    HG3  PRO 620           HG3      PRO 620  36.720  42.458  47.869
  542    HD2  PRO 620           HD2      PRO 620  37.533  40.863  49.923
  543    HD3  PRO 620           HD3      PRO 620  38.437  40.852  48.371
  544    H    GLN 621           H        GLN 621  40.251  45.705  50.213
  545    HA   GLN 621           HA       GLN 621  38.196  46.349  52.206
  546    HB2  GLN 621           HB2      GLN 621  39.682  46.863  53.998
  547    HB3  GLN 621           HB3      GLN 621  39.801  45.201  53.476
  548    HG2  GLN 621           HG2      GLN 621  41.982  45.738  53.932
  549    HG3  GLN 621           HG3      GLN 621  41.873  45.738  52.153
  550   HE21  GLN 621          HE22      GLN 621  41.792  47.871  55.028
  551   HE22  GLN 621          HE21      GLN 621  42.476  49.260  54.194
  552    H    SER 622           H        SER 622  39.245  47.261  49.526
  553    HA   SER 622           HA       SER 622  40.192  49.985  49.650
  554    HB2  SER 622           HB2      SER 622  40.045  49.774  47.239
  555    HB3  SER 622           HB3      SER 622  40.627  48.255  47.910
  556    HG   SER 622           HG       SER 622  39.181  47.646  46.627
  557    HA   PRO 623           HA       PRO 623  36.872  52.727  49.936
  558    HB2  PRO 623           HB2      PRO 623  37.203  53.648  47.112
  559    HB3  PRO 623           HB3      PRO 623  37.136  54.585  48.652
  560    HG2  PRO 623           HG2      PRO 623  39.443  54.196  47.490
  561    HG3  PRO 623           HG3      PRO 623  39.325  53.853  49.250
  562    HD2  PRO 623           HD2      PRO 623  39.097  51.776  47.019
  563    HD3  PRO 623           HD3      PRO 623  40.176  51.752  48.433
  Start of MODEL   12
    1    H1   MET 553           H1       MET 553  18.595  38.330  20.819
    2    H2   MET 553           H2       MET 553  18.398  37.411  19.502
    3    H3   MET 553           H3       MET 553  18.195  39.064  19.478
    4    HA   MET 553           HA       MET 553  20.735  38.311  20.482
    5    HB2  MET 553           HB2      MET 553  21.867  37.649  18.498
    6    HB3  MET 553           HB3      MET 553  20.546  36.510  18.765
    7    HG2  MET 553           HG2      MET 553  20.376  38.837  16.836
    8    HG3  MET 553           HG3      MET 553  20.959  37.242  16.363
    9    HE1  MET 553           HE1      MET 553  18.708  39.054  15.170
   10    HE2  MET 553           HE2      MET 553  18.869  37.530  14.297
   11    HE3  MET 553           HE3      MET 553  17.282  37.997  14.905
   12    H    LYS 554           H        LYS 554  22.234  39.784  20.142
   13    HA   LYS 554           HA       LYS 554  21.654  42.273  18.680
   14    HB2  LYS 554           HB2      LYS 554  21.923  43.690  20.758
   15    HB3  LYS 554           HB3      LYS 554  20.463  42.782  20.703
   16    HG2  LYS 554           HG2      LYS 554  21.616  41.070  22.302
   17    HG3  LYS 554           HG3      LYS 554  22.966  42.200  22.317
   18    HD2  LYS 554           HD2      LYS 554  21.562  42.727  24.264
   19    HD3  LYS 554           HD3      LYS 554  21.334  44.011  23.083
   20    HE2  LYS 554           HE2      LYS 554  19.183  42.851  22.388
   21    HE3  LYS 554           HE3      LYS 554  19.459  41.692  23.675
   22    HZ1  LYS 554           HZ1      LYS 554  18.833  44.537  23.955
   23    HZ2  LYS 554           HZ2      LYS 554  18.288  43.296  24.819
   24    HZ3  LYS 554           HZ3      LYS 554  19.807  43.830  25.072
   25    H    MET 555           H        MET 555  23.441  44.038  19.386
   26    HA   MET 555           HA       MET 555  26.104  42.720  19.093
   27    HB2  MET 555           HB2      MET 555  25.624  43.891  16.978
   28    HB3  MET 555           HB3      MET 555  25.171  45.366  17.799
   29    HG2  MET 555           HG2      MET 555  27.549  45.564  18.623
   30    HG3  MET 555           HG3      MET 555  27.911  44.104  17.658
   31    HE1  MET 555           HE1      MET 555  29.586  46.865  17.262
   32    HE2  MET 555           HE2      MET 555  29.866  45.322  16.408
   33    HE3  MET 555           HE3      MET 555  29.675  46.828  15.495
   34    H    TRP 556           H        TRP 556  27.655  43.057  20.404
   35    HA   TRP 556           HA       TRP 556  27.326  45.003  22.622
   36    HB2  TRP 556           HB2      TRP 556  28.809  42.455  22.109
   37    HB3  TRP 556           HB3      TRP 556  29.583  43.654  23.154
   38    HD1  TRP 556           HD1      TRP 556  27.988  40.594  23.624
   39    HE1  TRP 556           HE1      TRP 556  27.211  40.394  26.032
   40    HE3  TRP 556           HE3      TRP 556  27.315  45.531  24.676
   41    HZ2  TRP 556           HZ2      TRP 556  25.970  42.073  28.013
   42    HZ3  TRP 556           HZ3      TRP 556  26.156  46.185  26.796
   43    HH2  TRP 556           HH2      TRP 556  25.437  44.436  28.425
   44    H    LYS 557           H        LYS 557  28.857  46.595  23.077
   45    HA   LYS 557           HA       LYS 557  30.864  47.352  21.039
   46    HB2  LYS 557           HB2      LYS 557  28.469  49.068  21.889
   47    HB3  LYS 557           HB3      LYS 557  29.765  49.632  20.884
   48    HG2  LYS 557           HG2      LYS 557  29.007  47.645  19.257
   49    HG3  LYS 557           HG3      LYS 557  27.557  47.643  20.202
   50    HD2  LYS 557           HD2      LYS 557  27.022  49.962  19.641
   51    HD3  LYS 557           HD3      LYS 557  28.535  50.150  18.735
   52    HE2  LYS 557           HE2      LYS 557  27.786  48.226  17.300
   53    HE3  LYS 557           HE3      LYS 557  26.183  48.351  18.069
   54    HZ1  LYS 557           HZ1      LYS 557  27.446  50.371  16.371
   55    HZ2  LYS 557           HZ2      LYS 557  25.956  49.671  16.173
   56    HZ3  LYS 557           HZ3      LYS 557  26.247  50.740  17.336
   57    HA   PRO 558           HA       PRO 558  33.133  48.701  24.470
   58    HB2  PRO 558           HB2      PRO 558  34.844  50.551  23.443
   59    HB3  PRO 558           HB3      PRO 558  34.866  48.843  22.969
   60    HG2  PRO 558           HG2      PRO 558  33.517  51.096  21.473
   61    HG3  PRO 558           HG3      PRO 558  34.605  49.771  20.871
   62    HD2  PRO 558           HD2      PRO 558  31.852  49.732  20.770
   63    HD3  PRO 558           HD3      PRO 558  32.893  48.273  20.858
   64    H    GLY 559           H        GLY 559  33.424  50.178  26.062
   65    HA2  GLY 559           HA2      GLY 559  33.082  52.066  27.402
   66    HA3  GLY 559           HA3      GLY 559  32.385  52.903  26.042
   67    H    ASP 560           H        ASP 560  31.541  49.952  28.065
   68    HA   ASP 560           HA       ASP 560  28.914  51.132  28.782
   69    HB2  ASP 560           HB2      ASP 560  29.368  48.822  26.906
   70    HB3  ASP 560           HB3      ASP 560  28.191  48.572  28.175
   71    H    GLU 561           H        GLU 561  29.249  51.107  31.064
   72    HA   GLU 561           HA       GLU 561  30.095  48.783  32.379
   73    HB2  GLU 561           HB2      GLU 561  28.730  49.615  34.367
   74    HB3  GLU 561           HB3      GLU 561  29.786  50.829  33.714
   75    HG2  GLU 561           HG2      GLU 561  26.790  50.539  33.199
   76    HG3  GLU 561           HG3      GLU 561  27.457  51.714  34.287
   77    H    CYS 562           H        CYS 562  29.321  46.781  32.682
   78    HA   CYS 562           HA       CYS 562  26.495  45.992  32.452
   79    HB2  CYS 562           HB2      CYS 562  28.674  44.928  30.598
   80    HB3  CYS 562           HB3      CYS 562  27.064  44.277  30.750
   81    HG   CYS 562           HG       CYS 562  27.969  47.305  29.806
   82    H    PHE 563           H        PHE 563  26.767  43.282  32.381
   83    HA   PHE 563           HA       PHE 563  28.256  42.618  34.885
   84    HB2  PHE 563           HB2      PHE 563  25.444  42.056  33.957
   85    HB3  PHE 563           HB3      PHE 563  26.334  40.882  34.961
   86    HD1  PHE 563           HD1      PHE 563  27.300  41.625  37.175
   87    HD2  PHE 563           HD2      PHE 563  24.159  43.744  35.118
   88    HE1  PHE 563           HE1      PHE 563  26.626  42.701  39.299
   89    HE2  PHE 563           HE2      PHE 563  23.486  44.802  37.268
   90    HZ   PHE 563           HZ       PHE 563  24.807  44.408  39.309
   91    H    ALA 564           H        ALA 564  29.814  41.265  34.416
   92    HA   ALA 564           HA       ALA 564  29.696  39.606  31.930
   93    HB1  ALA 564           HB1      ALA 564  31.946  40.895  33.469
   94    HB2  ALA 564           HB2      ALA 564  32.148  39.692  32.163
   95    HB3  ALA 564           HB3      ALA 564  31.382  41.273  31.820
   96    H    LEU 565           H        LEU 565  29.700  37.477  32.263
   97    HA   LEU 565           HA       LEU 565  29.693  36.238  34.842
   98    HB2  LEU 565           HB2      LEU 565  28.524  35.612  32.697
   99    HB3  LEU 565           HB3      LEU 565  30.072  35.010  32.108
  100    HG   LEU 565           HG       LEU 565  30.181  33.249  33.582
  101   HD11  LEU 565          HD11      LEU 565  27.973  34.383  35.319
  102   HD12  LEU 565          HD12      LEU 565  28.551  32.716  35.309
  103   HD13  LEU 565          HD13      LEU 565  29.705  34.021  35.667
  104   HD21  LEU 565          HD21      LEU 565  28.282  31.904  33.166
  105   HD22  LEU 565          HD22      LEU 565  27.190  33.286  33.014
  106   HD23  LEU 565          HD23      LEU 565  28.417  32.957  31.762
  107    H    TYR 566           H        TYR 566  31.570  35.886  36.114
  108    HA   TYR 566           HA       TYR 566  34.192  35.765  35.002
  109    HB2  TYR 566           HB2      TYR 566  33.284  36.279  37.426
  110    HB3  TYR 566           HB3      TYR 566  33.425  34.543  37.625
  111    HD1  TYR 566           HD1      TYR 566  35.810  37.031  35.878
  112    HD2  TYR 566           HD2      TYR 566  35.137  34.158  39.046
  113    HE1  TYR 566           HE1      TYR 566  38.132  37.280  36.598
  114    HE2  TYR 566           HE2      TYR 566  37.513  34.398  39.727
  115    HH   TYR 566           HH       TYR 566  39.830  36.411  38.115
  116    H    TRP 567           H        TRP 567  35.449  33.730  35.977
  117    HA   TRP 567           HA       TRP 567  34.513  31.260  34.482
  118    HB2  TRP 567           HB2      TRP 567  36.914  30.871  34.113
  119    HB3  TRP 567           HB3      TRP 567  36.282  32.266  33.332
  120    HD1  TRP 567           HD1      TRP 567  36.915  34.754  34.396
  121    HE1  TRP 567           HE1      TRP 567  39.103  35.530  35.319
  122    HE3  TRP 567           HE3      TRP 567  38.703  30.275  35.879
  123    HZ2  TRP 567           HZ2      TRP 567  41.226  34.395  37.095
  124    HZ3  TRP 567           HZ3      TRP 567  40.661  30.134  37.414
  125    HH2  TRP 567           HH2      TRP 567  41.905  32.169  38.044
  126    H    GLU 568           H        GLU 568  36.586  32.119  37.219
  127    HA   GLU 568           HA       GLU 568  37.084  29.654  38.429
  128    HB2  GLU 568           HB2      GLU 568  38.247  31.396  39.142
  129    HB3  GLU 568           HB3      GLU 568  36.829  32.475  39.288
  130    HG2  GLU 568           HG2      GLU 568  36.199  31.560  41.411
  131    HG3  GLU 568           HG3      GLU 568  37.528  30.371  41.366
  132    H    ASP 569           H        ASP 569  34.198  31.622  38.979
  133    HA   ASP 569           HA       ASP 569  32.945  29.297  40.308
  134    HB2  ASP 569           HB2      ASP 569  31.819  31.030  41.824
  135    HB3  ASP 569           HB3      ASP 569  33.564  30.873  42.037
  136    H    ASN 570           H        ASN 570  32.745  31.237  37.676
  137    HA   ASN 570           HA       ASN 570  31.067  31.600  36.108
  138    HB2  ASN 570           HB2      ASN 570  31.024  29.001  36.526
  139    HB3  ASN 570           HB3      ASN 570  29.546  29.349  37.437
  140   HD21  ASN 570          HD22      ASN 570  27.661  29.116  36.160
  141   HD22  ASN 570          HD21      ASN 570  27.635  29.526  34.433
  142    H    LYS 571           H        LYS 571  30.931  33.379  38.270
  143    HA   LYS 571           HA       LYS 571  27.990  33.906  38.370
  144    HB2  LYS 571           HB2      LYS 571  30.067  33.937  40.512
  145    HB3  LYS 571           HB3      LYS 571  29.185  35.428  40.465
  146    HG2  LYS 571           HG2      LYS 571  27.872  32.707  40.703
  147    HG3  LYS 571           HG3      LYS 571  28.253  33.822  42.002
  148    HD2  LYS 571           HD2      LYS 571  26.811  35.555  40.421
  149    HD3  LYS 571           HD3      LYS 571  26.132  34.039  39.823
  150    HE2  LYS 571           HE2      LYS 571  24.748  35.082  41.480
  151    HE3  LYS 571           HE3      LYS 571  25.295  33.506  42.015
  152    HZ1  LYS 571           HZ1      LYS 571  26.407  36.154  42.861
  153    HZ2  LYS 571           HZ2      LYS 571  25.538  35.139  43.772
  154    HZ3  LYS 571           HZ3      LYS 571  27.017  34.691  43.328
  155    H    PHE 572           H        PHE 572  27.215  35.974  37.851
  156    HA   PHE 572           HA       PHE 572  29.020  37.539  36.248
  157    HB2  PHE 572           HB2      PHE 572  26.222  38.138  37.261
  158    HB3  PHE 572           HB3      PHE 572  27.090  39.057  36.062
  159    HD1  PHE 572           HD1      PHE 572  25.345  35.791  36.736
  160    HD2  PHE 572           HD2      PHE 572  27.154  38.305  33.720
  161    HE1  PHE 572           HE1      PHE 572  24.375  34.403  35.014
  162    HE2  PHE 572           HE2      PHE 572  25.901  36.999  31.958
  163    HZ   PHE 572           HZ       PHE 572  24.587  35.003  32.620
  164    H    TYR 573           H        TYR 573  30.004  39.366  36.646
  165    HA   TYR 573           HA       TYR 573  29.573  40.904  39.147
  166    HB2  TYR 573           HB2      TYR 573  32.273  40.216  37.947
  167    HB3  TYR 573           HB3      TYR 573  32.001  41.208  39.360
  168    HD1  TYR 573           HD2      TYR 573  31.988  37.788  38.064
  169    HD2  TYR 573           HD1      TYR 573  31.279  40.216  41.517
  170    HE1  TYR 573           HE2      TYR 573  32.267  35.754  39.528
  171    HE2  TYR 573           HE1      TYR 573  31.730  38.237  42.996
  172    HH   TYR 573           HH       TYR 573  32.123  34.981  41.822
  173    H    ARG 574           H        ARG 574  30.049  43.073  38.971
  174    HA   ARG 574           HA       ARG 574  29.179  44.358  36.540
  175    HB2  ARG 574           HB2      ARG 574  30.449  45.482  39.092
  176    HB3  ARG 574           HB3      ARG 574  29.919  46.494  37.763
  177    HG2  ARG 574           HG2      ARG 574  27.571  45.721  38.128
  178    HG3  ARG 574           HG3      ARG 574  28.152  44.858  39.583
  179    HD2  ARG 574           HD2      ARG 574  28.756  47.787  39.200
  180    HD3  ARG 574           HD3      ARG 574  27.199  47.298  39.832
  181    HE   ARG 574           HE       ARG 574  28.429  45.984  41.627
  182   HH11  ARG 574          HH11      ARG 574  29.973  48.897  40.280
  183   HH12  ARG 574          HH12      ARG 574  31.011  48.970  41.694
  184   HH21  ARG 574          HH21      ARG 574  29.968  46.259  43.251
  185   HH22  ARG 574          HH22      ARG 574  31.123  47.586  43.088
  186    H    ALA 575           H        ALA 575  30.482  44.738  34.740
  187    HA   ALA 575           HA       ALA 575  33.248  45.663  35.189
  188    HB1  ALA 575           HB1      ALA 575  32.431  43.413  33.294
  189    HB2  ALA 575           HB2      ALA 575  34.054  44.177  33.385
  190    HB3  ALA 575           HB3      ALA 575  33.428  43.230  34.727
  191    H    GLU 576           H        GLU 576  33.750  47.317  34.042
  192    HA   GLU 576           HA       GLU 576  32.070  48.599  32.055
  193    HB2  GLU 576           HB2      GLU 576  34.757  49.145  33.397
  194    HB3  GLU 576           HB3      GLU 576  34.347  49.993  31.903
  195    HG2  GLU 576           HG2      GLU 576  32.168  50.646  33.028
  196    HG3  GLU 576           HG3      GLU 576  32.818  49.910  34.510
  197    H    VAL 577           H        VAL 577  31.823  47.608  30.224
  198    HA   VAL 577           HA       VAL 577  33.499  45.995  28.652
  199    HB   VAL 577           HB       VAL 577  31.234  47.877  28.037
  200   HG11  VAL 577          HG11      VAL 577  32.948  46.430  26.046
  201   HG12  VAL 577          HG12      VAL 577  31.205  46.732  25.761
  202   HG13  VAL 577          HG13      VAL 577  32.284  48.089  26.105
  203   HG21  VAL 577          HG21      VAL 577  30.429  45.918  29.082
  204   HG22  VAL 577          HG22      VAL 577  30.086  45.803  27.341
  205   HG23  VAL 577          HG23      VAL 577  31.375  44.819  28.039
  206    H    GLU 578           H        GLU 578  35.248  46.283  27.619
  207    HA   GLU 578           HA       GLU 578  36.332  49.015  27.244
  208    HB2  GLU 578           HB2      GLU 578  37.416  47.281  28.801
  209    HB3  GLU 578           HB3      GLU 578  37.628  46.268  27.393
  210    HG2  GLU 578           HG2      GLU 578  39.737  47.291  27.804
  211    HG3  GLU 578           HG3      GLU 578  39.043  47.958  26.317
  212    H    ALA 579           H        ALA 579  36.025  45.802  25.732
  213    HA   ALA 579           HA       ALA 579  35.875  46.982  23.098
  214    HB1  ALA 579           HB1      ALA 579  37.999  45.750  22.259
  215    HB2  ALA 579           HB2      ALA 579  38.266  47.181  23.271
  216    HB3  ALA 579           HB3      ALA 579  38.437  45.578  23.977
  217    H    LEU 580           H        LEU 580  34.272  45.791  22.139
  218    HA   LEU 580           HA       LEU 580  34.176  42.828  22.567
  219    HB2  LEU 580           HB2      LEU 580  31.681  44.507  22.403
  220    HB3  LEU 580           HB3      LEU 580  31.839  42.823  22.806
  221    HG   LEU 580           HG       LEU 580  32.263  45.288  24.402
  222   HD11  LEU 580          HD11      LEU 580  30.899  42.608  24.871
  223   HD12  LEU 580          HD12      LEU 580  31.286  43.602  26.261
  224   HD13  LEU 580          HD13      LEU 580  30.241  44.260  25.039
  225   HD21  LEU 580          HD21      LEU 580  33.375  43.643  26.233
  226   HD22  LEU 580          HD22      LEU 580  34.066  42.970  24.713
  227   HD23  LEU 580          HD23      LEU 580  34.294  44.666  25.177
  228    H    HIS 581           H        HIS 581  35.231  42.441  20.606
  229    HA   HIS 581           HA       HIS 581  33.173  41.099  19.051
  230    HB2  HIS 581           HB2      HIS 581  33.413  43.100  17.604
  231    HB3  HIS 581           HB3      HIS 581  35.184  42.852  17.579
  232    HD2  HIS 581           HD2      HIS 581  32.826  39.856  17.155
  233    HE1  HIS 581           HE1      HIS 581  34.373  40.734  13.299
  234    HE2  HIS 581           HE2      HIS 581  33.081  39.078  14.657
  235    H    SER 582           H        SER 582  36.564  41.952  19.553
  236    HA   SER 582           HA       SER 582  38.553  40.821  19.479
  237    HB2  SER 582           HB2      SER 582  36.792  38.527  20.350
  238    HB3  SER 582           HB3      SER 582  38.558  38.575  20.534
  239    HG   SER 582           HG       SER 582  36.635  39.635  22.010
  240    H    SER 583           H        SER 583  37.334  41.006  17.027
  241    HA   SER 583           HA       SER 583  37.057  40.180  15.000
  242    HB2  SER 583           HB2      SER 583  38.854  39.044  13.979
  243    HB3  SER 583           HB3      SER 583  39.460  40.260  15.131
  244    HG   SER 583           HG       SER 583  39.632  37.549  15.158
  245    H    GLY 584           H        GLY 584  35.734  38.284  17.328
  246    HA2  GLY 584           HA2      GLY 584  34.315  36.753  15.445
  247    HA3  GLY 584           HA3      GLY 584  35.527  35.701  16.169
  248    H    MET 585           H        MET 585  35.390  35.929  18.858
  249    HA   MET 585           HA       MET 585  32.471  35.611  19.489
  250    HB2  MET 585           HB2      MET 585  32.752  33.450  20.373
  251    HB3  MET 585           HB3      MET 585  33.536  33.416  18.801
  252    HG2  MET 585           HG2      MET 585  35.737  33.547  19.872
  253    HG3  MET 585           HG3      MET 585  34.962  33.954  21.421
  254    HE1  MET 585           HE1      MET 585  36.905  32.228  22.113
  255    HE2  MET 585           HE2      MET 585  35.695  31.518  23.201
  256    HE3  MET 585           HE3      MET 585  36.615  30.479  22.105
  257    H    THR 586           H        THR 586  35.633  36.326  21.025
  258    HA   THR 586           HA       THR 586  34.243  36.530  23.649
  259    HB   THR 586           HB       THR 586  36.388  36.739  24.733
  260    HG1  THR 586           HG1      THR 586  38.094  36.110  22.965
  261   HG21  THR 586          HG21      THR 586  37.404  34.670  24.413
  262   HG22  THR 586          HG22      THR 586  35.660  34.457  24.309
  263   HG23  THR 586          HG23      THR 586  36.662  34.459  22.810
  264    H    ALA 587           H        ALA 587  35.143  38.295  25.071
  265    HA   ALA 587           HA       ALA 587  35.032  40.974  23.795
  266    HB1  ALA 587           HB1      ALA 587  33.084  41.371  25.527
  267    HB2  ALA 587           HB2      ALA 587  32.713  40.470  24.041
  268    HB3  ALA 587           HB3      ALA 587  33.000  39.611  25.582
  269    H    VAL 588           H        VAL 588  36.077  42.522  24.920
  270    HA   VAL 588           HA       VAL 588  37.486  41.680  27.378
  271    HB   VAL 588           HB       VAL 588  37.925  44.282  25.915
  272   HG11  VAL 588          HG11      VAL 588  39.183  42.762  28.110
  273   HG12  VAL 588          HG12      VAL 588  40.302  43.500  26.958
  274   HG13  VAL 588          HG13      VAL 588  39.105  44.518  27.774
  275   HG21  VAL 588          HG21      VAL 588  38.351  42.544  24.198
  276   HG22  VAL 588          HG22      VAL 588  39.929  43.005  24.845
  277   HG23  VAL 588          HG23      VAL 588  39.155  41.515  25.409
  278    H    VAL 589           H        VAL 589  36.872  42.396  29.364
  279    HA   VAL 589           HA       VAL 589  35.221  44.828  29.696
  280    HB   VAL 589           HB       VAL 589  33.621  43.692  31.051
  281   HG11  VAL 589          HG11      VAL 589  33.886  42.177  28.459
  282   HG12  VAL 589          HG12      VAL 589  32.412  42.551  29.383
  283   HG13  VAL 589          HG13      VAL 589  33.329  43.871  28.602
  284   HG21  VAL 589          HG21      VAL 589  35.241  41.159  30.512
  285   HG22  VAL 589          HG22      VAL 589  34.512  41.706  32.045
  286   HG23  VAL 589          HG23      VAL 589  33.504  41.054  30.758
  287    H    LYS 590           H        LYS 590  35.954  46.016  31.437
  288    HA   LYS 590           HA       LYS 590  37.935  45.003  33.357
  289    HB2  LYS 590           HB2      LYS 590  38.446  47.077  32.245
  290    HB3  LYS 590           HB3      LYS 590  36.918  47.794  32.741
  291    HG2  LYS 590           HG2      LYS 590  37.605  48.101  34.946
  292    HG3  LYS 590           HG3      LYS 590  38.835  46.831  34.867
  293    HD2  LYS 590           HD2      LYS 590  40.283  48.264  33.479
  294    HD3  LYS 590           HD3      LYS 590  38.981  49.438  33.272
  295    HE2  LYS 590           HE2      LYS 590  39.095  49.758  35.811
  296    HE3  LYS 590           HE3      LYS 590  40.556  48.765  35.773
  297    HZ1  LYS 590           HZ1      LYS 590  40.242  51.427  34.502
  298    HZ2  LYS 590           HZ2      LYS 590  41.335  50.978  35.575
  299    HZ3  LYS 590           HZ3      LYS 590  41.438  50.382  34.093
  300    H    PHE 591           H        PHE 591  36.964  43.896  35.006
  301    HA   PHE 591           HA       PHE 591  34.516  44.265  36.368
  302    HB2  PHE 591           HB2      PHE 591  37.128  43.295  37.468
  303    HB3  PHE 591           HB3      PHE 591  35.532  43.129  38.245
  304    HD1  PHE 591           HD2      PHE 591  33.619  42.033  36.776
  305    HD2  PHE 591           HD1      PHE 591  37.849  41.416  36.297
  306    HE1  PHE 591           HE2      PHE 591  33.165  40.001  35.407
  307    HE2  PHE 591           HE1      PHE 591  37.409  39.321  35.070
  308    HZ   PHE 591           HZ       PHE 591  35.043  38.680  34.499
  309    H    ILE 592           H        ILE 592  33.693  46.025  37.180
  310    HA   ILE 592           HA       ILE 592  35.148  48.383  37.734
  311    HB   ILE 592           HB       ILE 592  32.357  48.024  38.799
  312   HG12  ILE 592          HG12      ILE 592  33.208  48.173  35.920
  313   HG13  ILE 592          HG13      ILE 592  32.116  47.006  36.721
  314   HG21  ILE 592          HG21      ILE 592  33.728  50.298  37.287
  315   HG22  ILE 592          HG22      ILE 592  32.205  50.405  38.206
  316   HG23  ILE 592          HG23      ILE 592  33.742  50.197  39.051
  317   HD11  ILE 592          HD11      ILE 592  31.409  49.895  36.101
  318   HD12  ILE 592          HD12      ILE 592  30.857  48.483  35.223
  319   HD13  ILE 592          HD13      ILE 592  30.366  48.693  36.919
  320    H    ASP 593           H        ASP 593  34.447  45.682  39.813
  321    HA   ASP 593           HA       ASP 593  35.627  47.270  42.064
  322    HB2  ASP 593           HB2      ASP 593  33.339  46.263  42.485
  323    HB3  ASP 593           HB3      ASP 593  34.129  44.677  42.485
  324    H    TYR 594           H        TYR 594  37.017  45.693  39.809
  325    HA   TYR 594           HA       TYR 594  39.086  44.528  41.559
  326    HB2  TYR 594           HB2      TYR 594  38.114  42.815  39.278
  327    HB3  TYR 594           HB3      TYR 594  39.205  42.442  40.550
  328    HD1  TYR 594           HD1      TYR 594  35.504  43.443  40.242
  329    HD2  TYR 594           HD2      TYR 594  38.394  40.963  42.286
  330    HE1  TYR 594           HE1      TYR 594  33.674  42.214  41.344
  331    HE2  TYR 594           HE2      TYR 594  36.481  39.781  43.437
  332    HH   TYR 594           HH       TYR 594  33.167  40.750  43.057
  333    H    GLY 595           H        GLY 595  38.467  46.698  39.375
  334    HA2  GLY 595           HA2      GLY 595  39.598  47.875  37.819
  335    HA3  GLY 595           HA3      GLY 595  40.867  47.747  39.050
  336    H    ASN 596           H        ASN 596  40.071  44.953  36.980
  337    HA   ASN 596           HA       ASN 596  41.761  46.066  34.836
  338    HB2  ASN 596           HB2      ASN 596  43.355  44.344  34.853
  339    HB3  ASN 596           HB3      ASN 596  43.149  44.677  36.566
  340   HD21  ASN 596          HD22      ASN 596  41.402  43.294  37.746
  341   HD22  ASN 596          HD21      ASN 596  41.226  41.640  37.212
  342    H    TYR 597           H        TYR 597  41.867  44.388  32.818
  343    HA   TYR 597           HA       TYR 597  39.139  43.283  32.580
  344    HB2  TYR 597           HB2      TYR 597  39.297  44.011  30.115
  345    HB3  TYR 597           HB3      TYR 597  38.874  45.179  31.326
  346    HD1  TYR 597           HD2      TYR 597  40.668  46.786  32.204
  347    HD2  TYR 597           HD1      TYR 597  41.210  44.410  28.630
  348    HE1  TYR 597           HE2      TYR 597  42.579  48.147  31.595
  349    HE2  TYR 597           HE1      TYR 597  42.919  45.972  27.852
  350    HH   TYR 597           HH       TYR 597  44.108  47.869  28.378
  351    H    GLU 598           H        GLU 598  38.789  41.622  31.430
  352    HA   GLU 598           HA       GLU 598  40.924  40.083  30.104
  353    HB2  GLU 598           HB2      GLU 598  40.378  38.040  31.282
  354    HB3  GLU 598           HB3      GLU 598  40.807  39.229  32.500
  355    HG2  GLU 598           HG2      GLU 598  38.485  39.642  33.036
  356    HG3  GLU 598           HG3      GLU 598  37.954  38.475  31.820
  357    H    GLU 599           H        GLU 599  40.193  38.293  28.852
  358    HA   GLU 599           HA       GLU 599  37.859  38.894  27.308
  359    HB2  GLU 599           HB2      GLU 599  38.390  36.955  26.046
  360    HB3  GLU 599           HB3      GLU 599  39.929  37.724  26.453
  361    HG2  GLU 599           HG2      GLU 599  38.626  35.207  27.483
  362    HG3  GLU 599           HG3      GLU 599  40.051  35.332  26.488
  363    H    VAL 600           H        VAL 600  35.908  38.043  27.356
  364    HA   VAL 600           HA       VAL 600  34.980  35.709  28.897
  365    HB   VAL 600           HB       VAL 600  33.862  38.554  29.277
  366   HG11  VAL 600          HG11      VAL 600  31.943  36.994  29.217
  367   HG12  VAL 600          HG12      VAL 600  32.788  35.904  30.360
  368   HG13  VAL 600          HG13      VAL 600  32.261  37.489  30.887
  369   HG21  VAL 600          HG21      VAL 600  35.744  38.180  30.738
  370   HG22  VAL 600          HG22      VAL 600  34.311  37.903  31.736
  371   HG23  VAL 600          HG23      VAL 600  35.207  36.518  31.058
  372    H    LEU 601           H        LEU 601  32.990  34.864  27.801
  373    HA   LEU 601           HA       LEU 601  33.002  35.378  24.997
  374    HB2  LEU 601           HB2      LEU 601  32.025  33.322  26.638
  375    HB3  LEU 601           HB3      LEU 601  30.548  34.146  26.206
  376    HG   LEU 601           HG       LEU 601  30.984  32.248  24.805
  377   HD11  LEU 601          HD11      LEU 601  29.722  33.991  23.933
  378   HD12  LEU 601          HD12      LEU 601  31.176  34.810  23.204
  379   HD13  LEU 601          HD13      LEU 601  30.668  33.235  22.621
  380   HD21  LEU 601          HD21      LEU 601  32.727  32.149  23.192
  381   HD22  LEU 601          HD22      LEU 601  33.411  33.726  23.702
  382   HD23  LEU 601          HD23      LEU 601  33.481  32.309  24.787
  383    H    LEU 602           H        LEU 602  31.487  36.536  23.633
  384    HA   LEU 602           HA       LEU 602  30.152  38.801  24.731
  385    HB2  LEU 602           HB2      LEU 602  29.562  37.216  22.149
  386    HB3  LEU 602           HB3      LEU 602  28.943  38.820  22.470
  387    HG   LEU 602           HG       LEU 602  31.920  38.452  22.176
  388   HD11  LEU 602          HD11      LEU 602  30.119  38.969  19.775
  389   HD12  LEU 602          HD12      LEU 602  31.893  38.782  19.866
  390   HD13  LEU 602          HD13      LEU 602  30.856  37.392  20.140
  391   HD21  LEU 602          HD21      LEU 602  30.768  40.560  22.954
  392   HD22  LEU 602          HD22      LEU 602  31.763  40.803  21.472
  393   HD23  LEU 602          HD23      LEU 602  30.032  40.713  21.328
  394    H    SER 603           H        SER 603  29.158  35.522  24.404
  395    HA   SER 603           HA       SER 603  26.335  36.085  24.948
  396    HB2  SER 603           HB2      SER 603  27.710  33.403  25.177
  397    HB3  SER 603           HB3      SER 603  25.988  33.771  25.051
  398    HG   SER 603           HG       SER 603  27.037  33.212  23.099
  399    H    ASN 604           H        ASN 604  28.997  36.231  26.923
  400    HA   ASN 604           HA       ASN 604  27.634  35.038  29.312
  401    HB2  ASN 604           HB2      ASN 604  30.560  35.064  28.473
  402    HB3  ASN 604           HB3      ASN 604  30.027  34.781  30.117
  403   HD21  ASN 604          HD22      ASN 604  31.286  32.661  29.632
  404   HD22  ASN 604          HD21      ASN 604  30.354  31.384  28.884
  405    H    ILE 605           H        ILE 605  28.200  37.868  27.874
  406    HA   ILE 605           HA       ILE 605  28.254  39.296  30.521
  407    HB   ILE 605           HB       ILE 605  28.550  40.524  27.766
  408   HG12  ILE 605          HG12      ILE 605  30.967  40.153  29.608
  409   HG13  ILE 605          HG13      ILE 605  30.572  38.865  28.498
  410   HG21  ILE 605          HG21      ILE 605  29.340  41.652  30.436
  411   HG22  ILE 605          HG22      ILE 605  29.343  42.433  28.827
  412   HG23  ILE 605          HG23      ILE 605  27.803  41.939  29.562
  413   HD11  ILE 605          HD11      ILE 605  31.048  41.707  27.493
  414   HD12  ILE 605          HD12      ILE 605  32.261  40.446  27.651
  415   HD13  ILE 605          HD13      ILE 605  30.836  40.196  26.586
  416    H    LYS 606           H        LYS 606  26.399  40.193  31.143
  417    HA   LYS 606           HA       LYS 606  24.008  40.517  29.351
  418    HB2  LYS 606           HB2      LYS 606  22.622  39.934  31.244
  419    HB3  LYS 606           HB3      LYS 606  23.777  38.636  30.965
  420    HG2  LYS 606           HG2      LYS 606  25.167  39.352  32.828
  421    HG3  LYS 606           HG3      LYS 606  24.116  40.770  33.106
  422    HD2  LYS 606           HD2      LYS 606  22.209  39.394  33.506
  423    HD3  LYS 606           HD3      LYS 606  23.131  37.898  33.187
  424    HE2  LYS 606           HE2      LYS 606  24.641  38.593  35.126
  425    HE3  LYS 606           HE3      LYS 606  23.496  39.884  35.454
  426    HZ1  LYS 606           HZ1      LYS 606  22.978  38.011  36.822
  427    HZ2  LYS 606           HZ2      LYS 606  21.779  38.064  35.741
  428    HZ3  LYS 606           HZ3      LYS 606  22.927  36.957  35.585
  429    HA   PRO 607           HA       PRO 607  24.262  44.804  30.287
  430    HB2  PRO 607           HB2      PRO 607  21.719  45.737  30.580
  431    HB3  PRO 607           HB3      PRO 607  22.409  45.230  29.019
  432    HG2  PRO 607           HG2      PRO 607  20.658  43.541  30.854
  433    HG3  PRO 607           HG3      PRO 607  20.518  43.773  29.077
  434    HD2  PRO 607           HD2      PRO 607  21.778  41.592  29.906
  435    HD3  PRO 607           HD3      PRO 607  22.431  42.635  28.598
  436    H    ILE 608           H        ILE 608  24.067  46.549  31.878
  437    HA   ILE 608           HA       ILE 608  23.584  45.659  34.632
  438    HB   ILE 608           HB       ILE 608  25.293  47.570  33.303
  439   HG12  ILE 608          HG12      ILE 608  24.998  46.779  36.226
  440   HG13  ILE 608          HG13      ILE 608  25.777  45.756  35.058
  441   HG21  ILE 608          HG21      ILE 608  23.797  48.939  35.548
  442   HG22  ILE 608          HG22      ILE 608  25.154  49.539  34.565
  443   HG23  ILE 608          HG23      ILE 608  23.583  49.264  33.816
  444   HD11  ILE 608          HD11      ILE 608  26.712  48.481  36.017
  445   HD12  ILE 608          HD12      ILE 608  27.547  46.922  36.204
  446   HD13  ILE 608          HD13      ILE 608  27.458  47.681  34.617
  447    H    LEU 609           H        LEU 609  22.126  47.770  32.228
  448    HA   LEU 609           HA       LEU 609  19.515  47.569  33.467
  449    HB2  LEU 609           HB2      LEU 609  19.060  49.852  33.751
  450    HB3  LEU 609           HB3      LEU 609  20.339  49.258  34.776
  451    HG   LEU 609           HG       LEU 609  21.993  50.398  33.085
  452   HD11  LEU 609          HD11      LEU 609  21.172  52.466  32.116
  453   HD12  LEU 609          HD12      LEU 609  20.276  51.120  31.427
  454   HD13  LEU 609          HD13      LEU 609  19.535  52.138  32.706
  455   HD21  LEU 609          HD21      LEU 609  21.732  50.930  35.452
  456   HD22  LEU 609          HD22      LEU 609  21.834  52.453  34.536
  457   HD23  LEU 609          HD23      LEU 609  20.288  51.893  35.162
  458    H    GLU 610           H        GLU 610  17.985  47.570  31.914
  459    HA   GLU 610           HA       GLU 610  18.589  48.338  29.145
  460    HB2  GLU 610           HB2      GLU 610  19.656  46.136  29.335
  461    HB3  GLU 610           HB3      GLU 610  18.198  45.404  29.960
  462    HG2  GLU 610           HG2      GLU 610  18.452  44.802  27.717
  463    HG3  GLU 610           HG3      GLU 610  17.015  45.781  27.844
  464    H1   TYR 611           H1       TYR 611  54.584  49.548  53.086
  465    H2   TYR 611           H2       TYR 611  55.606  48.758  52.037
  466    H3   TYR 611           H3       TYR 611  55.089  47.984  53.365
  467    HA   TYR 611           HA       TYR 611  52.888  47.965  52.657
  468    HB2  TYR 611           HB2      TYR 611  53.901  49.448  50.168
  469    HB3  TYR 611           HB3      TYR 611  52.296  48.805  50.417
  470    HD1  TYR 611           HD2      TYR 611  50.949  49.650  52.429
  471    HD2  TYR 611           HD1      TYR 611  54.375  51.721  50.808
  472    HE1  TYR 611           HE2      TYR 611  50.296  51.760  53.661
  473    HE2  TYR 611           HE1      TYR 611  53.613  53.804  51.864
  474    HH   TYR 611           HH       TYR 611  52.052  54.709  53.286
  475    H    SER 612           H        SER 612  52.816  45.754  52.296
  476    HA   SER 612           HA       SER 612  54.373  44.229  50.527
  477    HB2  SER 612           HB2      SER 612  52.504  42.578  50.526
  478    HB3  SER 612           HB3      SER 612  53.022  43.076  52.117
  479    HG   SER 612           HG       SER 612  51.220  44.422  52.212
  480    HA   PRO 613           HA       PRO 613  52.458  45.299  46.405
  481    HB2  PRO 613           HB2      PRO 613  53.069  43.223  44.915
  482    HB3  PRO 613           HB3      PRO 613  54.317  44.292  45.659
  483    HG2  PRO 613           HG2      PRO 613  53.407  41.562  46.530
  484    HG3  PRO 613           HG3      PRO 613  55.081  42.180  46.409
  485    HD2  PRO 613           HD2      PRO 613  53.502  42.128  48.708
  486    HD3  PRO 613           HD3      PRO 613  54.925  43.190  48.503
  487    H    SER 614           H        SER 614  50.514  45.133  47.988
  488    HA   SER 614           HA       SER 614  48.545  43.111  47.249
  489    HB2  SER 614           HB2      SER 614  48.531  44.345  49.452
  490    HB3  SER 614           HB3      SER 614  47.863  45.736  48.570
  491    HG   SER 614           HG       SER 614  46.527  43.589  49.363
  492    H    SER 615           H        SER 615  46.636  43.384  46.089
  493    HA   SER 615           HA       SER 615  46.332  45.627  44.198
  494    HB2  SER 615           HB2      SER 615  46.618  44.205  42.214
  495    HB3  SER 615           HB3      SER 615  48.010  43.878  43.264
  496    HG   SER 615           HG       SER 615  47.315  42.057  43.677
  497    HA   PRO 616           HA       PRO 616  42.005  45.211  44.194
  498    HB2  PRO 616           HB2      PRO 616  42.219  44.450  41.271
  499    HB3  PRO 616           HB3      PRO 616  41.047  45.600  42.001
  500    HG2  PRO 616           HG2      PRO 616  43.166  46.497  40.726
  501    HG3  PRO 616           HG3      PRO 616  42.867  47.181  42.372
  502    HD2  PRO 616           HD2      PRO 616  44.707  44.925  41.556
  503    HD3  PRO 616           HD3      PRO 616  45.072  46.343  42.602
  504   HC11  DA2 617          HC11      DA2 617  35.351  39.966  39.210
  505   HC12  DA2 617          HC12      DA2 617  37.061  40.315  39.510
  506   HC13  DA2 617          HC13      DA2 617  36.624  39.096  38.329
  507   HC21  DA2 617          HC21      DA2 617  34.242  38.667  40.514
  508   HC22  DA2 617          HC22      DA2 617  34.946  37.463  41.579
  509   HC23  DA2 617          HC23      DA2 617  34.871  37.148  39.812
  510    H2   DA2 617           H        DA2 617  43.410  42.347  42.620
  511    HA   DA2 617           HA       DA2 617  41.557  40.585  44.024
  512   HCB1  DA2 617          HCB1      DA2 617  41.992  39.864  41.121
  513   HCB2  DA2 617          HCB2      DA2 617  40.690  40.953  41.511
  514   HCG1  DA2 617          HCG1      DA2 617  40.830  38.363  43.099
  515   HCG2  DA2 617          HCG2      DA2 617  39.467  39.361  42.783
  516   HCD1  DA2 617          HCD1      DA2 617  40.655  38.017  40.376
  517   HCD2  DA2 617          HCD2      DA2 617  39.768  37.081  41.587
  518    HNE  DA2 617           HNE      DA2 617  38.642  39.316  39.962
  519   HNH2  DA2 617          HNH2      DA2 617  38.194  36.649  42.331
  520   HNH1  DA2 617          HNH1      DA2 617  36.499  36.594  42.068
  521    H    TYR 618           H        TYR 618  44.063  41.240  44.732
  522    HA   TYR 618           HA       TYR 618  45.982  40.278  45.554
  523    HB2  TYR 618           HB2      TYR 618  45.615  38.343  46.781
  524    HB3  TYR 618           HB3      TYR 618  44.249  39.416  46.867
  525    HD1  TYR 618           HD1      TYR 618  42.078  38.707  45.468
  526    HD2  TYR 618           HD2      TYR 618  45.466  36.157  46.159
  527    HE1  TYR 618           HE1      TYR 618  40.672  36.719  45.006
  528    HE2  TYR 618           HE2      TYR 618  44.051  34.153  45.807
  529    HH   TYR 618           HH       TYR 618  40.647  34.525  44.706
  530    H    THR 619           H        THR 619  46.137  40.351  42.766
  531    HA   THR 619           HA       THR 619  48.466  38.581  42.680
  532    HB   THR 619           HB       THR 619  46.647  37.310  41.574
  533    HG1  THR 619           HG1      THR 619  47.911  37.037  39.703
  534   HG21  THR 619          HG21      THR 619  46.700  39.256  39.271
  535   HG22  THR 619          HG22      THR 619  45.744  37.778  39.493
  536   HG23  THR 619          HG23      THR 619  45.408  39.187  40.512
  537    HA   PRO 620           HA       PRO 620  49.712  42.672  41.001
  538    HB2  PRO 620           HB2      PRO 620  52.266  42.765  41.766
  539    HB3  PRO 620           HB3      PRO 620  51.055  42.487  43.032
  540    HG2  PRO 620           HG2      PRO 620  52.658  40.318  41.581
  541    HG3  PRO 620           HG3      PRO 620  52.564  40.644  43.312
  542    HD2  PRO 620           HD2      PRO 620  50.817  38.898  41.912
  543    HD3  PRO 620           HD3      PRO 620  50.342  39.773  43.418
  544    H    GLN 621           H        GLN 621  49.999  39.836  39.521
  545    HA   GLN 621           HA       GLN 621  52.351  39.715  38.013
  546    HB2  GLN 621           HB2      GLN 621  50.210  38.145  38.094
  547    HB3  GLN 621           HB3      GLN 621  49.674  39.131  36.740
  548    HG2  GLN 621           HG2      GLN 621  51.645  38.468  35.391
  549    HG3  GLN 621           HG3      GLN 621  52.451  37.825  36.809
  550   HE21  GLN 621          HE22      GLN 621  52.011  36.414  34.417
  551   HE22  GLN 621          HE21      GLN 621  50.805  35.146  34.699
  552    H    SER 622           H        SER 622  49.607  41.718  37.480
  553    HA   SER 622           HA       SER 622  48.932  43.151  35.907
  554    HB2  SER 622           HB2      SER 622  50.480  45.124  35.815
  555    HB3  SER 622           HB3      SER 622  50.116  44.478  37.422
  556    HG   SER 622           HG       SER 622  52.033  43.233  37.194
  557    HA   PRO 623           HA       PRO 623  50.948  41.183  32.162
  558    HB2  PRO 623           HB2      PRO 623  48.601  40.437  30.938
  559    HB3  PRO 623           HB3      PRO 623  49.405  39.432  32.181
  560    HG2  PRO 623           HG2      PRO 623  47.147  41.408  32.623
  561    HG3  PRO 623           HG3      PRO 623  47.253  39.704  33.180
  562    HD2  PRO 623           HD2      PRO 623  47.899  41.762  34.798
  563    HD3  PRO 623           HD3      PRO 623  48.944  40.307  34.806
  Start of MODEL   13
    1    H1   MET 553           H1       MET 553  17.875  44.792  21.875
    2    H2   MET 553           H2       MET 553  17.636  43.201  21.963
    3    H3   MET 553           H3       MET 553  18.059  43.910  20.548
    4    HA   MET 553           HA       MET 553  20.182  44.620  21.656
    5    HB2  MET 553           HB2      MET 553  19.004  43.981  24.021
    6    HB3  MET 553           HB3      MET 553  19.675  42.398  23.649
    7    HG2  MET 553           HG2      MET 553  21.293  43.596  24.907
    8    HG3  MET 553           HG3      MET 553  21.862  43.324  23.256
    9    HE1  MET 553           HE1      MET 553  23.222  44.723  25.146
   10    HE2  MET 553           HE2      MET 553  23.753  44.589  23.477
   11    HE3  MET 553           HE3      MET 553  23.879  46.164  24.282
   12    H    LYS 554           H        LYS 554  21.870  43.566  20.458
   13    HA   LYS 554           HA       LYS 554  21.962  40.627  20.265
   14    HB2  LYS 554           HB2      LYS 554  21.877  40.522  17.907
   15    HB3  LYS 554           HB3      LYS 554  20.412  41.319  18.473
   16    HG2  LYS 554           HG2      LYS 554  21.529  43.550  17.791
   17    HG3  LYS 554           HG3      LYS 554  22.858  42.594  17.180
   18    HD2  LYS 554           HD2      LYS 554  21.268  43.374  15.421
   19    HD3  LYS 554           HD3      LYS 554  21.453  41.621  15.426
   20    HE2  LYS 554           HE2      LYS 554  19.251  41.373  16.477
   21    HE3  LYS 554           HE3      LYS 554  19.212  43.101  16.841
   22    HZ1  LYS 554           HZ1      LYS 554  17.834  42.731  14.952
   23    HZ2  LYS 554           HZ2      LYS 554  19.097  43.587  14.522
   24    HZ3  LYS 554           HZ3      LYS 554  19.012  42.000  14.095
   25    H    MET 555           H        MET 555  23.737  43.503  20.537
   26    HA   MET 555           HA       MET 555  26.222  42.039  20.098
   27    HB2  MET 555           HB2      MET 555  27.084  43.814  18.491
   28    HB3  MET 555           HB3      MET 555  25.721  42.901  17.868
   29    HG2  MET 555           HG2      MET 555  25.219  45.079  17.278
   30    HG3  MET 555           HG3      MET 555  24.249  44.862  18.721
   31    HE1  MET 555           HE1      MET 555  28.281  46.036  18.527
   32    HE2  MET 555           HE2      MET 555  27.348  46.403  17.059
   33    HE3  MET 555           HE3      MET 555  27.844  47.709  18.135
   34    H    TRP 556           H        TRP 556  28.142  43.867  20.374
   35    HA   TRP 556           HA       TRP 556  27.472  45.585  22.682
   36    HB2  TRP 556           HB2      TRP 556  29.439  43.278  22.406
   37    HB3  TRP 556           HB3      TRP 556  29.855  44.624  23.415
   38    HD1  TRP 556           HD1      TRP 556  28.845  41.348  23.842
   39    HE1  TRP 556           HE1      TRP 556  27.856  40.962  26.137
   40    HE3  TRP 556           HE3      TRP 556  27.163  46.086  24.714
   41    HZ2  TRP 556           HZ2      TRP 556  26.514  42.636  28.245
   42    HZ3  TRP 556           HZ3      TRP 556  25.781  46.573  26.685
   43    HH2  TRP 556           HH2      TRP 556  25.501  44.847  28.483
   44    H    LYS 557           H        LYS 557  29.373  47.020  23.349
   45    HA   LYS 557           HA       LYS 557  31.209  47.944  21.265
   46    HB2  LYS 557           HB2      LYS 557  29.097  49.945  22.204
   47    HB3  LYS 557           HB3      LYS 557  30.374  50.143  21.007
   48    HG2  LYS 557           HG2      LYS 557  29.276  48.554  19.527
   49    HG3  LYS 557           HG3      LYS 557  27.888  48.501  20.620
   50    HD2  LYS 557           HD2      LYS 557  29.073  51.056  19.368
   51    HD3  LYS 557           HD3      LYS 557  27.741  50.162  18.668
   52    HE2  LYS 557           HE2      LYS 557  26.286  50.809  20.543
   53    HE3  LYS 557           HE3      LYS 557  27.635  51.419  21.458
   54    HZ1  LYS 557           HZ1      LYS 557  27.970  53.144  19.680
   55    HZ2  LYS 557           HZ2      LYS 557  26.557  52.684  19.012
   56    HZ3  LYS 557           HZ3      LYS 557  26.647  53.295  20.495
   57    HA   PRO 558           HA       PRO 558  33.429  49.056  24.964
   58    HB2  PRO 558           HB2      PRO 558  34.959  51.082  24.147
   59    HB3  PRO 558           HB3      PRO 558  35.211  49.373  23.658
   60    HG2  PRO 558           HG2      PRO 558  33.859  51.585  22.026
   61    HG3  PRO 558           HG3      PRO 558  35.043  50.412  21.427
   62    HD2  PRO 558           HD2      PRO 558  32.417  50.042  21.090
   63    HD3  PRO 558           HD3      PRO 558  33.502  48.668  21.405
   64    H    GLY 559           H        GLY 559  33.203  50.281  26.731
   65    HA2  GLY 559           HA2      GLY 559  32.992  52.375  27.863
   66    HA3  GLY 559           HA3      GLY 559  32.092  53.028  26.469
   67    H    ASP 560           H        ASP 560  31.630  50.228  28.767
   68    HA   ASP 560           HA       ASP 560  28.930  51.233  29.315
   69    HB2  ASP 560           HB2      ASP 560  29.211  49.776  27.025
   70    HB3  ASP 560           HB3      ASP 560  28.860  48.486  28.172
   71    H    GLU 561           H        GLU 561  28.957  51.101  31.437
   72    HA   GLU 561           HA       GLU 561  30.001  48.862  32.943
   73    HB2  GLU 561           HB2      GLU 561  28.916  49.841  34.878
   74    HB3  GLU 561           HB3      GLU 561  29.787  51.078  33.986
   75    HG2  GLU 561           HG2      GLU 561  27.714  51.870  32.936
   76    HG3  GLU 561           HG3      GLU 561  26.786  50.694  33.887
   77    H    CYS 562           H        CYS 562  29.373  46.906  32.942
   78    HA   CYS 562           HA       CYS 562  26.594  45.999  32.432
   79    HB2  CYS 562           HB2      CYS 562  29.080  44.992  30.960
   80    HB3  CYS 562           HB3      CYS 562  27.436  44.399  30.744
   81    HG   CYS 562           HG       CYS 562  28.726  47.301  30.053
   82    H    PHE 563           H        PHE 563  26.907  43.336  32.366
   83    HA   PHE 563           HA       PHE 563  28.264  42.616  34.921
   84    HB2  PHE 563           HB2      PHE 563  25.491  42.117  33.910
   85    HB3  PHE 563           HB3      PHE 563  26.278  40.734  34.589
   86    HD1  PHE 563           HD1      PHE 563  27.579  41.233  36.971
   87    HD2  PHE 563           HD2      PHE 563  24.274  43.456  35.345
   88    HE1  PHE 563           HE1      PHE 563  26.983  42.020  39.252
   89    HE2  PHE 563           HE2      PHE 563  23.714  44.284  37.639
   90    HZ   PHE 563           HZ       PHE 563  25.082  43.585  39.570
   91    H    ALA 564           H        ALA 564  29.898  41.152  34.660
   92    HA   ALA 564           HA       ALA 564  30.027  39.684  32.057
   93    HB1  ALA 564           HB1      ALA 564  32.471  39.924  32.443
   94    HB2  ALA 564           HB2      ALA 564  31.540  41.437  32.215
   95    HB3  ALA 564           HB3      ALA 564  32.101  40.959  33.845
   96    H    LEU 565           H        LEU 565  30.210  37.493  32.126
   97    HA   LEU 565           HA       LEU 565  29.854  36.165  34.638
   98    HB2  LEU 565           HB2      LEU 565  28.838  35.544  32.462
   99    HB3  LEU 565           HB3      LEU 565  30.450  35.102  31.874
  100    HG   LEU 565           HG       LEU 565  30.507  33.173  33.420
  101   HD11  LEU 565          HD11      LEU 565  29.561  34.032  35.315
  102   HD12  LEU 565          HD12      LEU 565  27.954  34.295  34.526
  103   HD13  LEU 565          HD13      LEU 565  28.567  32.652  34.841
  104   HD21  LEU 565          HD21      LEU 565  29.290  33.027  31.210
  105   HD22  LEU 565          HD22      LEU 565  28.545  31.946  32.410
  106   HD23  LEU 565          HD23      LEU 565  27.796  33.497  32.006
  107    H    TYR 566           H        TYR 566  31.401  35.424  35.927
  108    HA   TYR 566           HA       TYR 566  34.251  35.358  35.096
  109    HB2  TYR 566           HB2      TYR 566  33.338  36.675  37.135
  110    HB3  TYR 566           HB3      TYR 566  33.090  35.039  37.853
  111    HD1  TYR 566           HD1      TYR 566  35.689  36.944  35.992
  112    HD2  TYR 566           HD2      TYR 566  34.836  34.324  39.313
  113    HE1  TYR 566           HE1      TYR 566  38.068  36.854  36.496
  114    HE2  TYR 566           HE2      TYR 566  37.223  34.503  40.033
  115    HH   TYR 566           HH       TYR 566  39.620  36.042  38.060
  116    H    TRP 567           H        TRP 567  35.342  33.568  36.814
  117    HA   TRP 567           HA       TRP 567  34.179  31.058  35.679
  118    HB2  TRP 567           HB2      TRP 567  36.429  30.360  35.254
  119    HB3  TRP 567           HB3      TRP 567  36.375  32.057  34.773
  120    HD1  TRP 567           HD1      TRP 567  37.859  33.737  36.143
  121    HE1  TRP 567           HE1      TRP 567  39.412  33.589  38.150
  122    HE3  TRP 567           HE3      TRP 567  37.516  28.720  37.074
  123    HZ2  TRP 567           HZ2      TRP 567  40.290  31.605  40.040
  124    HZ3  TRP 567           HZ3      TRP 567  38.705  27.736  39.012
  125    HH2  TRP 567           HH2      TRP 567  39.997  29.198  40.575
  126    H    GLU 568           H        GLU 568  35.145  32.486  38.740
  127    HA   GLU 568           HA       GLU 568  36.298  30.182  39.922
  128    HB2  GLU 568           HB2      GLU 568  36.748  31.578  41.589
  129    HB3  GLU 568           HB3      GLU 568  36.199  32.814  40.519
  130    HG2  GLU 568           HG2      GLU 568  34.282  33.287  41.636
  131    HG3  GLU 568           HG3      GLU 568  34.088  31.649  42.313
  132    H    ASP 569           H        ASP 569  33.070  31.442  39.966
  133    HA   ASP 569           HA       ASP 569  31.823  28.917  40.905
  134    HB2  ASP 569           HB2      ASP 569  30.370  30.231  42.292
  135    HB3  ASP 569           HB3      ASP 569  32.067  30.609  42.698
  136    H    ASN 570           H        ASN 570  32.138  30.931  38.350
  137    HA   ASN 570           HA       ASN 570  30.863  31.633  36.555
  138    HB2  ASN 570           HB2      ASN 570  30.743  29.100  36.537
  139    HB3  ASN 570           HB3      ASN 570  29.093  29.295  37.160
  140   HD21  ASN 570          HD22      ASN 570  27.497  29.472  35.862
  141   HD22  ASN 570          HD21      ASN 570  27.544  29.908  34.159
  142    H    LYS 571           H        LYS 571  30.377  33.271  38.540
  143    HA   LYS 571           HA       LYS 571  27.468  33.902  38.270
  144    HB2  LYS 571           HB2      LYS 571  29.392  34.144  40.458
  145    HB3  LYS 571           HB3      LYS 571  28.714  35.728  40.022
  146    HG2  LYS 571           HG2      LYS 571  26.922  33.354  40.356
  147    HG3  LYS 571           HG3      LYS 571  27.611  34.112  41.784
  148    HD2  LYS 571           HD2      LYS 571  26.630  36.378  40.684
  149    HD3  LYS 571           HD3      LYS 571  25.512  35.237  39.928
  150    HE2  LYS 571           HE2      LYS 571  25.194  34.237  42.287
  151    HE3  LYS 571           HE3      LYS 571  26.243  35.513  42.881
  152    HZ1  LYS 571           HZ1      LYS 571  23.626  35.981  41.587
  153    HZ2  LYS 571           HZ2      LYS 571  23.880  36.000  43.181
  154    HZ3  LYS 571           HZ3      LYS 571  24.564  37.140  42.231
  155    H    PHE 572           H        PHE 572  26.933  36.083  37.694
  156    HA   PHE 572           HA       PHE 572  28.886  37.455  36.031
  157    HB2  PHE 572           HB2      PHE 572  26.113  38.356  36.921
  158    HB3  PHE 572           HB3      PHE 572  27.146  39.108  35.714
  159    HD1  PHE 572           HD1      PHE 572  25.072  36.089  36.452
  160    HD2  PHE 572           HD2      PHE 572  27.382  38.196  33.468
  161    HE1  PHE 572           HE1      PHE 572  24.331  34.496  34.771
  162    HE2  PHE 572           HE2      PHE 572  26.517  36.664  31.739
  163    HZ   PHE 572           HZ       PHE 572  24.955  34.807  32.372
  164    H    TYR 573           H        TYR 573  30.185  39.072  36.689
  165    HA   TYR 573           HA       TYR 573  29.593  40.511  39.237
  166    HB2  TYR 573           HB2      TYR 573  32.323  39.907  38.038
  167    HB3  TYR 573           HB3      TYR 573  31.972  40.871  39.465
  168    HD1  TYR 573           HD2      TYR 573  31.642  37.367  38.072
  169    HD2  TYR 573           HD1      TYR 573  31.830  39.848  41.569
  170    HE1  TYR 573           HE2      TYR 573  31.825  35.318  39.517
  171    HE2  TYR 573           HE1      TYR 573  31.830  37.779  43.017
  172    HH   TYR 573           HH       TYR 573  31.508  34.565  41.763
  173    H    ARG 574           H        ARG 574  29.832  42.755  39.226
  174    HA   ARG 574           HA       ARG 574  29.143  44.153  36.881
  175    HB2  ARG 574           HB2      ARG 574  30.365  45.060  39.517
  176    HB3  ARG 574           HB3      ARG 574  29.822  46.185  38.277
  177    HG2  ARG 574           HG2      ARG 574  27.519  45.330  38.400
  178    HG3  ARG 574           HG3      ARG 574  27.989  44.105  39.594
  179    HD2  ARG 574           HD2      ARG 574  26.967  45.790  40.806
  180    HD3  ARG 574           HD3      ARG 574  28.672  45.788  41.165
  181    HE   ARG 574           HE       ARG 574  28.933  47.906  39.938
  182   HH11  ARG 574          HH11      ARG 574  25.579  46.743  40.021
  183   HH12  ARG 574          HH12      ARG 574  24.986  48.344  39.618
  184   HH21  ARG 574          HH21      ARG 574  27.871  49.884  39.241
  185   HH22  ARG 574          HH22      ARG 574  26.163  50.023  39.635
  186    H    ALA 575           H        ALA 575  30.326  45.071  35.271
  187    HA   ALA 575           HA       ALA 575  33.200  45.613  35.545
  188    HB1  ALA 575           HB1      ALA 575  32.206  43.604  33.471
  189    HB2  ALA 575           HB2      ALA 575  33.862  44.228  33.681
  190    HB3  ALA 575           HB3      ALA 575  33.137  43.195  34.921
  191    H    GLU 576           H        GLU 576  33.760  47.402  34.444
  192    HA   GLU 576           HA       GLU 576  31.911  48.655  32.587
  193    HB2  GLU 576           HB2      GLU 576  34.556  49.469  33.857
  194    HB3  GLU 576           HB3      GLU 576  34.115  50.208  32.331
  195    HG2  GLU 576           HG2      GLU 576  31.926  50.912  33.344
  196    HG3  GLU 576           HG3      GLU 576  32.605  50.433  34.929
  197    H    VAL 577           H        VAL 577  31.860  47.897  30.515
  198    HA   VAL 577           HA       VAL 577  33.602  46.217  29.085
  199    HB   VAL 577           HB       VAL 577  31.395  48.179  28.534
  200   HG11  VAL 577          HG11      VAL 577  33.188  47.079  26.431
  201   HG12  VAL 577          HG12      VAL 577  31.428  47.003  26.135
  202   HG13  VAL 577          HG13      VAL 577  32.168  48.559  26.483
  203   HG21  VAL 577          HG21      VAL 577  30.742  46.055  29.413
  204   HG22  VAL 577          HG22      VAL 577  30.204  46.186  27.730
  205   HG23  VAL 577          HG23      VAL 577  31.616  45.185  28.102
  206    H    GLU 578           H        GLU 578  35.584  46.523  28.281
  207    HA   GLU 578           HA       GLU 578  36.578  49.311  28.005
  208    HB2  GLU 578           HB2      GLU 578  37.914  47.776  29.348
  209    HB3  GLU 578           HB3      GLU 578  38.074  46.644  28.020
  210    HG2  GLU 578           HG2      GLU 578  40.082  47.940  27.868
  211    HG3  GLU 578           HG3      GLU 578  39.035  48.605  26.640
  212    H    ALA 579           H        ALA 579  36.177  46.354  26.057
  213    HA   ALA 579           HA       ALA 579  36.199  47.722  23.506
  214    HB1  ALA 579           HB1      ALA 579  38.680  46.160  24.280
  215    HB2  ALA 579           HB2      ALA 579  38.295  46.974  22.723
  216    HB3  ALA 579           HB3      ALA 579  38.583  47.933  24.190
  217    H    LEU 580           H        LEU 580  34.562  46.593  22.808
  218    HA   LEU 580           HA       LEU 580  34.565  43.579  22.808
  219    HB2  LEU 580           HB2      LEU 580  32.013  45.204  22.689
  220    HB3  LEU 580           HB3      LEU 580  32.182  43.520  22.940
  221    HG   LEU 580           HG       LEU 580  32.475  45.800  24.737
  222   HD11  LEU 580          HD11      LEU 580  31.117  43.095  24.789
  223   HD12  LEU 580          HD12      LEU 580  31.666  43.601  26.354
  224   HD13  LEU 580          HD13      LEU 580  30.556  44.643  25.473
  225   HD21  LEU 580          HD21      LEU 580  33.664  44.087  26.503
  226   HD22  LEU 580          HD22      LEU 580  34.424  43.632  24.955
  227   HD23  LEU 580          HD23      LEU 580  34.427  45.323  25.550
  228    H    HIS 581           H        HIS 581  35.116  43.017  20.696
  229    HA   HIS 581           HA       HIS 581  34.577  44.413  18.341
  230    HB2  HIS 581           HB2      HIS 581  34.187  41.457  18.814
  231    HB3  HIS 581           HB3      HIS 581  34.399  42.284  17.249
  232    HD2  HIS 581           HD2      HIS 581  36.841  43.968  17.374
  233    HE1  HIS 581           HE1      HIS 581  38.980  40.868  19.337
  234    HE2  HIS 581           HE2      HIS 581  39.174  43.029  18.023
  235    H    SER 582           H        SER 582  32.989  44.777  17.053
  236    HA   SER 582           HA       SER 582  30.262  44.468  17.946
  237    HB2  SER 582           HB2      SER 582  29.714  45.525  15.763
  238    HB3  SER 582           HB3      SER 582  30.855  46.436  16.767
  239    HG   SER 582           HG       SER 582  31.620  46.292  14.716
  240    H    SER 583           H        SER 583  32.380  42.808  15.653
  241    HA   SER 583           HA       SER 583  30.663  40.435  16.027
  242    HB2  SER 583           HB2      SER 583  30.238  41.376  13.693
  243    HB3  SER 583           HB3      SER 583  31.972  41.075  13.379
  244    HG   SER 583           HG       SER 583  30.995  39.205  12.873
  245    H    GLY 584           H        GLY 584  31.884  38.457  16.102
  246    HA2  GLY 584           HA2      GLY 584  34.526  37.831  16.083
  247    HA3  GLY 584           HA3      GLY 584  34.429  38.932  17.453
  248    H    MET 585           H        MET 585  35.026  37.017  18.728
  249    HA   MET 585           HA       MET 585  32.626  35.470  19.586
  250    HB2  MET 585           HB2      MET 585  34.088  33.672  20.381
  251    HB3  MET 585           HB3      MET 585  34.130  33.824  18.648
  252    HG2  MET 585           HG2      MET 585  36.346  34.791  18.719
  253    HG3  MET 585           HG3      MET 585  36.275  34.982  20.457
  254    HE1  MET 585           HE1      MET 585  37.546  33.147  21.996
  255    HE2  MET 585           HE2      MET 585  35.849  32.602  22.132
  256    HE3  MET 585           HE3      MET 585  37.126  31.430  21.863
  257    H    THR 586           H        THR 586  35.398  37.473  20.622
  258    HA   THR 586           HA       THR 586  34.417  37.324  23.442
  259    HB   THR 586           HB       THR 586  36.821  37.539  24.152
  260    HG1  THR 586           HG1      THR 586  37.797  38.132  22.413
  261   HG21  THR 586          HG21      THR 586  36.233  35.019  22.605
  262   HG22  THR 586          HG22      THR 586  37.553  35.274  23.769
  263   HG23  THR 586          HG23      THR 586  35.893  35.356  24.351
  264    H    ALA 587           H        ALA 587  35.335  38.939  24.836
  265    HA   ALA 587           HA       ALA 587  35.346  41.679  23.769
  266    HB1  ALA 587           HB1      ALA 587  33.056  41.780  24.138
  267    HB2  ALA 587           HB2      ALA 587  33.019  40.209  24.973
  268    HB3  ALA 587           HB3      ALA 587  33.451  41.638  25.871
  269    H    VAL 588           H        VAL 588  36.267  43.149  25.114
  270    HA   VAL 588           HA       VAL 588  37.751  42.056  27.436
  271    HB   VAL 588           HB       VAL 588  38.262  44.797  26.249
  272   HG11  VAL 588          HG11      VAL 588  39.949  43.014  28.053
  273   HG12  VAL 588          HG12      VAL 588  40.506  44.478  27.239
  274   HG13  VAL 588          HG13      VAL 588  39.221  44.592  28.411
  275   HG21  VAL 588          HG21      VAL 588  39.883  43.951  24.815
  276   HG22  VAL 588          HG22      VAL 588  39.802  42.285  25.528
  277   HG23  VAL 588          HG23      VAL 588  38.523  42.896  24.488
  278    H    VAL 589           H        VAL 589  36.861  42.424  29.338
  279    HA   VAL 589           HA       VAL 589  35.411  44.968  29.822
  280    HB   VAL 589           HB       VAL 589  33.920  43.661  31.360
  281   HG11  VAL 589          HG11      VAL 589  33.454  44.339  28.954
  282   HG12  VAL 589          HG12      VAL 589  33.775  42.681  28.477
  283   HG13  VAL 589          HG13      VAL 589  32.444  43.015  29.603
  284   HG21  VAL 589          HG21      VAL 589  34.947  41.154  29.942
  285   HG22  VAL 589          HG22      VAL 589  35.306  41.539  31.623
  286   HG23  VAL 589          HG23      VAL 589  33.624  41.283  31.115
  287    H    LYS 590           H        LYS 590  35.861  46.021  31.727
  288    HA   LYS 590           HA       LYS 590  37.932  44.840  33.483
  289    HB2  LYS 590           HB2      LYS 590  38.757  46.906  32.549
  290    HB3  LYS 590           HB3      LYS 590  37.229  47.727  32.809
  291    HG2  LYS 590           HG2      LYS 590  37.635  47.893  35.196
  292    HG3  LYS 590           HG3      LYS 590  39.025  46.807  35.078
  293    HD2  LYS 590           HD2      LYS 590  40.357  48.456  33.993
  294    HD3  LYS 590           HD3      LYS 590  38.966  49.376  33.450
  295    HE2  LYS 590           HE2      LYS 590  39.402  49.263  36.418
  296    HE3  LYS 590           HE3      LYS 590  40.614  50.080  35.456
  297    HZ1  LYS 590           HZ1      LYS 590  38.615  51.513  36.192
  298    HZ2  LYS 590           HZ2      LYS 590  38.987  51.580  34.619
  299    HZ3  LYS 590           HZ3      LYS 590  37.769  50.679  35.039
  300    H    PHE 591           H        PHE 591  37.285  44.002  35.243
  301    HA   PHE 591           HA       PHE 591  34.788  44.311  36.569
  302    HB2  PHE 591           HB2      PHE 591  37.500  43.260  37.373
  303    HB3  PHE 591           HB3      PHE 591  36.086  43.129  38.408
  304    HD1  PHE 591           HD2      PHE 591  33.919  42.158  37.326
  305    HD2  PHE 591           HD1      PHE 591  37.826  41.550  35.642
  306    HE1  PHE 591           HE2      PHE 591  33.062  40.175  36.005
  307    HE2  PHE 591           HE1      PHE 591  36.937  39.648  34.293
  308    HZ   PHE 591           HZ       PHE 591  34.600  38.888  34.604
  309    H    ILE 592           H        ILE 592  34.005  45.843  37.761
  310    HA   ILE 592           HA       ILE 592  35.374  48.308  37.948
  311    HB   ILE 592           HB       ILE 592  32.777  47.697  39.418
  312   HG12  ILE 592          HG12      ILE 592  33.344  47.887  36.466
  313   HG13  ILE 592          HG13      ILE 592  32.286  46.764  37.365
  314   HG21  ILE 592          HG21      ILE 592  33.857  50.111  37.921
  315   HG22  ILE 592          HG22      ILE 592  32.364  50.082  38.907
  316   HG23  ILE 592          HG23      ILE 592  33.940  49.978  39.685
  317   HD11  ILE 592          HD11      ILE 592  30.674  48.626  37.683
  318   HD12  ILE 592          HD12      ILE 592  31.683  49.592  36.562
  319   HD13  ILE 592          HD13      ILE 592  30.938  48.062  36.023
  320    H    ASP 593           H        ASP 593  34.552  46.037  40.562
  321    HA   ASP 593           HA       ASP 593  35.933  47.680  42.558
  322    HB2  ASP 593           HB2      ASP 593  33.683  46.620  42.888
  323    HB3  ASP 593           HB3      ASP 593  34.459  45.059  43.008
  324    H    TYR 594           H        TYR 594  37.061  45.577  40.346
  325    HA   TYR 594           HA       TYR 594  39.262  44.399  42.016
  326    HB2  TYR 594           HB2      TYR 594  38.225  43.160  39.456
  327    HB3  TYR 594           HB3      TYR 594  39.264  42.485  40.698
  328    HD1  TYR 594           HD1      TYR 594  35.698  43.743  40.386
  329    HD2  TYR 594           HD2      TYR 594  38.467  40.933  42.154
  330    HE1  TYR 594           HE1      TYR 594  33.812  42.515  41.388
  331    HE2  TYR 594           HE2      TYR 594  36.596  39.789  43.259
  332    HH   TYR 594           HH       TYR 594  33.263  40.806  42.832
  333    H    GLY 595           H        GLY 595  38.518  46.513  39.347
  334    HA2  GLY 595           HA2      GLY 595  39.936  48.213  38.661
  335    HA3  GLY 595           HA3      GLY 595  41.321  47.323  39.361
  336    H    ASN 596           H        ASN 596  39.977  45.071  37.342
  337    HA   ASN 596           HA       ASN 596  41.898  45.914  35.228
  338    HB2  ASN 596           HB2      ASN 596  43.323  44.091  35.612
  339    HB3  ASN 596           HB3      ASN 596  43.029  44.853  37.153
  340   HD21  ASN 596          HD22      ASN 596  43.189  41.892  35.550
  341   HD22  ASN 596          HD21      ASN 596  42.149  40.968  36.600
  342    H    TYR 597           H        TYR 597  42.052  44.305  33.444
  343    HA   TYR 597           HA       TYR 597  39.334  43.381  32.771
  344    HB2  TYR 597           HB2      TYR 597  39.961  44.149  30.362
  345    HB3  TYR 597           HB3      TYR 597  39.230  45.194  31.520
  346    HD1  TYR 597           HD2      TYR 597  41.130  46.476  33.070
  347    HD2  TYR 597           HD1      TYR 597  41.572  45.314  28.944
  348    HE1  TYR 597           HE2      TYR 597  42.923  48.124  32.816
  349    HE2  TYR 597           HE1      TYR 597  43.334  47.011  28.651
  350    HH   TYR 597           HH       TYR 597  44.495  48.778  29.725
  351    H    GLU 598           H        GLU 598  39.078  41.865  31.099
  352    HA   GLU 598           HA       GLU 598  41.234  40.319  29.959
  353    HB2  GLU 598           HB2      GLU 598  40.533  38.228  30.942
  354    HB3  GLU 598           HB3      GLU 598  41.255  39.333  32.122
  355    HG2  GLU 598           HG2      GLU 598  39.057  39.760  33.134
  356    HG3  GLU 598           HG3      GLU 598  38.256  38.930  31.816
  357    H    GLU 599           H        GLU 599  40.310  38.497  28.712
  358    HA   GLU 599           HA       GLU 599  38.054  39.440  27.086
  359    HB2  GLU 599           HB2      GLU 599  38.783  38.046  25.418
  360    HB3  GLU 599           HB3      GLU 599  40.256  38.619  26.155
  361    HG2  GLU 599           HG2      GLU 599  39.095  35.844  26.441
  362    HG3  GLU 599           HG3      GLU 599  40.523  36.311  25.567
  363    H    VAL 600           H        VAL 600  36.001  38.637  27.188
  364    HA   VAL 600           HA       VAL 600  35.391  36.034  28.473
  365    HB   VAL 600           HB       VAL 600  33.759  38.582  28.957
  366   HG11  VAL 600          HG11      VAL 600  33.355  35.729  29.966
  367   HG12  VAL 600          HG12      VAL 600  32.325  37.072  30.403
  368   HG13  VAL 600          HG13      VAL 600  32.368  36.580  28.731
  369   HG21  VAL 600          HG21      VAL 600  35.820  38.524  30.388
  370   HG22  VAL 600          HG22      VAL 600  34.326  38.398  31.324
  371   HG23  VAL 600          HG23      VAL 600  35.299  36.960  31.046
  372    H    LEU 601           H        LEU 601  33.519  35.016  27.290
  373    HA   LEU 601           HA       LEU 601  33.144  35.752  24.566
  374    HB2  LEU 601           HB2      LEU 601  32.556  33.581  26.097
  375    HB3  LEU 601           HB3      LEU 601  30.965  34.337  26.092
  376    HG   LEU 601           HG       LEU 601  31.049  32.612  24.683
  377   HD11  LEU 601          HD11      LEU 601  30.680  35.131  23.130
  378   HD12  LEU 601          HD12      LEU 601  30.374  33.460  22.522
  379   HD13  LEU 601          HD13      LEU 601  29.506  34.032  23.925
  380   HD21  LEU 601          HD21      LEU 601  33.539  32.633  24.121
  381   HD22  LEU 601          HD22      LEU 601  32.495  32.236  22.763
  382   HD23  LEU 601          HD23      LEU 601  33.216  33.838  22.865
  383    H    LEU 602           H        LEU 602  31.735  37.095  23.584
  384    HA   LEU 602           HA       LEU 602  30.322  39.198  24.780
  385    HB2  LEU 602           HB2      LEU 602  29.839  37.625  22.221
  386    HB3  LEU 602           HB3      LEU 602  29.096  39.195  22.525
  387    HG   LEU 602           HG       LEU 602  32.124  38.843  22.608
  388   HD11  LEU 602          HD11      LEU 602  30.484  39.596  20.192
  389   HD12  LEU 602          HD12      LEU 602  32.273  39.613  20.358
  390   HD13  LEU 602          HD13      LEU 602  31.386  38.074  20.391
  391   HD21  LEU 602          HD21      LEU 602  30.901  41.001  23.471
  392   HD22  LEU 602          HD22      LEU 602  32.188  41.203  22.253
  393   HD23  LEU 602          HD23      LEU 602  30.494  41.279  21.766
  394    H    SER 603           H        SER 603  29.144  35.895  24.380
  395    HA   SER 603           HA       SER 603  26.432  36.684  25.166
  396    HB2  SER 603           HB2      SER 603  27.119  33.764  24.824
  397    HB3  SER 603           HB3      SER 603  25.678  34.676  24.344
  398    HG   SER 603           HG       SER 603  26.799  34.164  22.626
  399    H    ASN 604           H        ASN 604  28.993  36.524  26.886
  400    HA   ASN 604           HA       ASN 604  27.904  35.222  29.352
  401    HB2  ASN 604           HB2      ASN 604  30.636  35.101  28.068
  402    HB3  ASN 604           HB3      ASN 604  30.464  34.822  29.746
  403   HD21  ASN 604          HD22      ASN 604  27.650  33.145  29.204
  404   HD22  ASN 604          HD21      ASN 604  28.369  31.701  28.602
  405    H    ILE 605           H        ILE 605  28.149  38.053  27.976
  406    HA   ILE 605           HA       ILE 605  28.645  39.478  30.553
  407    HB   ILE 605           HB       ILE 605  28.954  40.839  27.864
  408   HG12  ILE 605          HG12      ILE 605  31.330  40.241  29.602
  409   HG13  ILE 605          HG13      ILE 605  30.782  39.007  28.453
  410   HG21  ILE 605          HG21      ILE 605  30.032  42.603  29.244
  411   HG22  ILE 605          HG22      ILE 605  28.328  42.310  29.631
  412   HG23  ILE 605          HG23      ILE 605  29.618  41.711  30.708
  413   HD11  ILE 605          HD11      ILE 605  30.977  40.574  26.580
  414   HD12  ILE 605          HD12      ILE 605  31.451  41.868  27.682
  415   HD13  ILE 605          HD13      ILE 605  32.499  40.427  27.491
  416    H    LYS 606           H        LYS 606  26.636  39.822  31.226
  417    HA   LYS 606           HA       LYS 606  24.273  40.288  29.491
  418    HB2  LYS 606           HB2      LYS 606  24.690  39.970  32.504
  419    HB3  LYS 606           HB3      LYS 606  23.166  40.521  31.805
  420    HG2  LYS 606           HG2      LYS 606  22.811  38.459  30.679
  421    HG3  LYS 606           HG3      LYS 606  24.411  37.826  31.133
  422    HD2  LYS 606           HD2      LYS 606  22.908  36.817  32.645
  423    HD3  LYS 606           HD3      LYS 606  23.683  38.116  33.591
  424    HE2  LYS 606           HE2      LYS 606  21.629  39.523  32.783
  425    HE3  LYS 606           HE3      LYS 606  20.952  37.931  32.388
  426    HZ1  LYS 606           HZ1      LYS 606  21.032  37.357  34.716
  427    HZ2  LYS 606           HZ2      LYS 606  21.891  38.694  35.114
  428    HZ3  LYS 606           HZ3      LYS 606  20.360  38.808  34.580
  429    HA   PRO 607           HA       PRO 607  24.466  44.767  30.440
  430    HB2  PRO 607           HB2      PRO 607  21.803  45.486  30.691
  431    HB3  PRO 607           HB3      PRO 607  22.627  45.244  29.125
  432    HG2  PRO 607           HG2      PRO 607  20.846  43.297  30.647
  433    HG3  PRO 607           HG3      PRO 607  20.874  43.701  28.902
  434    HD2  PRO 607           HD2      PRO 607  22.084  41.500  30.109
  435    HD3  PRO 607           HD3      PRO 607  22.716  42.250  28.589
  436    H    ILE 608           H        ILE 608  24.039  46.307  32.107
  437    HA   ILE 608           HA       ILE 608  23.594  45.247  34.820
  438    HB   ILE 608           HB       ILE 608  25.076  47.403  33.578
  439   HG12  ILE 608          HG12      ILE 608  25.054  46.236  36.390
  440   HG13  ILE 608          HG13      ILE 608  25.989  45.696  35.005
  441   HG21  ILE 608          HG21      ILE 608  23.404  48.308  35.948
  442   HG22  ILE 608          HG22      ILE 608  24.797  49.181  35.264
  443   HG23  ILE 608          HG23      ILE 608  23.361  48.988  34.295
  444   HD11  ILE 608          HD11      ILE 608  27.250  47.946  35.097
  445   HD12  ILE 608          HD12      ILE 608  26.300  48.349  36.527
  446   HD13  ILE 608          HD13      ILE 608  27.423  46.982  36.561
  447    H    LEU 609           H        LEU 609  21.924  47.416  32.529
  448    HA   LEU 609           HA       LEU 609  19.419  47.280  34.094
  449    HB2  LEU 609           HB2      LEU 609  20.534  49.193  34.965
  450    HB3  LEU 609           HB3      LEU 609  21.025  49.758  33.386
  451    HG   LEU 609           HG       LEU 609  19.291  51.089  34.402
  452   HD11  LEU 609          HD11      LEU 609  17.628  51.304  32.732
  453   HD12  LEU 609          HD12      LEU 609  19.239  51.109  32.007
  454   HD13  LEU 609          HD13      LEU 609  18.026  49.798  31.948
  455   HD21  LEU 609          HD21      LEU 609  17.403  48.682  34.268
  456   HD22  LEU 609          HD22      LEU 609  18.199  49.266  35.731
  457   HD23  LEU 609          HD23      LEU 609  17.059  50.317  34.867
  458    H    GLU 610           H        GLU 610  17.930  46.656  32.627
  459    HA   GLU 610           HA       GLU 610  17.896  47.630  29.859
  460    HB2  GLU 610           HB2      GLU 610  19.436  45.691  29.814
  461    HB3  GLU 610           HB3      GLU 610  18.168  44.632  30.379
  462    HG2  GLU 610           HG2      GLU 610  18.273  46.182  27.728
  463    HG3  GLU 610           HG3      GLU 610  18.720  44.515  27.926
  464    H1   TYR 611           H1       TYR 611  51.608  39.465  56.660
  465    H2   TYR 611           H2       TYR 611  53.116  39.335  56.077
  466    H3   TYR 611           H3       TYR 611  51.968  38.199  55.726
  467    HA   TYR 611           HA       TYR 611  50.670  39.923  54.612
  468    HB2  TYR 611           HB2      TYR 611  51.711  42.058  54.137
  469    HB3  TYR 611           HB3      TYR 611  51.645  41.724  55.859
  470    HD1  TYR 611           HD1      TYR 611  53.917  42.142  52.958
  471    HD2  TYR 611           HD2      TYR 611  53.711  41.705  57.268
  472    HE1  TYR 611           HE1      TYR 611  56.278  42.782  53.150
  473    HE2  TYR 611           HE2      TYR 611  56.040  42.501  57.437
  474    HH   TYR 611           HH       TYR 611  58.036  43.137  54.703
  475    H    SER 612           H        SER 612  50.547  39.062  52.406
  476    HA   SER 612           HA       SER 612  52.962  39.252  50.747
  477    HB2  SER 612           HB2      SER 612  51.543  36.629  51.348
  478    HB3  SER 612           HB3      SER 612  52.574  36.852  49.904
  479    HG   SER 612           HG       SER 612  53.482  37.384  52.482
  480    HA   PRO 613           HA       PRO 613  49.745  40.435  47.910
  481    HB2  PRO 613           HB2      PRO 613  50.981  40.487  45.463
  482    HB3  PRO 613           HB3      PRO 613  51.437  41.581  46.783
  483    HG2  PRO 613           HG2      PRO 613  52.780  39.094  45.872
  484    HG3  PRO 613           HG3      PRO 613  53.498  40.623  46.475
  485    HD2  PRO 613           HD2      PRO 613  53.201  38.339  48.109
  486    HD3  PRO 613           HD3      PRO 613  53.328  40.008  48.703
  487    H    SER 614           H        SER 614  49.314  37.755  48.575
  488    HA   SER 614           HA       SER 614  49.052  36.081  46.107
  489    HB2  SER 614           HB2      SER 614  48.515  35.162  48.958
  490    HB3  SER 614           HB3      SER 614  48.911  34.213  47.528
  491    HG   SER 614           HG       SER 614  50.908  35.404  47.521
  492    H    SER 615           H        SER 615  47.456  38.334  46.482
  493    HA   SER 615           HA       SER 615  44.735  37.202  46.377
  494    HB2  SER 615           HB2      SER 615  45.499  39.556  48.218
  495    HB3  SER 615           HB3      SER 615  43.870  39.064  47.770
  496    HG   SER 615           HG       SER 615  45.774  37.641  49.267
  497    HA   PRO 616           HA       PRO 616  46.421  40.227  43.313
  498    HB2  PRO 616           HB2      PRO 616  45.099  38.848  41.048
  499    HB3  PRO 616           HB3      PRO 616  46.815  39.241  41.266
  500    HG2  PRO 616           HG2      PRO 616  45.910  36.670  41.491
  501    HG3  PRO 616           HG3      PRO 616  47.316  37.357  42.345
  502    HD2  PRO 616           HD2      PRO 616  44.596  36.764  43.465
  503    HD3  PRO 616           HD3      PRO 616  46.176  36.629  44.229
  504   HC11  DA2 617          HC11      DA2 617  35.859  40.485  39.004
  505   HC12  DA2 617          HC12      DA2 617  37.574  40.188  38.768
  506   HC13  DA2 617          HC13      DA2 617  36.406  39.254  37.802
  507   HC21  DA2 617          HC21      DA2 617  34.417  38.602  39.493
  508   HC22  DA2 617          HC22      DA2 617  34.954  38.418  41.177
  509   HC23  DA2 617          HC23      DA2 617  35.122  37.094  40.043
  510    H2   DA2 617           H        DA2 617  43.123  39.303  43.733
  511    HA   DA2 617           HA       DA2 617  42.131  41.941  42.734
  512   HCB1  DA2 617          HCB1      DA2 617  42.116  40.131  40.866
  513   HCB2  DA2 617          HCB2      DA2 617  40.641  41.032  41.129
  514   HCG1  DA2 617          HCG1      DA2 617  41.340  38.361  42.438
  515   HCG2  DA2 617          HCG2      DA2 617  39.776  39.203  42.568
  516   HCD1  DA2 617          HCD1      DA2 617  40.903  38.050  40.003
  517   HCD2  DA2 617          HCD2      DA2 617  39.929  37.185  41.204
  518    HNE  DA2 617           HNE      DA2 617  39.039  39.449  39.464
  519   HNH2  DA2 617          HNH2      DA2 617  38.317  37.017  41.915
  520   HNH1  DA2 617          HNH1      DA2 617  36.623  36.976  41.543
  521    H    TYR 618           H        TYR 618  41.718  39.292  45.028
  522    HA   TYR 618           HA       TYR 618  39.375  40.553  46.319
  523    HB2  TYR 618           HB2      TYR 618  38.425  39.177  44.516
  524    HB3  TYR 618           HB3      TYR 618  39.412  37.820  45.009
  525    HD1  TYR 618           HD2      TYR 618  36.664  40.081  46.267
  526    HD2  TYR 618           HD1      TYR 618  38.784  36.363  46.636
  527    HE1  TYR 618           HE2      TYR 618  34.741  39.107  47.569
  528    HE2  TYR 618           HE1      TYR 618  36.852  35.370  47.890
  529    HH   TYR 618           HH       TYR 618  34.706  35.652  48.345
  530    H    THR 619           H        THR 619  39.434  40.339  48.342
  531    HA   THR 619           HA       THR 619  40.193  38.111  49.927
  532    HB   THR 619           HB       THR 619  42.376  38.469  49.309
  533    HG1  THR 619           HG1      THR 619  42.361  39.667  51.766
  534   HG21  THR 619          HG21      THR 619  42.208  41.364  50.245
  535   HG22  THR 619          HG22      THR 619  43.663  40.512  49.634
  536   HG23  THR 619          HG23      THR 619  42.331  40.832  48.557
  537    HA   PRO 620           HA       PRO 620  37.619  41.658  51.831
  538    HB2  PRO 620           HB2      PRO 620  35.320  40.143  52.489
  539    HB3  PRO 620           HB3      PRO 620  35.616  41.109  51.026
  540    HG2  PRO 620           HG2      PRO 620  35.900  38.153  51.498
  541    HG3  PRO 620           HG3      PRO 620  35.327  38.939  50.011
  542    HD2  PRO 620           HD2      PRO 620  37.841  37.928  50.289
  543    HD3  PRO 620           HD3      PRO 620  37.458  39.314  49.227
  544    H    GLN 621           H        GLN 621  39.141  39.009  53.313
  545    HA   GLN 621           HA       GLN 621  38.778  40.261  55.983
  546    HB2  GLN 621           HB2      GLN 621  39.111  37.296  55.538
  547    HB3  GLN 621           HB3      GLN 621  38.771  38.156  57.022
  548    HG2  GLN 621           HG2      GLN 621  36.479  38.753  56.076
  549    HG3  GLN 621           HG3      GLN 621  36.888  37.817  54.625
  550   HE21  GLN 621          HE22      GLN 621  34.723  36.950  55.739
  551   HE22  GLN 621          HE21      GLN 621  35.066  35.430  56.571
  552    H    SER 622           H        SER 622  41.057  40.685  54.049
  553    HA   SER 622           HA       SER 622  43.423  39.524  54.542
  554    HB2  SER 622           HB2      SER 622  42.805  42.482  54.614
  555    HB3  SER 622           HB3      SER 622  44.429  41.749  54.429
  556    HG   SER 622           HG       SER 622  43.218  42.156  52.513
  557    HA   PRO 623           HA       PRO 623  44.274  39.307  58.891
  558    HB2  PRO 623           HB2      PRO 623  47.175  39.633  58.154
  559    HB3  PRO 623           HB3      PRO 623  46.410  38.393  59.200
  560    HG2  PRO 623           HG2      PRO 623  47.138  37.831  56.671
  561    HG3  PRO 623           HG3      PRO 623  45.617  37.192  57.406
  562    HD2  PRO 623           HD2      PRO 623  45.948  39.407  55.403
  563    HD3  PRO 623           HD3      PRO 623  44.716  38.140  55.548
  Start of MODEL   14
    1    H1   MET 553           H1       MET 553  19.064  42.565  15.008
    2    H2   MET 553           H2       MET 553  18.477  43.167  16.414
    3    H3   MET 553           H3       MET 553  17.832  41.813  15.750
    4    HA   MET 553           HA       MET 553  19.060  41.035  17.480
    5    HB2  MET 553           HB2      MET 553  19.510  39.880  15.240
    6    HB3  MET 553           HB3      MET 553  20.923  40.899  15.043
    7    HG2  MET 553           HG2      MET 553  21.770  38.871  15.840
    8    HG3  MET 553           HG3      MET 553  21.771  39.924  17.229
    9    HE1  MET 553           HE1      MET 553  19.089  37.621  15.303
   10    HE2  MET 553           HE2      MET 553  20.398  36.462  15.723
   11    HE3  MET 553           HE3      MET 553  18.803  36.321  16.446
   12    H    LYS 554           H        LYS 554  19.692  42.424  19.124
   13    HA   LYS 554           HA       LYS 554  21.515  44.529  18.928
   14    HB2  LYS 554           HB2      LYS 554  21.693  44.358  21.369
   15    HB3  LYS 554           HB3      LYS 554  20.023  44.163  20.799
   16    HG2  LYS 554           HG2      LYS 554  20.324  41.671  21.005
   17    HG3  LYS 554           HG3      LYS 554  21.966  42.002  21.646
   18    HD2  LYS 554           HD2      LYS 554  20.907  43.394  23.418
   19    HD3  LYS 554           HD3      LYS 554  19.298  42.862  22.865
   20    HE2  LYS 554           HE2      LYS 554  19.873  40.515  23.247
   21    HE3  LYS 554           HE3      LYS 554  21.477  40.979  23.800
   22    HZ1  LYS 554           HZ1      LYS 554  18.938  41.575  25.210
   23    HZ2  LYS 554           HZ2      LYS 554  20.215  40.734  25.700
   24    HZ3  LYS 554           HZ3      LYS 554  20.334  42.358  25.504
   25    H    MET 555           H        MET 555  23.696  44.770  19.639
   26    HA   MET 555           HA       MET 555  25.491  42.430  19.798
   27    HB2  MET 555           HB2      MET 555  26.998  43.387  18.108
   28    HB3  MET 555           HB3      MET 555  25.459  42.807  17.461
   29    HG2  MET 555           HG2      MET 555  24.842  44.767  16.672
   30    HG3  MET 555           HG3      MET 555  25.461  45.710  18.048
   31    HE1  MET 555           HE1      MET 555  26.901  46.933  14.446
   32    HE2  MET 555           HE2      MET 555  25.314  46.295  14.906
   33    HE3  MET 555           HE3      MET 555  26.079  47.561  15.894
   34    H    TRP 556           H        TRP 556  27.510  42.906  20.807
   35    HA   TRP 556           HA       TRP 556  27.437  45.102  22.660
   36    HB2  TRP 556           HB2      TRP 556  29.473  42.979  21.980
   37    HB3  TRP 556           HB3      TRP 556  29.862  44.258  23.094
   38    HD1  TRP 556           HD1      TRP 556  29.360  40.997  23.680
   39    HE1  TRP 556           HE1      TRP 556  27.963  40.380  25.687
   40    HE3  TRP 556           HE3      TRP 556  26.635  45.429  24.423
   41    HZ2  TRP 556           HZ2      TRP 556  26.343  41.583  27.565
   42    HZ3  TRP 556           HZ3      TRP 556  25.235  45.570  26.431
   43    HH2  TRP 556           HH2      TRP 556  24.999  43.688  27.962
   44    H    LYS 557           H        LYS 557  28.864  46.657  23.104
   45    HA   LYS 557           HA       LYS 557  30.483  47.905  20.976
   46    HB2  LYS 557           HB2      LYS 557  28.134  48.446  20.491
   47    HB3  LYS 557           HB3      LYS 557  27.864  48.990  22.137
   48    HG2  LYS 557           HG2      LYS 557  29.373  50.987  21.660
   49    HG3  LYS 557           HG3      LYS 557  29.339  50.495  19.968
   50    HD2  LYS 557           HD2      LYS 557  26.817  51.012  21.662
   51    HD3  LYS 557           HD3      LYS 557  27.600  52.292  20.801
   52    HE2  LYS 557           HE2      LYS 557  27.280  51.246  18.677
   53    HE3  LYS 557           HE3      LYS 557  26.485  49.840  19.400
   54    HZ1  LYS 557           HZ1      LYS 557  24.771  51.276  20.273
   55    HZ2  LYS 557           HZ2      LYS 557  25.488  52.602  19.728
   56    HZ3  LYS 557           HZ3      LYS 557  24.872  51.561  18.665
   57    HA   PRO 558           HA       PRO 558  32.741  49.267  24.634
   58    HB2  PRO 558           HB2      PRO 558  34.048  51.458  23.787
   59    HB3  PRO 558           HB3      PRO 558  34.361  49.814  23.166
   60    HG2  PRO 558           HG2      PRO 558  32.622  51.883  21.791
   61    HG3  PRO 558           HG3      PRO 558  34.061  50.997  21.192
   62    HD2  PRO 558           HD2      PRO 558  31.516  50.029  20.774
   63    HD3  PRO 558           HD3      PRO 558  32.858  48.931  21.173
   64    H    GLY 559           H        GLY 559  32.576  50.724  26.461
   65    HA2  GLY 559           HA2      GLY 559  31.688  52.282  27.814
   66    HA3  GLY 559           HA3      GLY 559  31.009  53.123  26.420
   67    H    ASP 560           H        ASP 560  30.334  50.005  28.207
   68    HA   ASP 560           HA       ASP 560  27.747  51.094  29.040
   69    HB2  ASP 560           HB2      ASP 560  27.787  49.412  26.697
   70    HB3  ASP 560           HB3      ASP 560  27.120  48.447  27.977
   71    H    GLU 561           H        GLU 561  27.598  50.633  31.151
   72    HA   GLU 561           HA       GLU 561  29.092  48.426  32.217
   73    HB2  GLU 561           HB2      GLU 561  28.031  48.574  34.339
   74    HB3  GLU 561           HB3      GLU 561  28.576  50.134  33.782
   75    HG2  GLU 561           HG2      GLU 561  26.237  50.711  33.149
   76    HG3  GLU 561           HG3      GLU 561  25.660  49.215  33.894
   77    H    CYS 562           H        CYS 562  28.846  46.463  32.362
   78    HA   CYS 562           HA       CYS 562  26.262  45.126  31.984
   79    HB2  CYS 562           HB2      CYS 562  28.733  44.347  30.348
   80    HB3  CYS 562           HB3      CYS 562  27.101  43.698  30.164
   81    HG   CYS 562           HG       CYS 562  28.270  46.655  29.393
   82    H    PHE 563           H        PHE 563  26.920  42.570  32.009
   83    HA   PHE 563           HA       PHE 563  28.269  42.145  34.641
   84    HB2  PHE 563           HB2      PHE 563  25.559  41.356  33.611
   85    HB3  PHE 563           HB3      PHE 563  26.478  40.066  34.374
   86    HD1  PHE 563           HD1      PHE 563  27.674  40.846  36.702
   87    HD2  PHE 563           HD2      PHE 563  23.980  42.184  34.989
   88    HE1  PHE 563           HE1      PHE 563  26.808  41.366  38.974
   89    HE2  PHE 563           HE2      PHE 563  23.302  43.147  37.182
   90    HZ   PHE 563           HZ       PHE 563  24.678  42.646  39.216
   91    H    ALA 564           H        ALA 564  30.069  41.039  34.299
   92    HA   ALA 564           HA       ALA 564  30.261  39.274  31.899
   93    HB1  ALA 564           HB1      ALA 564  32.204  40.981  33.464
   94    HB2  ALA 564           HB2      ALA 564  32.707  39.830  32.193
   95    HB3  ALA 564           HB3      ALA 564  31.600  41.194  31.810
   96    H    LEU 565           H        LEU 565  30.750  37.296  32.004
   97    HA   LEU 565           HA       LEU 565  30.350  35.684  34.292
   98    HB2  LEU 565           HB2      LEU 565  29.744  35.220  31.953
   99    HB3  LEU 565           HB3      LEU 565  31.457  35.045  31.553
  100    HG   LEU 565           HG       LEU 565  31.553  33.017  33.076
  101   HD11  LEU 565          HD11      LEU 565  28.626  33.742  33.500
  102   HD12  LEU 565          HD12      LEU 565  29.210  32.100  33.636
  103   HD13  LEU 565          HD13      LEU 565  29.924  33.381  34.671
  104   HD21  LEU 565          HD21      LEU 565  30.488  31.523  31.647
  105   HD22  LEU 565          HD22      LEU 565  29.343  32.751  31.039
  106   HD23  LEU 565          HD23      LEU 565  31.097  32.821  30.646
  107    H    TYR 566           H        TYR 566  31.845  34.645  35.620
  108    HA   TYR 566           HA       TYR 566  34.746  35.067  35.311
  109    HB2  TYR 566           HB2      TYR 566  33.079  35.539  37.321
  110    HB3  TYR 566           HB3      TYR 566  33.238  33.834  37.612
  111    HD1  TYR 566           HD1      TYR 566  36.105  36.153  36.575
  112    HD2  TYR 566           HD2      TYR 566  34.127  33.966  39.741
  113    HE1  TYR 566           HE1      TYR 566  38.111  36.375  37.991
  114    HE2  TYR 566           HE2      TYR 566  36.082  34.256  41.169
  115    HH   TYR 566           HH       TYR 566  39.049  35.660  40.172
  116    H    TRP 567           H        TRP 567  35.922  33.114  36.584
  117    HA   TRP 567           HA       TRP 567  35.425  30.742  34.802
  118    HB2  TRP 567           HB2      TRP 567  37.872  30.486  34.723
  119    HB3  TRP 567           HB3      TRP 567  37.446  32.125  34.217
  120    HD1  TRP 567           HD1      TRP 567  38.074  34.120  35.739
  121    HE1  TRP 567           HE1      TRP 567  39.643  34.403  37.794
  122    HE3  TRP 567           HE3      TRP 567  38.903  29.215  36.879
  123    HZ2  TRP 567           HZ2      TRP 567  40.660  32.840  39.821
  124    HZ3  TRP 567           HZ3      TRP 567  40.032  28.648  39.080
  125    HH2  TRP 567           HH2      TRP 567  40.907  30.460  40.516
  126    H    GLU 568           H        GLU 568  36.547  31.727  38.002
  127    HA   GLU 568           HA       GLU 568  37.005  29.349  39.322
  128    HB2  GLU 568           HB2      GLU 568  37.405  31.647  40.176
  129    HB3  GLU 568           HB3      GLU 568  35.662  31.973  40.087
  130    HG2  GLU 568           HG2      GLU 568  36.280  31.794  42.326
  131    HG3  GLU 568           HG3      GLU 568  35.323  30.378  41.991
  132    H    ASP 569           H        ASP 569  33.796  31.079  39.135
  133    HA   ASP 569           HA       ASP 569  32.486  28.603  40.086
  134    HB2  ASP 569           HB2      ASP 569  30.989  30.271  41.268
  135    HB3  ASP 569           HB3      ASP 569  32.679  30.225  41.851
  136    H    ASN 570           H        ASN 570  32.772  30.736  37.568
  137    HA   ASN 570           HA       ASN 570  31.606  31.343  35.784
  138    HB2  ASN 570           HB2      ASN 570  31.422  28.784  35.730
  139    HB3  ASN 570           HB3      ASN 570  29.772  28.970  36.341
  140   HD21  ASN 570          HD22      ASN 570  31.921  29.890  33.726
  141   HD22  ASN 570          HD21      ASN 570  30.674  29.881  32.475
  142    H    LYS 571           H        LYS 571  30.970  32.761  38.045
  143    HA   LYS 571           HA       LYS 571  28.065  33.344  37.691
  144    HB2  LYS 571           HB2      LYS 571  30.008  33.696  39.969
  145    HB3  LYS 571           HB3      LYS 571  28.967  35.056  39.659
  146    HG2  LYS 571           HG2      LYS 571  27.736  32.280  39.772
  147    HG3  LYS 571           HG3      LYS 571  28.150  33.118  41.255
  148    HD2  LYS 571           HD2      LYS 571  26.879  35.052  40.718
  149    HD3  LYS 571           HD3      LYS 571  26.464  34.475  39.094
  150    HE2  LYS 571           HE2      LYS 571  25.204  32.596  40.078
  151    HE3  LYS 571           HE3      LYS 571  25.654  33.129  41.705
  152    HZ1  LYS 571           HZ1      LYS 571  23.443  33.763  41.055
  153    HZ2  LYS 571           HZ2      LYS 571  24.333  35.056  41.466
  154    HZ3  LYS 571           HZ3      LYS 571  24.010  34.766  39.894
  155    H    PHE 572           H        PHE 572  27.365  35.554  37.348
  156    HA   PHE 572           HA       PHE 572  29.339  37.036  35.731
  157    HB2  PHE 572           HB2      PHE 572  26.420  37.733  36.187
  158    HB3  PHE 572           HB3      PHE 572  27.526  38.341  34.951
  159    HD1  PHE 572           HD1      PHE 572  25.433  35.366  35.887
  160    HD2  PHE 572           HD2      PHE 572  28.078  37.196  33.002
  161    HE1  PHE 572           HE1      PHE 572  24.747  33.707  34.188
  162    HE2  PHE 572           HE2      PHE 572  27.245  35.636  31.264
  163    HZ   PHE 572           HZ       PHE 572  25.603  33.842  31.892
  164    H    TYR 573           H        TYR 573  30.292  38.897  36.370
  165    HA   TYR 573           HA       TYR 573  29.459  40.228  38.890
  166    HB2  TYR 573           HB2      TYR 573  32.305  39.937  37.830
  167    HB3  TYR 573           HB3      TYR 573  31.771  40.801  39.261
  168    HD1  TYR 573           HD2      TYR 573  31.872  37.287  37.825
  169    HD2  TYR 573           HD1      TYR 573  31.622  39.873  41.294
  170    HE1  TYR 573           HE2      TYR 573  32.198  35.343  39.308
  171    HE2  TYR 573           HE1      TYR 573  31.864  37.911  42.764
  172    HH   TYR 573           HH       TYR 573  32.388  34.637  41.575
  173    H    ARG 574           H        ARG 574  29.885  42.523  38.920
  174    HA   ARG 574           HA       ARG 574  28.857  43.835  36.535
  175    HB2  ARG 574           HB2      ARG 574  29.910  45.045  39.150
  176    HB3  ARG 574           HB3      ARG 574  28.959  45.911  37.954
  177    HG2  ARG 574           HG2      ARG 574  27.151  44.172  38.242
  178    HG3  ARG 574           HG3      ARG 574  28.050  43.553  39.639
  179    HD2  ARG 574           HD2      ARG 574  26.847  46.334  39.374
  180    HD3  ARG 574           HD3      ARG 574  26.224  45.034  40.360
  181    HE   ARG 574           HE       ARG 574  28.082  45.144  41.873
  182   HH11  ARG 574          HH11      ARG 574  28.006  47.805  39.513
  183   HH12  ARG 574          HH12      ARG 574  28.914  48.819  40.633
  184   HH21  ARG 574          HH21      ARG 574  29.411  46.506  43.010
  185   HH22  ARG 574          HH22      ARG 574  29.764  48.100  42.424
  186    H    ALA 575           H        ALA 575  29.817  45.229  35.031
  187    HA   ALA 575           HA       ALA 575  32.603  45.903  35.332
  188    HB1  ALA 575           HB1      ALA 575  31.640  43.969  33.157
  189    HB2  ALA 575           HB2      ALA 575  33.293  44.622  33.258
  190    HB3  ALA 575           HB3      ALA 575  32.702  43.528  34.511
  191    H    GLU 576           H        GLU 576  33.148  47.721  34.154
  192    HA   GLU 576           HA       GLU 576  31.135  48.912  32.359
  193    HB2  GLU 576           HB2      GLU 576  33.835  49.903  33.348
  194    HB3  GLU 576           HB3      GLU 576  32.591  50.802  32.402
  195    HG2  GLU 576           HG2      GLU 576  31.076  50.215  34.484
  196    HG3  GLU 576           HG3      GLU 576  32.633  50.021  35.311
  197    H    VAL 577           H        VAL 577  31.080  48.193  30.302
  198    HA   VAL 577           HA       VAL 577  33.089  46.738  28.960
  199    HB   VAL 577           HB       VAL 577  30.653  48.291  28.074
  200   HG11  VAL 577          HG11      VAL 577  32.886  47.566  26.277
  201   HG12  VAL 577          HG12      VAL 577  31.245  47.102  25.766
  202   HG13  VAL 577          HG13      VAL 577  31.566  48.773  26.186
  203   HG21  VAL 577          HG21      VAL 577  30.222  46.140  29.026
  204   HG22  VAL 577          HG22      VAL 577  29.936  46.069  27.297
  205   HG23  VAL 577          HG23      VAL 577  31.424  45.348  27.983
  206    H    GLU 578           H        GLU 578  35.086  47.331  28.127
  207    HA   GLU 578           HA       GLU 578  35.625  50.206  27.636
  208    HB2  GLU 578           HB2      GLU 578  37.102  49.137  29.230
  209    HB3  GLU 578           HB3      GLU 578  37.469  47.842  28.116
  210    HG2  GLU 578           HG2      GLU 578  39.316  49.382  28.185
  211    HG3  GLU 578           HG3      GLU 578  38.604  49.393  26.593
  212    H    ALA 579           H        ALA 579  35.866  47.031  25.935
  213    HA   ALA 579           HA       ALA 579  35.577  48.232  23.292
  214    HB1  ALA 579           HB1      ALA 579  38.278  47.249  24.260
  215    HB2  ALA 579           HB2      ALA 579  37.914  47.494  22.532
  216    HB3  ALA 579           HB3      ALA 579  37.914  48.878  23.619
  217    H    LEU 580           H        LEU 580  34.265  46.741  22.335
  218    HA   LEU 580           HA       LEU 580  34.711  43.860  23.026
  219    HB2  LEU 580           HB2      LEU 580  32.036  45.089  22.383
  220    HB3  LEU 580           HB3      LEU 580  32.355  43.479  22.928
  221    HG   LEU 580           HG       LEU 580  32.063  45.971  24.375
  222   HD11  LEU 580          HD11      LEU 580  31.266  43.106  24.745
  223   HD12  LEU 580          HD12      LEU 580  31.456  43.937  26.260
  224   HD13  LEU 580          HD13      LEU 580  30.365  44.598  25.094
  225   HD21  LEU 580          HD21      LEU 580  34.057  46.116  25.343
  226   HD22  LEU 580          HD22      LEU 580  33.389  44.979  26.480
  227   HD23  LEU 580          HD23      LEU 580  34.463  44.419  25.165
  228    H    HIS 581           H        HIS 581  36.266  44.417  21.114
  229    HA   HIS 581           HA       HIS 581  35.026  42.743  18.964
  230    HB2  HIS 581           HB2      HIS 581  36.864  45.061  18.379
  231    HB3  HIS 581           HB3      HIS 581  36.035  44.030  17.206
  232    HD2  HIS 581           HD2      HIS 581  33.116  44.282  17.381
  233    HE1  HIS 581           HE1      HIS 581  33.356  48.335  18.651
  234    HE2  HIS 581           HE2      HIS 581  31.800  46.457  17.855
  235    H    SER 582           H        SER 582  37.331  42.604  21.208
  236    HA   SER 582           HA       SER 582  39.818  42.296  19.837
  237    HB2  SER 582           HB2      SER 582  38.958  41.322  22.576
  238    HB3  SER 582           HB3      SER 582  40.636  41.392  21.974
  239    HG   SER 582           HG       SER 582  39.842  43.208  23.181
  240    H    SER 583           H        SER 583  40.920  40.698  19.022
  241    HA   SER 583           HA       SER 583  41.130  39.182  17.499
  242    HB2  SER 583           HB2      SER 583  40.204  37.049  19.418
  243    HB3  SER 583           HB3      SER 583  41.615  37.076  18.348
  244    HG   SER 583           HG       SER 583  42.559  38.548  19.717
  245    H    GLY 584           H        GLY 584  38.141  40.015  17.863
  246    HA2  GLY 584           HA2      GLY 584  36.330  39.805  16.487
  247    HA3  GLY 584           HA3      GLY 584  36.994  38.357  15.739
  248    H    MET 585           H        MET 585  37.101  38.071  19.111
  249    HA   MET 585           HA       MET 585  34.688  36.289  19.301
  250    HB2  MET 585           HB2      MET 585  36.126  34.534  20.260
  251    HB3  MET 585           HB3      MET 585  36.340  34.769  18.529
  252    HG2  MET 585           HG2      MET 585  38.409  35.873  18.784
  253    HG3  MET 585           HG3      MET 585  38.229  36.054  20.529
  254    HE1  MET 585           HE1      MET 585  37.737  33.690  21.961
  255    HE2  MET 585           HE2      MET 585  39.077  32.517  21.878
  256    HE3  MET 585           HE3      MET 585  39.445  34.209  22.200
  257    H    THR 586           H        THR 586  37.281  37.936  21.168
  258    HA   THR 586           HA       THR 586  35.561  37.685  23.636
  259    HB   THR 586           HB       THR 586  37.561  38.343  24.944
  260    HG1  THR 586           HG1      THR 586  38.677  39.114  22.882
  261   HG21  THR 586          HG21      THR 586  37.031  35.963  24.734
  262   HG22  THR 586          HG22      THR 586  38.217  35.886  23.380
  263   HG23  THR 586          HG23      THR 586  38.738  36.382  25.012
  264    H    ALA 587           H        ALA 587  36.028  39.560  25.166
  265    HA   ALA 587           HA       ALA 587  35.955  42.182  23.847
  266    HB1  ALA 587           HB1      ALA 587  33.741  42.391  25.422
  267    HB2  ALA 587           HB2      ALA 587  33.689  41.936  23.699
  268    HB3  ALA 587           HB3      ALA 587  33.614  40.689  24.949
  269    H    VAL 588           H        VAL 588  36.566  43.865  25.142
  270    HA   VAL 588           HA       VAL 588  37.859  43.063  27.663
  271    HB   VAL 588           HB       VAL 588  38.233  45.767  26.374
  272   HG11  VAL 588          HG11      VAL 588  40.177  43.999  27.945
  273   HG12  VAL 588          HG12      VAL 588  40.388  45.665  27.444
  274   HG13  VAL 588          HG13      VAL 588  39.129  45.239  28.654
  275   HG21  VAL 588          HG21      VAL 588  39.393  43.085  25.573
  276   HG22  VAL 588          HG22      VAL 588  38.773  44.381  24.504
  277   HG23  VAL 588          HG23      VAL 588  40.330  44.576  25.307
  278    H    VAL 589           H        VAL 589  37.022  43.509  29.551
  279    HA   VAL 589           HA       VAL 589  35.046  45.670  29.834
  280    HB   VAL 589           HB       VAL 589  33.553  44.151  31.142
  281   HG11  VAL 589          HG11      VAL 589  33.438  44.774  28.693
  282   HG12  VAL 589          HG12      VAL 589  34.011  43.118  28.366
  283   HG13  VAL 589          HG13      VAL 589  32.466  43.380  29.224
  284   HG21  VAL 589          HG21      VAL 589  35.361  41.913  30.032
  285   HG22  VAL 589          HG22      VAL 589  35.082  42.279  31.726
  286   HG23  VAL 589          HG23      VAL 589  33.747  41.677  30.694
  287    H    LYS 590           H        LYS 590  35.095  46.699  31.859
  288    HA   LYS 590           HA       LYS 590  37.403  46.109  33.645
  289    HB2  LYS 590           HB2      LYS 590  37.570  48.301  32.783
  290    HB3  LYS 590           HB3      LYS 590  35.880  48.659  33.003
  291    HG2  LYS 590           HG2      LYS 590  36.053  48.844  35.352
  292    HG3  LYS 590           HG3      LYS 590  37.680  48.124  35.400
  293    HD2  LYS 590           HD2      LYS 590  38.579  50.033  34.177
  294    HD3  LYS 590           HD3      LYS 590  36.930  50.760  34.097
  295    HE2  LYS 590           HE2      LYS 590  37.128  50.427  36.752
  296    HE3  LYS 590           HE3      LYS 590  38.859  50.378  36.353
  297    HZ1  LYS 590           HZ1      LYS 590  36.938  52.535  35.800
  298    HZ2  LYS 590           HZ2      LYS 590  38.160  52.635  36.844
  299    HZ3  LYS 590           HZ3      LYS 590  38.522  52.560  35.274
  300    H    PHE 591           H        PHE 591  36.823  44.817  35.394
  301    HA   PHE 591           HA       PHE 591  34.190  44.495  36.449
  302    HB2  PHE 591           HB2      PHE 591  36.985  43.983  37.421
  303    HB3  PHE 591           HB3      PHE 591  35.642  43.446  38.416
  304    HD1  PHE 591           HD2      PHE 591  33.757  42.100  37.519
  305    HD2  PHE 591           HD1      PHE 591  37.557  42.445  35.543
  306    HE1  PHE 591           HE2      PHE 591  33.226  40.074  36.078
  307    HE2  PHE 591           HE1      PHE 591  36.816  40.700  33.872
  308    HZ   PHE 591           HZ       PHE 591  34.648  39.554  34.183
  309    H    ILE 592           H        ILE 592  33.033  45.829  38.045
  310    HA   ILE 592           HA       ILE 592  34.364  48.434  38.192
  311    HB   ILE 592           HB       ILE 592  31.611  47.976  39.265
  312   HG12  ILE 592          HG12      ILE 592  32.421  48.046  36.298
  313   HG13  ILE 592          HG13      ILE 592  31.461  46.827  37.146
  314   HG21  ILE 592          HG21      ILE 592  32.775  50.263  37.665
  315   HG22  ILE 592          HG22      ILE 592  31.300  50.221  38.665
  316   HG23  ILE 592          HG23      ILE 592  32.891  50.129  39.443
  317   HD11  ILE 592          HD11      ILE 592  30.203  48.240  35.596
  318   HD12  ILE 592          HD12      ILE 592  29.592  48.221  37.291
  319   HD13  ILE 592          HD13      ILE 592  30.462  49.640  36.604
  320    H    ASP 593           H        ASP 593  33.316  45.866  40.437
  321    HA   ASP 593           HA       ASP 593  33.996  47.442  42.792
  322    HB2  ASP 593           HB2      ASP 593  32.078  45.778  42.495
  323    HB3  ASP 593           HB3      ASP 593  33.268  44.500  42.488
  324    H    TYR 594           H        TYR 594  36.006  46.619  40.675
  325    HA   TYR 594           HA       TYR 594  38.215  45.614  42.431
  326    HB2  TYR 594           HB2      TYR 594  37.575  44.616  39.610
  327    HB3  TYR 594           HB3      TYR 594  38.986  44.184  40.563
  328    HD1  TYR 594           HD1      TYR 594  35.248  43.890  40.476
  329    HD2  TYR 594           HD2      TYR 594  38.988  42.355  41.973
  330    HE1  TYR 594           HE1      TYR 594  34.031  42.024  41.515
  331    HE2  TYR 594           HE2      TYR 594  37.732  40.490  43.114
  332    HH   TYR 594           HH       TYR 594  34.334  40.245  43.227
  333    H    GLY 595           H        GLY 595  37.283  47.013  39.318
  334    HA2  GLY 595           HA2      GLY 595  37.765  48.988  38.497
  335    HA3  GLY 595           HA3      GLY 595  38.962  49.316  39.767
  336    H    ASN 596           H        ASN 596  39.010  46.625  37.343
  337    HA   ASN 596           HA       ASN 596  40.636  48.153  35.531
  338    HB2  ASN 596           HB2      ASN 596  42.546  46.420  35.550
  339    HB3  ASN 596           HB3      ASN 596  42.456  47.472  36.967
  340   HD21  ASN 596          HD22      ASN 596  43.289  46.277  38.523
  341   HD22  ASN 596          HD21      ASN 596  42.678  44.721  39.048
  342    H    TYR 597           H        TYR 597  41.412  46.535  33.603
  343    HA   TYR 597           HA       TYR 597  38.984  44.954  33.040
  344    HB2  TYR 597           HB2      TYR 597  39.242  45.717  30.621
  345    HB3  TYR 597           HB3      TYR 597  38.396  46.671  31.745
  346    HD1  TYR 597           HD2      TYR 597  39.979  48.522  33.100
  347    HD2  TYR 597           HD1      TYR 597  40.790  46.868  29.182
  348    HE1  TYR 597           HE2      TYR 597  41.317  50.450  32.585
  349    HE2  TYR 597           HE1      TYR 597  42.000  48.964  28.584
  350    HH   TYR 597           HH       TYR 597  42.638  51.042  29.374
  351    H    GLU 598           H        GLU 598  39.057  43.492  31.250
  352    HA   GLU 598           HA       GLU 598  41.433  42.097  30.389
  353    HB2  GLU 598           HB2      GLU 598  40.760  40.001  31.640
  354    HB3  GLU 598           HB3      GLU 598  41.569  41.200  32.617
  355    HG2  GLU 598           HG2      GLU 598  39.383  42.014  33.511
  356    HG3  GLU 598           HG3      GLU 598  38.534  40.826  32.525
  357    H    GLU 599           H        GLU 599  40.596  39.882  29.414
  358    HA   GLU 599           HA       GLU 599  38.154  40.613  27.909
  359    HB2  GLU 599           HB2      GLU 599  38.886  39.617  26.039
  360    HB3  GLU 599           HB3      GLU 599  40.183  40.612  26.612
  361    HG2  GLU 599           HG2      GLU 599  40.202  37.595  27.141
  362    HG3  GLU 599           HG3      GLU 599  40.727  38.195  25.617
  363    H    VAL 600           H        VAL 600  36.578  39.408  27.606
  364    HA   VAL 600           HA       VAL 600  36.363  36.558  28.428
  365    HB   VAL 600           HB       VAL 600  34.649  38.858  29.432
  366   HG11  VAL 600          HG11      VAL 600  33.889  35.917  29.460
  367   HG12  VAL 600          HG12      VAL 600  33.090  37.187  30.378
  368   HG13  VAL 600          HG13      VAL 600  32.997  37.233  28.613
  369   HG21  VAL 600          HG21      VAL 600  36.535  37.990  30.857
  370   HG22  VAL 600          HG22      VAL 600  34.943  37.585  31.530
  371   HG23  VAL 600          HG23      VAL 600  35.879  36.353  30.640
  372    H    LEU 601           H        LEU 601  34.694  35.359  27.288
  373    HA   LEU 601           HA       LEU 601  34.338  35.964  24.570
  374    HB2  LEU 601           HB2      LEU 601  33.623  33.819  26.197
  375    HB3  LEU 601           HB3      LEU 601  32.054  34.480  25.747
  376    HG   LEU 601           HG       LEU 601  32.568  32.689  24.399
  377   HD11  LEU 601          HD11      LEU 601  31.286  34.214  23.221
  378   HD12  LEU 601          HD12      LEU 601  32.683  35.114  22.592
  379   HD13  LEU 601          HD13      LEU 601  32.448  33.422  22.146
  380   HD21  LEU 601          HD21      LEU 601  35.205  34.013  23.612
  381   HD22  LEU 601          HD22      LEU 601  34.961  32.630  24.671
  382   HD23  LEU 601          HD23      LEU 601  34.516  32.499  22.957
  383    H    LEU 602           H        LEU 602  32.790  36.988  23.381
  384    HA   LEU 602           HA       LEU 602  31.310  39.118  24.493
  385    HB2  LEU 602           HB2      LEU 602  31.112  37.417  21.996
  386    HB3  LEU 602           HB3      LEU 602  30.039  38.802  22.212
  387    HG   LEU 602           HG       LEU 602  33.040  39.129  22.465
  388   HD11  LEU 602          HD11      LEU 602  31.411  38.989  19.852
  389   HD12  LEU 602          HD12      LEU 602  33.113  39.489  19.945
  390   HD13  LEU 602          HD13      LEU 602  32.622  37.837  20.381
  391   HD21  LEU 602          HD21      LEU 602  31.562  41.015  23.003
  392   HD22  LEU 602          HD22      LEU 602  32.569  41.360  21.563
  393   HD23  LEU 602          HD23      LEU 602  30.859  40.931  21.356
  394    H    SER 603           H        SER 603  30.324  35.732  24.031
  395    HA   SER 603           HA       SER 603  27.503  36.237  24.704
  396    HB2  SER 603           HB2      SER 603  29.132  33.693  24.708
  397    HB3  SER 603           HB3      SER 603  27.353  33.805  24.674
  398    HG   SER 603           HG       SER 603  27.893  33.541  22.623
  399    H    ASN 604           H        ASN 604  30.251  36.198  26.491
  400    HA   ASN 604           HA       ASN 604  29.102  34.974  28.955
  401    HB2  ASN 604           HB2      ASN 604  31.986  35.216  27.972
  402    HB3  ASN 604           HB3      ASN 604  31.575  34.692  29.568
  403   HD21  ASN 604          HD22      ASN 604  32.858  32.843  28.684
  404   HD22  ASN 604          HD21      ASN 604  31.968  31.569  27.852
  405    H    ILE 605           H        ILE 605  29.329  37.769  27.542
  406    HA   ILE 605           HA       ILE 605  29.201  39.193  30.185
  407    HB   ILE 605           HB       ILE 605  29.365  40.428  27.443
  408   HG12  ILE 605          HG12      ILE 605  31.847  40.470  29.221
  409   HG13  ILE 605          HG13      ILE 605  31.576  39.011  28.261
  410   HG21  ILE 605          HG21      ILE 605  29.720  41.438  30.266
  411   HG22  ILE 605          HG22      ILE 605  30.225  42.389  28.826
  412   HG23  ILE 605          HG23      ILE 605  28.529  41.981  29.053
  413   HD11  ILE 605          HD11      ILE 605  31.826  41.800  27.195
  414   HD12  ILE 605          HD12      ILE 605  32.999  40.457  27.122
  415   HD13  ILE 605          HD13      ILE 605  31.456  40.316  26.243
  416    H    LYS 606           H        LYS 606  27.205  39.319  30.881
  417    HA   LYS 606           HA       LYS 606  24.791  39.116  29.210
  418    HB2  LYS 606           HB2      LYS 606  25.046  37.571  31.017
  419    HB3  LYS 606           HB3      LYS 606  25.568  38.806  32.137
  420    HG2  LYS 606           HG2      LYS 606  23.169  39.690  32.198
  421    HG3  LYS 606           HG3      LYS 606  22.727  38.395  31.080
  422    HD2  LYS 606           HD2      LYS 606  23.858  36.831  32.878
  423    HD3  LYS 606           HD3      LYS 606  23.579  38.156  33.986
  424    HE2  LYS 606           HE2      LYS 606  21.439  36.620  32.423
  425    HE3  LYS 606           HE3      LYS 606  21.873  36.444  34.109
  426    HZ1  LYS 606           HZ1      LYS 606  19.932  37.798  33.910
  427    HZ2  LYS 606           HZ2      LYS 606  21.147  38.635  34.564
  428    HZ3  LYS 606           HZ3      LYS 606  20.693  38.918  33.019
  429    HA   PRO 607           HA       PRO 607  24.474  43.521  29.963
  430    HB2  PRO 607           HB2      PRO 607  21.775  44.066  29.671
  431    HB3  PRO 607           HB3      PRO 607  22.816  43.598  28.296
  432    HG2  PRO 607           HG2      PRO 607  21.030  41.802  29.994
  433    HG3  PRO 607           HG3      PRO 607  21.100  41.903  28.206
  434    HD2  PRO 607           HD2      PRO 607  22.461  39.989  29.575
  435    HD3  PRO 607           HD3      PRO 607  23.179  40.791  28.138
  436    H    ILE 608           H        ILE 608  23.673  45.201  31.315
  437    HA   ILE 608           HA       ILE 608  22.710  44.263  33.971
  438    HB   ILE 608           HB       ILE 608  24.440  46.511  33.036
  439   HG12  ILE 608          HG12      ILE 608  24.244  44.867  35.627
  440   HG13  ILE 608          HG13      ILE 608  25.214  44.401  34.245
  441   HG21  ILE 608          HG21      ILE 608  22.440  46.839  35.259
  442   HG22  ILE 608          HG22      ILE 608  23.925  47.816  35.187
  443   HG23  ILE 608          HG23      ILE 608  22.803  47.913  33.855
  444   HD11  ILE 608          HD11      ILE 608  25.602  46.877  35.992
  445   HD12  ILE 608          HD12      ILE 608  26.650  45.486  35.938
  446   HD13  ILE 608          HD13      ILE 608  26.507  46.530  34.486
  447    H    LEU 609           H        LEU 609  22.059  46.761  31.485
  448    HA   LEU 609           HA       LEU 609  19.151  46.347  31.816
  449    HB2  LEU 609           HB2      LEU 609  19.648  48.204  33.206
  450    HB3  LEU 609           HB3      LEU 609  20.701  48.916  31.951
  451    HG   LEU 609           HG       LEU 609  18.766  49.451  30.544
  452   HD11  LEU 609          HD11      LEU 609  17.119  48.394  32.869
  453   HD12  LEU 609          HD12      LEU 609  16.452  49.345  31.549
  454   HD13  LEU 609          HD13      LEU 609  17.130  47.768  31.164
  455   HD21  LEU 609          HD21      LEU 609  19.596  51.058  32.259
  456   HD22  LEU 609          HD22      LEU 609  17.842  51.216  32.091
  457   HD23  LEU 609          HD23      LEU 609  18.504  50.321  33.461
  458    H    GLU 610           H        GLU 610  18.662  45.703  29.931
  459    HA   GLU 610           HA       GLU 610  20.278  45.435  27.703
  460    HB2  GLU 610           HB2      GLU 610  17.266  45.382  27.662
  461    HB3  GLU 610           HB3      GLU 610  18.402  44.498  26.635
  462    HG2  GLU 610           HG2      GLU 610  17.859  42.830  28.008
  463    HG3  GLU 610           HG3      GLU 610  19.182  43.422  28.982
  464    H1   TYR 611           H1       TYR 611  48.170  29.878  28.629
  465    H2   TYR 611           H2       TYR 611  49.575  30.723  28.628
  466    H3   TYR 611           H3       TYR 611  48.306  31.239  27.742
  467    HA   TYR 611           HA       TYR 611  48.494  31.052  30.690
  468    HB2  TYR 611           HB2      TYR 611  49.587  33.082  30.139
  469    HB3  TYR 611           HB3      TYR 611  48.367  33.509  28.906
  470    HD1  TYR 611           HD1      TYR 611  49.293  33.168  32.419
  471    HD2  TYR 611           HD2      TYR 611  46.173  34.534  29.769
  472    HE1  TYR 611           HE1      TYR 611  48.238  34.342  34.303
  473    HE2  TYR 611           HE2      TYR 611  45.065  35.669  31.713
  474    HH   TYR 611           HH       TYR 611  46.352  35.694  34.919
  475    H    SER 612           H        SER 612  46.457  30.983  31.805
  476    HA   SER 612           HA       SER 612  44.160  32.318  30.478
  477    HB2  SER 612           HB2      SER 612  44.017  29.939  29.905
  478    HB3  SER 612           HB3      SER 612  44.003  29.539  31.634
  479    HG   SER 612           HG       SER 612  41.878  29.812  30.889
  480    HA   PRO 613           HA       PRO 613  43.381  33.742  34.843
  481    HB2  PRO 613           HB2      PRO 613  40.590  33.250  33.742
  482    HB3  PRO 613           HB3      PRO 613  41.088  34.560  34.857
  483    HG2  PRO 613           HG2      PRO 613  40.864  35.099  32.269
  484    HG3  PRO 613           HG3      PRO 613  42.376  35.600  33.113
  485    HD2  PRO 613           HD2      PRO 613  41.861  33.150  31.374
  486    HD3  PRO 613           HD3      PRO 613  43.263  34.231  31.291
  487    H    SER 614           H        SER 614  43.484  32.372  36.582
  488    HA   SER 614           HA       SER 614  41.877  29.914  36.839
  489    HB2  SER 614           HB2      SER 614  44.784  29.934  36.071
  490    HB3  SER 614           HB3      SER 614  44.112  28.538  36.928
  491    HG   SER 614           HG       SER 614  43.160  29.567  34.484
  492    H    SER 615           H        SER 615  43.560  32.339  38.358
  493    HA   SER 615           HA       SER 615  43.787  30.953  41.017
  494    HB2  SER 615           HB2      SER 615  45.860  32.667  39.628
  495    HB3  SER 615           HB3      SER 615  45.775  32.510  41.397
  496    HG   SER 615           HG       SER 615  47.132  31.056  40.250
  497    HA   PRO 616           HA       PRO 616  41.390  34.326  42.546
  498    HB2  PRO 616           HB2      PRO 616  43.163  34.665  44.937
  499    HB3  PRO 616           HB3      PRO 616  41.414  34.241  44.821
  500    HG2  PRO 616           HG2      PRO 616  43.318  32.446  45.488
  501    HG3  PRO 616           HG3      PRO 616  41.804  32.061  44.598
  502    HD2  PRO 616           HD2      PRO 616  44.609  32.434  43.565
  503    HD3  PRO 616           HD3      PRO 616  43.396  31.216  43.083
  504   HC11  DA2 617          HC11      DA2 617  37.318  40.602  38.446
  505   HC12  DA2 617          HC12      DA2 617  37.576  39.060  37.586
  506   HC13  DA2 617          HC13      DA2 617  35.976  39.839  37.602
  507   HC21  DA2 617          HC21      DA2 617  35.000  37.653  40.072
  508   HC22  DA2 617          HC22      DA2 617  34.630  38.534  38.602
  509   HC23  DA2 617          HC23      DA2 617  34.612  39.400  40.157
  510    H2   DA2 617           H        DA2 617  41.311  36.736  42.847
  511    HA   DA2 617           HA       DA2 617  43.682  38.105  41.731
  512   HCB1  DA2 617          HCB1      DA2 617  42.536  40.144  41.887
  513   HCB2  DA2 617          HCB2      DA2 617  41.247  39.465  42.888
  514   HCG1  DA2 617          HCG1      DA2 617  40.992  40.012  40.332
  515   HCG2  DA2 617          HCG2      DA2 617  41.642  38.377  40.105
  516   HCD1  DA2 617          HCD1      DA2 617  39.845  37.399  41.318
  517   HCD2  DA2 617          HCD2      DA2 617  39.419  38.909  42.127
  518    HNE  DA2 617           HNE      DA2 617  39.078  39.327  39.346
  519   HNH2  DA2 617          HNH2      DA2 617  37.843  37.558  42.056
  520   HNH1  DA2 617          HNH1      DA2 617  36.155  37.863  41.748
  521    H    TYR 618           H        TYR 618  42.127  37.680  44.880
  522    HA   TYR 618           HA       TYR 618  43.715  39.539  46.426
  523    HB2  TYR 618           HB2      TYR 618  42.707  38.445  48.319
  524    HB3  TYR 618           HB3      TYR 618  41.503  38.864  47.141
  525    HD1  TYR 618           HD2      TYR 618  43.275  35.831  48.568
  526    HD2  TYR 618           HD1      TYR 618  40.051  37.379  46.140
  527    HE1  TYR 618           HE2      TYR 618  42.248  33.578  48.457
  528    HE2  TYR 618           HE1      TYR 618  38.870  35.256  46.350
  529    HH   TYR 618           HH       TYR 618  39.033  33.114  47.047
  530    H    THR 619           H        THR 619  45.185  38.886  48.037
  531    HA   THR 619           HA       THR 619  46.020  36.546  48.997
  532    HB   THR 619           HB       THR 619  46.813  35.574  46.961
  533    HG1  THR 619           HG1      THR 619  48.553  35.011  47.875
  534   HG21  THR 619          HG21      THR 619  47.689  38.114  46.054
  535   HG22  THR 619          HG22      THR 619  49.157  37.112  46.332
  536   HG23  THR 619          HG23      THR 619  47.883  36.543  45.275
  537    HA   PRO 620           HA       PRO 620  48.307  39.664  51.311
  538    HB2  PRO 620           HB2      PRO 620  49.530  38.150  53.223
  539    HB3  PRO 620           HB3      PRO 620  47.817  38.656  53.246
  540    HG2  PRO 620           HG2      PRO 620  48.992  36.021  52.494
  541    HG3  PRO 620           HG3      PRO 620  47.492  36.350  53.395
  542    HD2  PRO 620           HD2      PRO 620  47.278  35.767  50.710
  543    HD3  PRO 620           HD3      PRO 620  46.239  36.915  51.567
  544    H    GLN 621           H        GLN 621  49.746  37.238  49.330
  545    HA   GLN 621           HA       GLN 621  52.445  38.460  49.624
  546    HB2  GLN 621           HB2      GLN 621  53.217  36.471  48.373
  547    HB3  GLN 621           HB3      GLN 621  52.656  36.211  50.031
  548    HG2  GLN 621           HG2      GLN 621  50.686  35.047  49.228
  549    HG3  GLN 621           HG3      GLN 621  51.014  35.635  47.579
  550   HE21  GLN 621          HE22      GLN 621  51.673  33.790  46.431
  551   HE22  GLN 621          HE21      GLN 621  52.999  32.741  46.942
  552    H    SER 622           H        SER 622  49.808  38.883  47.697
  553    HA   SER 622           HA       SER 622  49.354  40.007  45.860
  554    HB2  SER 622           HB2      SER 622  52.237  40.917  46.026
  555    HB3  SER 622           HB3      SER 622  51.081  41.651  44.926
  556    HG   SER 622           HG       SER 622  51.006  42.746  46.839
  557    HA   PRO 623           HA       PRO 623  49.810  37.663  42.106
  558    HB2  PRO 623           HB2      PRO 623  50.317  40.056  40.459
  559    HB3  PRO 623           HB3      PRO 623  49.092  38.780  40.326
  560    HG2  PRO 623           HG2      PRO 623  48.364  41.252  41.362
  561    HG3  PRO 623           HG3      PRO 623  47.703  39.769  42.040
  562    HD2  PRO 623           HD2      PRO 623  49.971  41.411  43.138
  563    HD3  PRO 623           HD3      PRO 623  48.627  40.657  43.975
  Start of MODEL   15
    1    H1   MET 553           H1       MET 553  25.326  48.608  12.557
    2    H2   MET 553           H2       MET 553  26.328  49.803  13.105
    3    H3   MET 553           H3       MET 553  24.743  50.078  13.013
    4    HA   MET 553           HA       MET 553  25.492  49.660  15.290
    5    HB2  MET 553           HB2      MET 553  23.198  49.639  14.569
    6    HB3  MET 553           HB3      MET 553  23.373  47.935  14.083
    7    HG2  MET 553           HG2      MET 553  22.082  48.289  16.123
    8    HG3  MET 553           HG3      MET 553  23.454  47.181  16.282
    9    HE1  MET 553           HE1      MET 553  23.845  51.372  18.117
   10    HE2  MET 553           HE2      MET 553  23.601  51.021  16.377
   11    HE3  MET 553           HE3      MET 553  22.227  50.976  17.520
   12    H    LYS 554           H        LYS 554  25.916  47.911  16.815
   13    HA   LYS 554           HA       LYS 554  26.909  45.303  15.796
   14    HB2  LYS 554           HB2      LYS 554  28.590  47.093  17.654
   15    HB3  LYS 554           HB3      LYS 554  28.895  45.422  17.250
   16    HG2  LYS 554           HG2      LYS 554  29.143  47.815  15.400
   17    HG3  LYS 554           HG3      LYS 554  30.448  46.903  16.181
   18    HD2  LYS 554           HD2      LYS 554  29.981  44.965  14.778
   19    HD3  LYS 554           HD3      LYS 554  28.510  45.790  14.163
   20    HE2  LYS 554           HE2      LYS 554  30.005  47.646  13.341
   21    HE3  LYS 554           HE3      LYS 554  31.406  46.576  13.601
   22    HZ1  LYS 554           HZ1      LYS 554  30.522  45.073  12.049
   23    HZ2  LYS 554           HZ2      LYS 554  29.065  45.792  12.056
   24    HZ3  LYS 554           HZ3      LYS 554  30.318  46.575  11.371
   25    H    MET 555           H        MET 555  27.166  43.688  17.313
   26    HA   MET 555           HA       MET 555  25.105  43.548  19.345
   27    HB2  MET 555           HB2      MET 555  27.311  41.729  18.373
   28    HB3  MET 555           HB3      MET 555  26.863  41.546  20.050
   29    HG2  MET 555           HG2      MET 555  24.737  41.341  17.946
   30    HG3  MET 555           HG3      MET 555  25.771  40.025  18.507
   31    HE1  MET 555           HE1      MET 555  22.754  38.828  20.391
   32    HE2  MET 555           HE2      MET 555  23.020  39.319  18.706
   33    HE3  MET 555           HE3      MET 555  24.284  38.419  19.557
   34    H    TRP 556           H        TRP 556  28.689  43.216  19.752
   35    HA   TRP 556           HA       TRP 556  28.400  44.956  22.139
   36    HB2  TRP 556           HB2      TRP 556  29.924  42.419  21.625
   37    HB3  TRP 556           HB3      TRP 556  30.635  43.612  22.689
   38    HD1  TRP 556           HD1      TRP 556  29.253  40.543  23.080
   39    HE1  TRP 556           HE1      TRP 556  28.040  40.159  25.191
   40    HE3  TRP 556           HE3      TRP 556  28.160  45.428  24.191
   41    HZ2  TRP 556           HZ2      TRP 556  26.562  41.827  27.240
   42    HZ3  TRP 556           HZ3      TRP 556  26.578  45.941  26.010
   43    HH2  TRP 556           HH2      TRP 556  25.804  44.188  27.539
   44    H    LYS 557           H        LYS 557  30.083  46.284  22.629
   45    HA   LYS 557           HA       LYS 557  32.293  46.858  20.869
   46    HB2  LYS 557           HB2      LYS 557  31.565  48.569  19.619
   47    HB3  LYS 557           HB3      LYS 557  29.985  47.912  19.900
   48    HG2  LYS 557           HG2      LYS 557  31.160  50.265  21.492
   49    HG3  LYS 557           HG3      LYS 557  30.149  50.381  20.089
   50    HD2  LYS 557           HD2      LYS 557  28.228  49.700  21.246
   51    HD3  LYS 557           HD3      LYS 557  29.113  48.665  22.348
   52    HE2  LYS 557           HE2      LYS 557  29.887  50.590  23.640
   53    HE3  LYS 557           HE3      LYS 557  29.295  51.707  22.430
   54    HZ1  LYS 557           HZ1      LYS 557  27.022  50.706  22.892
   55    HZ2  LYS 557           HZ2      LYS 557  27.696  49.913  24.144
   56    HZ3  LYS 557           HZ3      LYS 557  27.618  51.533  24.141
   57    HA   PRO 558           HA       PRO 558  34.260  48.360  24.274
   58    HB2  PRO 558           HB2      PRO 558  35.790  50.478  23.547
   59    HB3  PRO 558           HB3      PRO 558  36.009  48.783  22.998
   60    HG2  PRO 558           HG2      PRO 558  34.542  50.937  21.445
   61    HG3  PRO 558           HG3      PRO 558  35.888  49.848  20.908
   62    HD2  PRO 558           HD2      PRO 558  33.333  49.294  20.427
   63    HD3  PRO 558           HD3      PRO 558  34.455  47.980  20.910
   64    H    GLY 559           H        GLY 559  34.423  50.023  26.011
   65    HA2  GLY 559           HA2      GLY 559  33.651  51.709  27.393
   66    HA3  GLY 559           HA3      GLY 559  33.039  52.548  25.997
   67    H    ASP 560           H        ASP 560  32.139  49.408  27.620
   68    HA   ASP 560           HA       ASP 560  29.430  50.511  27.963
   69    HB2  ASP 560           HB2      ASP 560  30.006  48.845  25.835
   70    HB3  ASP 560           HB3      ASP 560  29.617  47.647  27.039
   71    H    GLU 561           H        GLU 561  29.147  50.583  30.073
   72    HA   GLU 561           HA       GLU 561  29.850  48.505  31.857
   73    HB2  GLU 561           HB2      GLU 561  27.960  49.543  33.295
   74    HB3  GLU 561           HB3      GLU 561  29.375  50.518  32.924
   75    HG2  GLU 561           HG2      GLU 561  26.674  50.920  31.531
   76    HG3  GLU 561           HG3      GLU 561  27.136  51.596  33.055
   77    H    CYS 562           H        CYS 562  29.349  46.496  31.969
   78    HA   CYS 562           HA       CYS 562  26.611  45.545  31.525
   79    HB2  CYS 562           HB2      CYS 562  29.087  44.164  30.384
   80    HB3  CYS 562           HB3      CYS 562  27.387  43.806  30.051
   81    HG   CYS 562           HG       CYS 562  29.278  46.297  28.902
   82    H    PHE 563           H        PHE 563  27.109  42.927  31.843
   83    HA   PHE 563           HA       PHE 563  28.399  42.465  34.526
   84    HB2  PHE 563           HB2      PHE 563  25.923  41.402  33.139
   85    HB3  PHE 563           HB3      PHE 563  26.753  40.398  34.302
   86    HD1  PHE 563           HD1      PHE 563  26.975  41.259  36.726
   87    HD2  PHE 563           HD2      PHE 563  24.443  43.107  33.774
   88    HE1  PHE 563           HE1      PHE 563  25.691  42.452  38.539
   89    HE2  PHE 563           HE2      PHE 563  23.280  44.365  35.536
   90    HZ   PHE 563           HZ       PHE 563  23.916  44.057  37.924
   91    H    ALA 564           H        ALA 564  30.229  41.129  34.304
   92    HA   ALA 564           HA       ALA 564  30.384  39.486  31.832
   93    HB1  ALA 564           HB1      ALA 564  32.550  40.481  33.636
   94    HB2  ALA 564           HB2      ALA 564  32.784  39.563  32.127
   95    HB3  ALA 564           HB3      ALA 564  32.035  41.152  32.016
   96    H    LEU 565           H        LEU 565  30.278  37.412  32.021
   97    HA   LEU 565           HA       LEU 565  29.948  35.858  34.438
   98    HB2  LEU 565           HB2      LEU 565  29.051  35.368  32.200
   99    HB3  LEU 565           HB3      LEU 565  30.724  35.078  31.646
  100    HG   LEU 565           HG       LEU 565  30.813  32.977  32.899
  101   HD11  LEU 565          HD11      LEU 565  29.841  33.485  34.972
  102   HD12  LEU 565          HD12      LEU 565  28.299  34.013  34.245
  103   HD13  LEU 565          HD13      LEU 565  28.736  32.301  34.229
  104   HD21  LEU 565          HD21      LEU 565  29.499  33.021  30.740
  105   HD22  LEU 565          HD22      LEU 565  28.997  31.774  31.857
  106   HD23  LEU 565          HD23      LEU 565  28.033  33.282  31.706
  107    H    TYR 566           H        TYR 566  31.577  35.627  35.877
  108    HA   TYR 566           HA       TYR 566  34.325  35.548  35.040
  109    HB2  TYR 566           HB2      TYR 566  33.382  36.495  37.240
  110    HB3  TYR 566           HB3      TYR 566  33.261  34.814  37.808
  111    HD1  TYR 566           HD1      TYR 566  35.808  37.081  36.165
  112    HD2  TYR 566           HD2      TYR 566  34.908  34.160  39.228
  113    HE1  TYR 566           HE1      TYR 566  38.095  37.313  37.064
  114    HE2  TYR 566           HE2      TYR 566  37.275  34.272  40.001
  115    HH   TYR 566           HH       TYR 566  39.666  36.232  38.391
  116    H    TRP 567           H        TRP 567  35.535  33.614  36.541
  117    HA   TRP 567           HA       TRP 567  34.762  31.154  34.977
  118    HB2  TRP 567           HB2      TRP 567  37.105  30.814  34.525
  119    HB3  TRP 567           HB3      TRP 567  36.683  32.430  34.024
  120    HD1  TRP 567           HD1      TRP 567  37.917  34.434  35.200
  121    HE1  TRP 567           HE1      TRP 567  39.804  34.659  36.884
  122    HE3  TRP 567           HE3      TRP 567  38.321  29.548  36.661
  123    HZ2  TRP 567           HZ2      TRP 567  41.067  33.001  38.964
  124    HZ3  TRP 567           HZ3      TRP 567  39.974  28.886  38.355
  125    HH2  TRP 567           HH2      TRP 567  41.272  30.598  39.596
  126    H    GLU 568           H        GLU 568  35.958  32.251  38.072
  127    HA   GLU 568           HA       GLU 568  36.686  29.650  39.134
  128    HB2  GLU 568           HB2      GLU 568  37.719  31.395  40.061
  129    HB3  GLU 568           HB3      GLU 568  36.296  32.456  40.065
  130    HG2  GLU 568           HG2      GLU 568  35.470  31.799  42.021
  131    HG3  GLU 568           HG3      GLU 568  36.299  30.228  42.063
  132    H    ASP 569           H        ASP 569  33.636  31.528  39.403
  133    HA   ASP 569           HA       ASP 569  32.399  28.971  40.240
  134    HB2  ASP 569           HB2      ASP 569  30.848  30.261  41.690
  135    HB3  ASP 569           HB3      ASP 569  32.520  30.320  42.240
  136    H    ASN 570           H        ASN 570  32.635  31.003  37.784
  137    HA   ASN 570           HA       ASN 570  31.367  31.666  36.056
  138    HB2  ASN 570           HB2      ASN 570  31.287  29.019  36.179
  139    HB3  ASN 570           HB3      ASN 570  29.600  29.263  36.598
  140   HD21  ASN 570          HD22      ASN 570  31.983  30.283  34.001
  141   HD22  ASN 570          HD21      ASN 570  30.702  30.334  32.793
  142    H    LYS 571           H        LYS 571  30.723  33.034  38.355
  143    HA   LYS 571           HA       LYS 571  27.847  33.687  37.930
  144    HB2  LYS 571           HB2      LYS 571  29.538  33.565  40.252
  145    HB3  LYS 571           HB3      LYS 571  29.215  35.263  40.004
  146    HG2  LYS 571           HG2      LYS 571  27.030  33.154  39.953
  147    HG3  LYS 571           HG3      LYS 571  27.563  33.913  41.456
  148    HD2  LYS 571           HD2      LYS 571  27.082  36.175  40.388
  149    HD3  LYS 571           HD3      LYS 571  26.283  35.339  39.064
  150    HE2  LYS 571           HE2      LYS 571  25.424  35.037  41.970
  151    HE3  LYS 571           HE3      LYS 571  24.780  36.208  40.848
  152    HZ1  LYS 571           HZ1      LYS 571  24.003  34.373  39.446
  153    HZ2  LYS 571           HZ2      LYS 571  24.730  33.260  40.402
  154    HZ3  LYS 571           HZ3      LYS 571  23.489  34.139  40.959
  155    H    PHE 572           H        PHE 572  27.216  35.577  37.179
  156    HA   PHE 572           HA       PHE 572  29.080  37.397  35.950
  157    HB2  PHE 572           HB2      PHE 572  26.180  37.863  36.725
  158    HB3  PHE 572           HB3      PHE 572  27.129  38.748  35.531
  159    HD1  PHE 572           HD1      PHE 572  25.436  35.581  36.365
  160    HD2  PHE 572           HD2      PHE 572  27.502  37.758  33.273
  161    HE1  PHE 572           HE1      PHE 572  24.539  34.007  34.651
  162    HE2  PHE 572           HE2      PHE 572  26.647  36.157  31.585
  163    HZ   PHE 572           HZ       PHE 572  25.102  34.316  32.277
  164    H    TYR 573           H        TYR 573  29.873  39.195  36.548
  165    HA   TYR 573           HA       TYR 573  29.465  40.625  39.130
  166    HB2  TYR 573           HB2      TYR 573  32.051  39.842  37.754
  167    HB3  TYR 573           HB3      TYR 573  31.919  40.873  39.164
  168    HD1  TYR 573           HD2      TYR 573  31.593  37.384  37.920
  169    HD2  TYR 573           HD1      TYR 573  31.488  39.923  41.366
  170    HE1  TYR 573           HE2      TYR 573  31.760  35.381  39.370
  171    HE2  TYR 573           HE1      TYR 573  31.820  37.905  42.856
  172    HH   TYR 573           HH       TYR 573  32.024  34.641  41.511
  173    H    ARG 574           H        ARG 574  29.523  42.900  38.655
  174    HA   ARG 574           HA       ARG 574  28.939  43.736  35.969
  175    HB2  ARG 574           HB2      ARG 574  29.632  45.177  38.516
  176    HB3  ARG 574           HB3      ARG 574  29.350  46.032  36.974
  177    HG2  ARG 574           HG2      ARG 574  27.036  45.041  36.907
  178    HG3  ARG 574           HG3      ARG 574  27.403  44.174  38.418
  179    HD2  ARG 574           HD2      ARG 574  27.380  47.198  38.184
  180    HD3  ARG 574           HD3      ARG 574  25.988  46.219  38.660
  181    HE   ARG 574           HE       ARG 574  27.823  45.278  40.404
  182   HH11  ARG 574          HH11      ARG 574  26.876  48.583  39.578
  183   HH12  ARG 574          HH12      ARG 574  27.421  49.199  41.110
  184   HH21  ARG 574          HH21      ARG 574  28.422  46.139  42.348
  185   HH22  ARG 574          HH22      ARG 574  28.062  47.828  42.661
  186    H    ALA 575           H        ALA 575  30.199  44.684  34.364
  187    HA   ALA 575           HA       ALA 575  32.961  45.448  34.990
  188    HB1  ALA 575           HB1      ALA 575  32.182  43.646  32.631
  189    HB2  ALA 575           HB2      ALA 575  33.821  44.222  33.000
  190    HB3  ALA 575           HB3      ALA 575  33.014  43.088  34.096
  191    H    GLU 576           H        GLU 576  33.742  47.099  33.856
  192    HA   GLU 576           HA       GLU 576  32.054  48.399  31.772
  193    HB2  GLU 576           HB2      GLU 576  34.383  49.247  33.482
  194    HB3  GLU 576           HB3      GLU 576  34.156  50.012  31.875
  195    HG2  GLU 576           HG2      GLU 576  31.782  50.397  32.467
  196    HG3  GLU 576           HG3      GLU 576  32.125  49.888  34.122
  197    H    VAL 577           H        VAL 577  32.033  47.232  30.055
  198    HA   VAL 577           HA       VAL 577  33.950  45.802  28.636
  199    HB   VAL 577           HB       VAL 577  31.747  47.654  27.763
  200   HG11  VAL 577          HG11      VAL 577  33.823  46.238  26.070
  201   HG12  VAL 577          HG12      VAL 577  32.173  46.508  25.480
  202   HG13  VAL 577          HG13      VAL 577  33.199  47.895  25.954
  203   HG21  VAL 577          HG21      VAL 577  31.175  45.312  28.672
  204   HG22  VAL 577          HG22      VAL 577  30.726  45.616  26.994
  205   HG23  VAL 577          HG23      VAL 577  32.218  44.683  27.374
  206    H    GLU 578           H        GLU 578  35.856  46.202  27.783
  207    HA   GLU 578           HA       GLU 578  36.735  49.013  27.354
  208    HB2  GLU 578           HB2      GLU 578  37.863  47.804  29.159
  209    HB3  GLU 578           HB3      GLU 578  38.269  46.474  28.057
  210    HG2  GLU 578           HG2      GLU 578  40.170  48.005  28.504
  211    HG3  GLU 578           HG3      GLU 578  39.729  47.882  26.802
  212    H    ALA 579           H        ALA 579  36.795  45.775  25.787
  213    HA   ALA 579           HA       ALA 579  37.089  47.045  23.196
  214    HB1  ALA 579           HB1      ALA 579  39.391  47.210  24.056
  215    HB2  ALA 579           HB2      ALA 579  39.432  45.456  24.339
  216    HB3  ALA 579           HB3      ALA 579  39.319  46.079  22.675
  217    H    LEU 580           H        LEU 580  35.517  46.079  22.332
  218    HA   LEU 580           HA       LEU 580  35.567  43.102  22.133
  219    HB2  LEU 580           HB2      LEU 580  32.918  44.422  22.085
  220    HB3  LEU 580           HB3      LEU 580  33.373  42.784  22.526
  221    HG   LEU 580           HG       LEU 580  33.261  45.276  24.102
  222   HD11  LEU 580          HD11      LEU 580  32.006  42.543  24.345
  223   HD12  LEU 580          HD12      LEU 580  32.236  43.431  25.827
  224   HD13  LEU 580          HD13      LEU 580  31.322  44.186  24.534
  225   HD21  LEU 580          HD21      LEU 580  35.152  44.960  25.178
  226   HD22  LEU 580          HD22      LEU 580  34.328  43.734  26.082
  227   HD23  LEU 580          HD23      LEU 580  35.321  43.278  24.653
  228    H    HIS 581           H        HIS 581  35.857  42.481  20.274
  229    HA   HIS 581           HA       HIS 581  34.409  43.688  17.975
  230    HB2  HIS 581           HB2      HIS 581  36.786  44.532  18.186
  231    HB3  HIS 581           HB3      HIS 581  37.332  42.886  17.877
  232    HD2  HIS 581           HD2      HIS 581  35.862  45.961  16.202
  233    HE1  HIS 581           HE1      HIS 581  36.727  43.216  13.063
  234    HE2  HIS 581           HE2      HIS 581  36.241  45.660  13.616
  235    H    SER 582           H        SER 582  33.710  42.410  16.485
  236    HA   SER 582           HA       SER 582  33.124  39.699  16.670
  237    HB2  SER 582           HB2      SER 582  33.412  41.220  14.107
  238    HB3  SER 582           HB3      SER 582  32.235  39.944  14.563
  239    HG   SER 582           HG       SER 582  31.488  41.992  14.641
  240    H    SER 583           H        SER 583  36.110  41.054  15.229
  241    HA   SER 583           HA       SER 583  37.184  38.818  13.965
  242    HB2  SER 583           HB2      SER 583  39.359  39.805  14.317
  243    HB3  SER 583           HB3      SER 583  38.196  41.072  13.906
  244    HG   SER 583           HG       SER 583  38.138  41.776  15.786
  245    H    GLY 584           H        GLY 584  36.486  38.769  17.390
  246    HA2  GLY 584           HA2      GLY 584  37.821  36.127  17.491
  247    HA3  GLY 584           HA3      GLY 584  38.346  37.263  18.687
  248    H    MET 585           H        MET 585  37.309  34.882  19.339
  249    HA   MET 585           HA       MET 585  34.443  34.797  19.707
  250    HB2  MET 585           HB2      MET 585  34.752  32.652  20.738
  251    HB3  MET 585           HB3      MET 585  35.942  32.746  19.495
  252    HG2  MET 585           HG2      MET 585  37.203  33.712  21.877
  253    HG3  MET 585           HG3      MET 585  36.263  32.317  22.346
  254    HE1  MET 585           HE1      MET 585  40.372  31.768  21.369
  255    HE2  MET 585           HE2      MET 585  39.503  33.222  21.931
  256    HE3  MET 585           HE3      MET 585  39.442  31.715  22.867
  257    H    THR 586           H        THR 586  37.110  35.695  21.815
  258    HA   THR 586           HA       THR 586  35.237  36.525  23.957
  259    HB   THR 586           HB       THR 586  37.362  36.926  25.265
  260    HG1  THR 586           HG1      THR 586  39.213  35.917  24.345
  261   HG21  THR 586          HG21      THR 586  36.291  34.933  25.820
  262   HG22  THR 586          HG22      THR 586  36.987  34.012  24.472
  263   HG23  THR 586          HG23      THR 586  38.024  34.643  25.763
  264    H    ALA 587           H        ALA 587  36.006  38.425  25.204
  265    HA   ALA 587           HA       ALA 587  36.492  40.908  23.657
  266    HB1  ALA 587           HB1      ALA 587  33.974  39.706  24.751
  267    HB2  ALA 587           HB2      ALA 587  34.227  41.387  25.122
  268    HB3  ALA 587           HB3      ALA 587  34.244  40.838  23.394
  269    H    VAL 588           H        VAL 588  37.058  42.592  25.003
  270    HA   VAL 588           HA       VAL 588  38.270  41.695  27.586
  271    HB   VAL 588           HB       VAL 588  38.957  44.236  26.097
  272   HG11  VAL 588          HG11      VAL 588  39.687  44.460  28.296
  273   HG12  VAL 588          HG12      VAL 588  40.398  42.813  28.332
  274   HG13  VAL 588          HG13      VAL 588  41.098  44.077  27.318
  275   HG21  VAL 588          HG21      VAL 588  40.940  42.872  25.266
  276   HG22  VAL 588          HG22      VAL 588  40.361  41.487  26.222
  277   HG23  VAL 588          HG23      VAL 588  39.468  42.000  24.797
  278    H    VAL 589           H        VAL 589  37.401  42.347  29.468
  279    HA   VAL 589           HA       VAL 589  35.812  44.830  29.536
  280    HB   VAL 589           HB       VAL 589  34.065  43.699  30.854
  281   HG11  VAL 589          HG11      VAL 589  34.436  42.016  28.371
  282   HG12  VAL 589          HG12      VAL 589  32.937  42.579  29.109
  283   HG13  VAL 589          HG13      VAL 589  34.019  43.748  28.322
  284   HG21  VAL 589          HG21      VAL 589  35.299  41.906  31.947
  285   HG22  VAL 589          HG22      VAL 589  34.049  41.122  30.959
  286   HG23  VAL 589          HG23      VAL 589  35.698  41.152  30.382
  287    H    LYS 590           H        LYS 590  36.139  46.080  31.374
  288    HA   LYS 590           HA       LYS 590  37.994  45.079  33.437
  289    HB2  LYS 590           HB2      LYS 590  38.649  47.186  32.398
  290    HB3  LYS 590           HB3      LYS 590  37.113  47.936  32.840
  291    HG2  LYS 590           HG2      LYS 590  37.661  47.586  35.260
  292    HG3  LYS 590           HG3      LYS 590  39.292  47.035  34.745
  293    HD2  LYS 590           HD2      LYS 590  39.814  49.133  33.861
  294    HD3  LYS 590           HD3      LYS 590  38.098  49.670  33.850
  295    HE2  LYS 590           HE2      LYS 590  38.530  49.071  36.491
  296    HE3  LYS 590           HE3      LYS 590  40.094  49.778  35.999
  297    HZ1  LYS 590           HZ1      LYS 590  37.468  51.054  36.001
  298    HZ2  LYS 590           HZ2      LYS 590  38.857  51.578  36.659
  299    HZ3  LYS 590           HZ3      LYS 590  38.648  51.612  35.034
  300    H    PHE 591           H        PHE 591  36.851  43.909  34.903
  301    HA   PHE 591           HA       PHE 591  34.476  44.434  36.202
  302    HB2  PHE 591           HB2      PHE 591  37.118  43.530  37.382
  303    HB3  PHE 591           HB3      PHE 591  35.535  43.342  38.150
  304    HD1  PHE 591           HD1      PHE 591  37.729  42.156  35.366
  305    HD2  PHE 591           HD2      PHE 591  33.897  41.685  37.301
  306    HE1  PHE 591           HE1      PHE 591  37.177  40.255  33.856
  307    HE2  PHE 591           HE2      PHE 591  33.443  39.700  35.855
  308    HZ   PHE 591           HZ       PHE 591  35.092  38.946  34.230
  309    H    ILE 592           H        ILE 592  33.652  45.909  37.472
  310    HA   ILE 592           HA       ILE 592  35.014  48.449  37.573
  311    HB   ILE 592           HB       ILE 592  32.268  48.075  38.744
  312   HG12  ILE 592          HG12      ILE 592  32.990  48.072  35.784
  313   HG13  ILE 592          HG13      ILE 592  32.156  46.792  36.684
  314   HG21  ILE 592          HG21      ILE 592  33.684  50.185  37.058
  315   HG22  ILE 592          HG22      ILE 592  32.035  50.355  37.716
  316   HG23  ILE 592          HG23      ILE 592  33.421  50.315  38.805
  317   HD11  ILE 592          HD11      ILE 592  31.031  49.495  35.918
  318   HD12  ILE 592          HD12      ILE 592  30.521  47.914  35.347
  319   HD13  ILE 592          HD13      ILE 592  30.236  48.350  37.043
  320    H    ASP 593           H        ASP 593  34.282  46.006  39.985
  321    HA   ASP 593           HA       ASP 593  35.168  47.615  42.267
  322    HB2  ASP 593           HB2      ASP 593  34.616  44.602  41.966
  323    HB3  ASP 593           HB3      ASP 593  34.952  45.393  43.483
  324    H    TYR 594           H        TYR 594  36.719  45.261  40.162
  325    HA   TYR 594           HA       TYR 594  39.041  44.935  42.019
  326    HB2  TYR 594           HB2      TYR 594  38.262  43.494  39.458
  327    HB3  TYR 594           HB3      TYR 594  39.600  43.016  40.506
  328    HD1  TYR 594           HD1      TYR 594  35.925  43.245  40.133
  329    HD2  TYR 594           HD2      TYR 594  39.145  41.777  42.621
  330    HE1  TYR 594           HE1      TYR 594  34.323  41.880  41.369
  331    HE2  TYR 594           HE2      TYR 594  37.496  40.358  43.857
  332    HH   TYR 594           HH       TYR 594  34.036  40.570  43.321
  333    H    GLY 595           H        GLY 595  38.465  45.894  38.597
  334    HA2  GLY 595           HA2      GLY 595  39.073  48.190  38.160
  335    HA3  GLY 595           HA3      GLY 595  40.496  47.990  39.230
  336    H    ASN 596           H        ASN 596  40.176  45.337  37.243
  337    HA   ASN 596           HA       ASN 596  41.930  46.532  35.145
  338    HB2  ASN 596           HB2      ASN 596  42.579  44.016  36.663
  339    HB3  ASN 596           HB3      ASN 596  43.558  44.870  35.418
  340   HD21  ASN 596          HD22      ASN 596  43.257  44.570  38.836
  341   HD22  ASN 596          HD21      ASN 596  44.122  46.016  39.246
  342    H    TYR 597           H        TYR 597  42.295  45.095  33.225
  343    HA   TYR 597           HA       TYR 597  39.743  43.691  32.794
  344    HB2  TYR 597           HB2      TYR 597  40.413  44.138  30.310
  345    HB3  TYR 597           HB3      TYR 597  39.477  45.270  31.253
  346    HD1  TYR 597           HD2      TYR 597  40.877  47.185  32.492
  347    HD2  TYR 597           HD1      TYR 597  42.199  44.967  29.051
  348    HE1  TYR 597           HE2      TYR 597  42.570  48.916  32.041
  349    HE2  TYR 597           HE1      TYR 597  43.971  46.671  28.626
  350    HH   TYR 597           HH       TYR 597  44.689  48.901  29.228
  351    H    GLU 598           H        GLU 598  39.408  41.950  31.696
  352    HA   GLU 598           HA       GLU 598  41.502  40.253  30.570
  353    HB2  GLU 598           HB2      GLU 598  40.665  38.268  31.867
  354    HB3  GLU 598           HB3      GLU 598  41.607  39.438  32.760
  355    HG2  GLU 598           HG2      GLU 598  39.318  40.334  33.688
  356    HG3  GLU 598           HG3      GLU 598  38.612  38.894  32.969
  357    H    GLU 599           H        GLU 599  40.688  38.436  29.284
  358    HA   GLU 599           HA       GLU 599  38.354  39.344  27.811
  359    HB2  GLU 599           HB2      GLU 599  39.151  37.856  26.049
  360    HB3  GLU 599           HB3      GLU 599  40.458  38.855  26.679
  361    HG2  GLU 599           HG2      GLU 599  40.132  36.093  27.843
  362    HG3  GLU 599           HG3      GLU 599  40.684  36.184  26.206
  363    H    VAL 600           H        VAL 600  36.529  38.371  27.418
  364    HA   VAL 600           HA       VAL 600  35.649  35.824  28.739
  365    HB   VAL 600           HB       VAL 600  34.357  38.541  29.079
  366   HG11  VAL 600          HG11      VAL 600  33.443  35.819  30.002
  367   HG12  VAL 600          HG12      VAL 600  32.716  37.394  30.448
  368   HG13  VAL 600          HG13      VAL 600  32.646  36.839  28.773
  369   HG21  VAL 600          HG21      VAL 600  35.907  36.643  30.932
  370   HG22  VAL 600          HG22      VAL 600  36.212  38.333  30.583
  371   HG23  VAL 600          HG23      VAL 600  34.814  37.857  31.583
  372    H    LEU 601           H        LEU 601  33.909  34.831  27.609
  373    HA   LEU 601           HA       LEU 601  33.781  35.329  24.840
  374    HB2  LEU 601           HB2      LEU 601  32.955  33.303  26.459
  375    HB3  LEU 601           HB3      LEU 601  31.394  33.970  25.985
  376    HG   LEU 601           HG       LEU 601  31.908  32.187  24.638
  377   HD11  LEU 601          HD11      LEU 601  30.652  33.671  23.422
  378   HD12  LEU 601          HD12      LEU 601  32.082  34.611  22.863
  379   HD13  LEU 601          HD13      LEU 601  31.800  32.943  22.349
  380   HD21  LEU 601          HD21      LEU 601  34.381  32.190  24.909
  381   HD22  LEU 601          HD22      LEU 601  33.952  32.055  23.190
  382   HD23  LEU 601          HD23      LEU 601  34.565  33.579  23.850
  383    H    LEU 602           H        LEU 602  32.337  36.297  23.495
  384    HA   LEU 602           HA       LEU 602  30.991  38.662  24.275
  385    HB2  LEU 602           HB2      LEU 602  30.795  36.830  21.890
  386    HB3  LEU 602           HB3      LEU 602  29.898  38.350  21.947
  387    HG   LEU 602           HG       LEU 602  32.891  38.364  22.492
  388   HD11  LEU 602          HD11      LEU 602  31.676  38.746  19.730
  389   HD12  LEU 602          HD12      LEU 602  33.387  38.714  20.239
  390   HD13  LEU 602          HD13      LEU 602  32.405  37.222  20.285
  391   HD21  LEU 602          HD21      LEU 602  31.539  40.412  22.946
  392   HD22  LEU 602          HD22      LEU 602  32.783  40.606  21.687
  393   HD23  LEU 602          HD23      LEU 602  31.084  40.426  21.211
  394    H    SER 603           H        SER 603  29.866  35.362  23.975
  395    HA   SER 603           HA       SER 603  27.050  36.009  24.506
  396    HB2  SER 603           HB2      SER 603  28.392  33.250  24.194
  397    HB3  SER 603           HB3      SER 603  26.641  33.614  24.109
  398    HG   SER 603           HG       SER 603  27.132  34.828  22.345
  399    H    ASN 604           H        ASN 604  29.422  36.148  26.553
  400    HA   ASN 604           HA       ASN 604  28.046  34.747  28.804
  401    HB2  ASN 604           HB2      ASN 604  31.011  35.099  28.208
  402    HB3  ASN 604           HB3      ASN 604  30.442  34.553  29.728
  403   HD21  ASN 604          HD22      ASN 604  28.224  32.832  27.808
  404   HD22  ASN 604          HD21      ASN 604  29.322  31.512  27.426
  405    H    ILE 605           H        ILE 605  29.636  37.690  27.593
  406    HA   ILE 605           HA       ILE 605  29.157  39.171  30.035
  407    HB   ILE 605           HB       ILE 605  29.210  40.212  27.222
  408   HG12  ILE 605          HG12      ILE 605  31.763  40.028  28.935
  409   HG13  ILE 605          HG13      ILE 605  31.368  38.727  27.838
  410   HG21  ILE 605          HG21      ILE 605  28.523  41.798  28.896
  411   HG22  ILE 605          HG22      ILE 605  29.963  41.429  29.895
  412   HG23  ILE 605          HG23      ILE 605  30.132  42.242  28.321
  413   HD11  ILE 605          HD11      ILE 605  32.829  40.157  26.669
  414   HD12  ILE 605          HD12      ILE 605  31.225  40.452  25.974
  415   HD13  ILE 605          HD13      ILE 605  31.920  41.611  27.138
  416    H    LYS 606           H        LYS 606  27.229  40.094  30.620
  417    HA   LYS 606           HA       LYS 606  24.705  39.717  29.031
  418    HB2  LYS 606           HB2      LYS 606  25.051  38.451  31.199
  419    HB3  LYS 606           HB3      LYS 606  24.964  40.019  32.026
  420    HG2  LYS 606           HG2      LYS 606  22.671  40.331  30.884
  421    HG3  LYS 606           HG3      LYS 606  22.792  38.608  30.427
  422    HD2  LYS 606           HD2      LYS 606  22.691  39.723  33.222
  423    HD3  LYS 606           HD3      LYS 606  21.474  38.776  32.368
  424    HE2  LYS 606           HE2      LYS 606  23.332  36.985  32.025
  425    HE3  LYS 606           HE3      LYS 606  24.231  37.847  33.294
  426    HZ1  LYS 606           HZ1      LYS 606  21.577  36.639  33.492
  427    HZ2  LYS 606           HZ2      LYS 606  22.886  36.094  34.265
  428    HZ3  LYS 606           HZ3      LYS 606  22.262  37.553  34.685
  429    HA   PRO 607           HA       PRO 607  24.646  44.273  29.321
  430    HB2  PRO 607           HB2      PRO 607  21.860  44.564  28.970
  431    HB3  PRO 607           HB3      PRO 607  23.129  44.639  27.701
  432    HG2  PRO 607           HG2      PRO 607  21.277  42.421  28.434
  433    HG3  PRO 607           HG3      PRO 607  22.027  42.766  26.843
  434    HD2  PRO 607           HD2      PRO 607  22.839  40.745  28.533
  435    HD3  PRO 607           HD3      PRO 607  23.913  41.548  27.352
  436    H    ILE 608           H        ILE 608  23.984  45.873  30.615
  437    HA   ILE 608           HA       ILE 608  22.928  45.323  33.330
  438    HB   ILE 608           HB       ILE 608  24.776  47.312  32.111
  439   HG12  ILE 608          HG12      ILE 608  24.372  46.371  34.967
  440   HG13  ILE 608          HG13      ILE 608  25.465  45.661  33.748
  441   HG21  ILE 608          HG21      ILE 608  22.982  48.533  34.231
  442   HG22  ILE 608          HG22      ILE 608  24.412  49.207  33.416
  443   HG23  ILE 608          HG23      ILE 608  22.951  48.910  32.498
  444   HD11  ILE 608          HD11      ILE 608  25.842  48.129  35.397
  445   HD12  ILE 608          HD12      ILE 608  26.957  46.818  35.008
  446   HD13  ILE 608          HD13      ILE 608  26.591  48.029  33.773
  447    H    LEU 609           H        LEU 609  22.072  46.774  30.253
  448    HA   LEU 609           HA       LEU 609  19.287  47.181  31.048
  449    HB2  LEU 609           HB2      LEU 609  20.119  49.350  31.601
  450    HB3  LEU 609           HB3      LEU 609  21.121  49.416  30.159
  451    HG   LEU 609           HG       LEU 609  19.073  49.422  28.745
  452   HD11  LEU 609          HD11      LEU 609  17.348  48.325  30.302
  453   HD12  LEU 609          HD12      LEU 609  17.563  49.693  31.415
  454   HD13  LEU 609          HD13      LEU 609  16.855  49.934  29.816
  455   HD21  LEU 609          HD21      LEU 609  20.047  51.551  29.534
  456   HD22  LEU 609          HD22      LEU 609  18.291  51.598  29.187
  457   HD23  LEU 609          HD23      LEU 609  18.852  51.562  30.871
  458    H    GLU 610           H        GLU 610  17.993  46.545  29.127
  459    HA   GLU 610           HA       GLU 610  19.634  45.337  27.026
  460    HB2  GLU 610           HB2      GLU 610  16.652  45.281  27.476
  461    HB3  GLU 610           HB3      GLU 610  17.556  44.457  26.183
  462    HG2  GLU 610           HG2      GLU 610  18.636  42.972  27.742
  463    HG3  GLU 610           HG3      GLU 610  18.151  43.905  29.116
  464    H1   TYR 611           H1       TYR 611  53.992  50.989  42.956
  465    H2   TYR 611           H2       TYR 611  54.468  52.111  41.877
  466    H3   TYR 611           H3       TYR 611  55.182  52.005  43.362
  467    HA   TYR 611           HA       TYR 611  56.531  51.046  41.516
  468    HB2  TYR 611           HB2      TYR 611  57.084  50.406  43.733
  469    HB3  TYR 611           HB3      TYR 611  55.687  49.376  43.904
  470    HD1  TYR 611           HD1      TYR 611  58.315  49.525  41.130
  471    HD2  TYR 611           HD2      TYR 611  56.378  47.193  44.257
  472    HE1  TYR 611           HE1      TYR 611  59.703  47.597  40.577
  473    HE2  TYR 611           HE2      TYR 611  57.713  45.191  43.512
  474    HH   TYR 611           HH       TYR 611  60.144  45.505  41.109
  475    H    SER 612           H        SER 612  54.361  48.338  42.351
  476    HA   SER 612           HA       SER 612  53.236  48.251  39.671
  477    HB2  SER 612           HB2      SER 612  55.171  45.977  40.417
  478    HB3  SER 612           HB3      SER 612  54.111  45.991  39.035
  479    HG   SER 612           HG       SER 612  55.516  48.242  39.020
  480    HA   PRO 613           HA       PRO 613  51.011  45.115  42.691
  481    HB2  PRO 613           HB2      PRO 613  52.172  46.301  45.223
  482    HB3  PRO 613           HB3      PRO 613  51.539  44.650  44.954
  483    HG2  PRO 613           HG2      PRO 613  54.202  45.185  45.049
  484    HG3  PRO 613           HG3      PRO 613  53.629  44.094  43.759
  485    HD2  PRO 613           HD2      PRO 613  54.153  47.075  43.629
  486    HD3  PRO 613           HD3      PRO 613  54.667  45.815  42.459
  487    H    SER 614           H        SER 614  48.923  45.768  43.372
  488    HA   SER 614           HA       SER 614  48.560  48.439  44.626
  489    HB2  SER 614           HB2      SER 614  46.586  48.915  43.240
  490    HB3  SER 614           HB3      SER 614  48.129  49.140  42.427
  491    HG   SER 614           HG       SER 614  46.689  48.067  41.148
  492    H    SER 615           H        SER 615  46.797  45.511  43.520
  493    HA   SER 615           HA       SER 615  45.719  45.110  46.145
  494    HB2  SER 615           HB2      SER 615  44.346  46.993  45.521
  495    HB3  SER 615           HB3      SER 615  43.785  46.194  44.059
  496    HG   SER 615           HG       SER 615  42.426  45.992  45.798
  497    HA   PRO 616           HA       PRO 616  45.737  41.169  43.905
  498    HB2  PRO 616           HB2      PRO 616  45.044  39.461  45.979
  499    HB3  PRO 616           HB3      PRO 616  46.681  40.123  45.739
  500    HG2  PRO 616           HG2      PRO 616  44.502  41.229  47.540
  501    HG3  PRO 616           HG3      PRO 616  46.202  40.903  47.972
  502    HD2  PRO 616           HD2      PRO 616  45.413  43.386  47.281
  503    HD3  PRO 616           HD3      PRO 616  46.962  42.762  46.637
  504   HC11  DA2 617          HC11      DA2 617  35.670  40.351  39.485
  505   HC12  DA2 617          HC12      DA2 617  36.886  39.464  38.556
  506   HC13  DA2 617          HC13      DA2 617  35.230  39.005  38.386
  507   HC21  DA2 617          HC21      DA2 617  34.828  36.872  41.136
  508   HC22  DA2 617          HC22      DA2 617  34.185  37.600  39.660
  509   HC23  DA2 617          HC23      DA2 617  34.173  38.501  41.193
  510    H2   DA2 617           H        DA2 617  44.070  39.979  42.848
  511    HA   DA2 617           HA       DA2 617  41.468  41.028  42.828
  512   HCB1  DA2 617          HCB1      DA2 617  42.240  38.247  41.826
  513   HCB2  DA2 617          HCB2      DA2 617  42.812  39.737  41.095
  514   HCG1  DA2 617          HCG1      DA2 617  40.457  40.510  40.835
  515   HCG2  DA2 617          HCG2      DA2 617  40.851  39.132  39.832
  516   HCD1  DA2 617          HCD1      DA2 617  39.848  37.534  41.252
  517   HCD2  DA2 617          HCD2      DA2 617  39.419  38.741  42.484
  518    HNE  DA2 617           HNE      DA2 617  38.366  39.504  39.944
  519   HNH2  DA2 617          HNH2      DA2 617  37.932  37.110  42.563
  520   HNH1  DA2 617          HNH1      DA2 617  36.247  36.931  42.314
  521    H    TYR 618           H        TYR 618  42.733  38.113  44.444
  522    HA   TYR 618           HA       TYR 618  40.386  37.609  46.130
  523    HB2  TYR 618           HB2      TYR 618  43.281  36.579  46.053
  524    HB3  TYR 618           HB3      TYR 618  42.195  36.102  47.320
  525    HD1  TYR 618           HD1      TYR 618  39.783  35.122  46.403
  526    HD2  TYR 618           HD2      TYR 618  43.642  34.949  44.452
  527    HE1  TYR 618           HE1      TYR 618  39.018  33.208  45.016
  528    HE2  TYR 618           HE2      TYR 618  42.869  32.983  43.133
  529    HH   TYR 618           HH       TYR 618  39.716  31.632  43.505
  530    H    THR 619           H        THR 619  40.544  40.084  46.564
  531    HA   THR 619           HA       THR 619  42.673  40.859  48.297
  532    HB   THR 619           HB       THR 619  41.804  42.669  47.141
  533    HG1  THR 619           HG1      THR 619  40.403  43.683  48.960
  534   HG21  THR 619          HG21      THR 619  39.041  41.596  47.871
  535   HG22  THR 619          HG22      THR 619  39.257  43.284  47.363
  536   HG23  THR 619          HG23      THR 619  39.713  41.948  46.290
  537    HA   PRO 620           HA       PRO 620  40.651  39.876  52.270
  538    HB2  PRO 620           HB2      PRO 620  42.613  40.565  54.011
  539    HB3  PRO 620           HB3      PRO 620  42.855  39.242  52.856
  540    HG2  PRO 620           HG2      PRO 620  43.756  42.136  52.435
  541    HG3  PRO 620           HG3      PRO 620  44.752  40.664  52.414
  542    HD2  PRO 620           HD2      PRO 620  43.627  41.748  50.142
  543    HD3  PRO 620           HD3      PRO 620  43.831  39.994  50.341
  544    H    GLN 621           H        GLN 621  41.286  42.925  50.997
  545    HA   GLN 621           HA       GLN 621  39.884  44.434  53.141
  546    HB2  GLN 621           HB2      GLN 621  41.998  45.345  52.606
  547    HB3  GLN 621           HB3      GLN 621  41.738  45.185  50.861
  548    HG2  GLN 621           HG2      GLN 621  39.859  46.888  51.048
  549    HG3  GLN 621           HG3      GLN 621  40.288  47.124  52.723
  550   HE21  GLN 621          HE22      GLN 621  42.262  48.407  53.146
  551   HE22  GLN 621          HE21      GLN 621  42.781  49.520  51.876
  552    H    SER 622           H        SER 622  37.821  44.280  52.917
  553    HA   SER 622           HA       SER 622  35.672  44.510  52.178
  554    HB2  SER 622           HB2      SER 622  37.199  46.639  50.763
  555    HB3  SER 622           HB3      SER 622  35.419  46.575  50.719
  556    HG   SER 622           HG       SER 622  36.616  47.697  52.560
  557    HA   PRO 623           HA       PRO 623  35.735  42.477  47.891
  558    HB2  PRO 623           HB2      PRO 623  34.897  39.968  48.558
  559    HB3  PRO 623           HB3      PRO 623  36.627  40.466  48.406
  560    HG2  PRO 623           HG2      PRO 623  34.920  40.185  50.900
  561    HG3  PRO 623           HG3      PRO 623  36.578  39.574  50.625
  562    HD2  PRO 623           HD2      PRO 623  35.979  41.914  51.934
  563    HD3  PRO 623           HD3      PRO 623  37.486  41.689  50.972
  Start of MODEL   16
    1    H1   MET 553           H1       MET 553  23.289  41.227  24.335
    2    H2   MET 553           H2       MET 553  23.070  41.061  22.768
    3    H3   MET 553           H3       MET 553  23.934  42.313  23.272
    4    HA   MET 553           HA       MET 553  25.752  41.006  23.904
    5    HB2  MET 553           HB2      MET 553  24.208  38.440  23.403
    6    HB3  MET 553           HB3      MET 553  25.791  38.730  24.146
    7    HG2  MET 553           HG2      MET 553  24.683  40.004  25.932
    8    HG3  MET 553           HG3      MET 553  23.097  39.555  25.307
    9    HE1  MET 553           HE1      MET 553  23.521  36.337  24.371
   10    HE2  MET 553           HE2      MET 553  22.979  35.622  25.892
   11    HE3  MET 553           HE3      MET 553  22.126  37.020  25.223
   12    H    LYS 554           H        LYS 554  23.584  39.762  21.367
   13    HA   LYS 554           HA       LYS 554  25.387  38.460  19.702
   14    HB2  LYS 554           HB2      LYS 554  23.570  38.325  18.210
   15    HB3  LYS 554           HB3      LYS 554  22.949  38.149  19.867
   16    HG2  LYS 554           HG2      LYS 554  21.990  40.410  19.781
   17    HG3  LYS 554           HG3      LYS 554  22.796  40.710  18.222
   18    HD2  LYS 554           HD2      LYS 554  21.517  38.943  17.154
   19    HD3  LYS 554           HD3      LYS 554  20.775  38.484  18.709
   20    HE2  LYS 554           HE2      LYS 554  19.636  40.524  18.906
   21    HE3  LYS 554           HE3      LYS 554  20.562  41.274  17.562
   22    HZ1  LYS 554           HZ1      LYS 554  18.162  40.082  17.322
   23    HZ2  LYS 554           HZ2      LYS 554  19.188  40.224  16.066
   24    HZ3  LYS 554           HZ3      LYS 554  19.142  38.857  16.977
   25    H    MET 555           H        MET 555  25.314  41.772  20.040
   26    HA   MET 555           HA       MET 555  26.948  42.215  17.645
   27    HB2  MET 555           HB2      MET 555  25.749  44.101  16.901
   28    HB3  MET 555           HB3      MET 555  24.832  42.586  16.797
   29    HG2  MET 555           HG2      MET 555  23.432  43.258  18.693
   30    HG3  MET 555           HG3      MET 555  24.267  44.822  18.779
   31    HE1  MET 555           HE1      MET 555  23.351  46.570  15.452
   32    HE2  MET 555           HE2      MET 555  23.835  46.813  17.140
   33    HE3  MET 555           HE3      MET 555  24.860  45.836  16.039
   34    H    TRP 556           H        TRP 556  28.102  42.037  19.882
   35    HA   TRP 556           HA       TRP 556  28.119  44.287  21.607
   36    HB2  TRP 556           HB2      TRP 556  29.774  41.796  21.414
   37    HB3  TRP 556           HB3      TRP 556  30.446  43.125  22.321
   38    HD1  TRP 556           HD1      TRP 556  29.246  40.281  23.352
   39    HE1  TRP 556           HE1      TRP 556  27.758  40.328  25.431
   40    HE3  TRP 556           HE3      TRP 556  28.131  45.337  23.551
   41    HZ2  TRP 556           HZ2      TRP 556  26.366  42.230  26.999
   42    HZ3  TRP 556           HZ3      TRP 556  26.594  46.154  25.304
   43    HH2  TRP 556           HH2      TRP 556  25.640  44.660  26.944
   44    H    LYS 557           H        LYS 557  29.785  45.749  22.143
   45    HA   LYS 557           HA       LYS 557  31.833  46.494  20.208
   46    HB2  LYS 557           HB2      LYS 557  30.916  48.479  19.339
   47    HB3  LYS 557           HB3      LYS 557  29.841  47.176  18.958
   48    HG2  LYS 557           HG2      LYS 557  28.210  47.883  20.640
   49    HG3  LYS 557           HG3      LYS 557  29.357  49.047  21.313
   50    HD2  LYS 557           HD2      LYS 557  29.205  50.464  19.358
   51    HD3  LYS 557           HD3      LYS 557  28.304  49.230  18.462
   52    HE2  LYS 557           HE2      LYS 557  27.034  50.225  20.977
   53    HE3  LYS 557           HE3      LYS 557  27.138  51.390  19.678
   54    HZ1  LYS 557           HZ1      LYS 557  26.095  49.821  18.174
   55    HZ2  LYS 557           HZ2      LYS 557  25.938  48.721  19.352
   56    HZ3  LYS 557           HZ3      LYS 557  25.116  50.131  19.364
   57    HA   PRO 558           HA       PRO 558  33.651  48.000  23.723
   58    HB2  PRO 558           HB2      PRO 558  35.328  50.029  22.998
   59    HB3  PRO 558           HB3      PRO 558  35.515  48.297  22.551
   60    HG2  PRO 558           HG2      PRO 558  34.520  50.570  20.833
   61    HG3  PRO 558           HG3      PRO 558  35.624  49.238  20.488
   62    HD2  PRO 558           HD2      PRO 558  32.828  49.187  19.906
   63    HD3  PRO 558           HD3      PRO 558  33.806  47.730  20.129
   64    H    GLY 559           H        GLY 559  34.070  49.740  25.400
   65    HA2  GLY 559           HA2      GLY 559  33.732  51.646  26.516
   66    HA3  GLY 559           HA3      GLY 559  33.225  52.443  25.039
   67    H    ASP 560           H        ASP 560  31.815  49.740  27.055
   68    HA   ASP 560           HA       ASP 560  29.413  51.382  27.636
   69    HB2  ASP 560           HB2      ASP 560  29.207  49.893  25.622
   70    HB3  ASP 560           HB3      ASP 560  29.259  48.508  26.699
   71    H    GLU 561           H        GLU 561  28.147  49.919  29.178
   72    HA   GLU 561           HA       GLU 561  29.826  48.511  31.244
   73    HB2  GLU 561           HB2      GLU 561  28.778  49.500  33.035
   74    HB3  GLU 561           HB3      GLU 561  29.571  50.738  31.990
   75    HG2  GLU 561           HG2      GLU 561  27.285  51.310  31.110
   76    HG3  GLU 561           HG3      GLU 561  26.619  50.228  32.352
   77    H    CYS 562           H        CYS 562  29.257  46.665  31.720
   78    HA   CYS 562           HA       CYS 562  26.500  45.683  31.285
   79    HB2  CYS 562           HB2      CYS 562  29.022  44.699  29.883
   80    HB3  CYS 562           HB3      CYS 562  27.456  43.860  29.872
   81    HG   CYS 562           HG       CYS 562  27.833  45.238  27.576
   82    H    PHE 563           H        PHE 563  26.740  43.092  31.691
   83    HA   PHE 563           HA       PHE 563  28.135  42.691  34.300
   84    HB2  PHE 563           HB2      PHE 563  25.379  41.671  33.459
   85    HB3  PHE 563           HB3      PHE 563  26.400  40.894  34.642
   86    HD1  PHE 563           HD1      PHE 563  27.194  41.948  36.619
   87    HD2  PHE 563           HD2      PHE 563  24.091  43.676  34.222
   88    HE1  PHE 563           HE1      PHE 563  26.364  43.202  38.623
   89    HE2  PHE 563           HE2      PHE 563  23.223  44.894  36.210
   90    HZ   PHE 563           HZ       PHE 563  24.284  44.593  38.417
   91    H    ALA 564           H        ALA 564  29.782  41.154  34.149
   92    HA   ALA 564           HA       ALA 564  29.837  39.499  31.683
   93    HB1  ALA 564           HB1      ALA 564  32.141  40.802  33.166
   94    HB2  ALA 564           HB2      ALA 564  32.205  39.729  31.753
   95    HB3  ALA 564           HB3      ALA 564  31.407  41.329  31.637
   96    H    LEU 565           H        LEU 565  29.965  37.351  31.967
   97    HA   LEU 565           HA       LEU 565  29.936  36.011  34.503
   98    HB2  LEU 565           HB2      LEU 565  28.818  35.383  32.238
   99    HB3  LEU 565           HB3      LEU 565  30.400  34.876  31.714
  100    HG   LEU 565           HG       LEU 565  30.337  32.973  33.325
  101   HD11  LEU 565          HD11      LEU 565  29.259  34.137  35.180
  102   HD12  LEU 565          HD12      LEU 565  27.715  34.153  34.307
  103   HD13  LEU 565          HD13      LEU 565  28.471  32.595  34.751
  104   HD21  LEU 565          HD21      LEU 565  28.367  31.830  32.407
  105   HD22  LEU 565          HD22      LEU 565  27.697  33.376  31.832
  106   HD23  LEU 565          HD23      LEU 565  29.202  32.755  31.139
  107    H    TYR 566           H        TYR 566  31.601  35.762  35.802
  108    HA   TYR 566           HA       TYR 566  34.326  35.637  34.851
  109    HB2  TYR 566           HB2      TYR 566  33.399  36.697  36.937
  110    HB3  TYR 566           HB3      TYR 566  33.173  35.072  37.601
  111    HD1  TYR 566           HD1      TYR 566  35.928  36.911  35.757
  112    HD2  TYR 566           HD2      TYR 566  34.753  34.700  39.249
  113    HE1  TYR 566           HE1      TYR 566  38.282  36.992  36.602
  114    HE2  TYR 566           HE2      TYR 566  37.142  34.763  40.072
  115    HH   TYR 566           HH       TYR 566  39.723  36.086  38.128
  116    H    TRP 567           H        TRP 567  35.627  33.715  36.081
  117    HA   TRP 567           HA       TRP 567  34.581  31.302  34.592
  118    HB2  TRP 567           HB2      TRP 567  36.929  30.756  34.245
  119    HB3  TRP 567           HB3      TRP 567  36.471  32.282  33.483
  120    HD1  TRP 567           HD1      TRP 567  37.733  34.505  34.479
  121    HE1  TRP 567           HE1      TRP 567  39.705  34.841  36.064
  122    HE3  TRP 567           HE3      TRP 567  38.317  29.687  36.122
  123    HZ2  TRP 567           HZ2      TRP 567  41.392  33.235  37.750
  124    HZ3  TRP 567           HZ3      TRP 567  39.861  29.212  37.983
  125    HH2  TRP 567           HH2      TRP 567  41.329  31.038  38.900
  126    H    GLU 568           H        GLU 568  36.556  32.268  37.354
  127    HA   GLU 568           HA       GLU 568  37.131  29.925  38.694
  128    HB2  GLU 568           HB2      GLU 568  37.895  32.139  39.327
  129    HB3  GLU 568           HB3      GLU 568  36.240  32.704  39.409
  130    HG2  GLU 568           HG2      GLU 568  37.245  32.607  41.614
  131    HG3  GLU 568           HG3      GLU 568  35.758  31.726  41.459
  132    H    ASP 569           H        ASP 569  34.172  31.839  39.074
  133    HA   ASP 569           HA       ASP 569  32.906  29.570  40.520
  134    HB2  ASP 569           HB2      ASP 569  31.620  31.492  41.766
  135    HB3  ASP 569           HB3      ASP 569  33.230  31.098  42.286
  136    H    ASN 570           H        ASN 570  32.716  31.289  37.686
  137    HA   ASN 570           HA       ASN 570  31.159  31.744  36.191
  138    HB2  ASN 570           HB2      ASN 570  31.188  29.225  36.507
  139    HB3  ASN 570           HB3      ASN 570  29.689  29.416  37.420
  140   HD21  ASN 570          HD22      ASN 570  27.871  29.320  36.276
  141   HD22  ASN 570          HD21      ASN 570  27.738  29.446  34.509
  142    H    LYS 571           H        LYS 571  30.798  33.298  38.670
  143    HA   LYS 571           HA       LYS 571  27.929  34.032  38.422
  144    HB2  LYS 571           HB2      LYS 571  30.032  34.323  40.483
  145    HB3  LYS 571           HB3      LYS 571  29.330  35.870  40.068
  146    HG2  LYS 571           HG2      LYS 571  27.546  33.517  40.828
  147    HG3  LYS 571           HG3      LYS 571  28.264  34.554  42.041
  148    HD2  LYS 571           HD2      LYS 571  27.417  36.573  41.087
  149    HD3  LYS 571           HD3      LYS 571  26.706  35.742  39.720
  150    HE2  LYS 571           HE2      LYS 571  25.883  35.590  42.666
  151    HE3  LYS 571           HE3      LYS 571  25.122  36.501  41.346
  152    HZ1  LYS 571           HZ1      LYS 571  25.153  33.552  41.652
  153    HZ2  LYS 571           HZ2      LYS 571  23.874  34.570  41.675
  154    HZ3  LYS 571           HZ3      LYS 571  24.665  34.324  40.309
  155    H    PHE 572           H        PHE 572  27.197  35.887  37.369
  156    HA   PHE 572           HA       PHE 572  28.965  37.539  35.711
  157    HB2  PHE 572           HB2      PHE 572  26.163  38.320  36.614
  158    HB3  PHE 572           HB3      PHE 572  27.005  38.897  35.253
  159    HD1  PHE 572           HD2      PHE 572  27.312  37.643  33.180
  160    HD2  PHE 572           HD1      PHE 572  25.024  36.042  36.474
  161    HE1  PHE 572           HE2      PHE 572  26.390  35.892  31.692
  162    HE2  PHE 572           HE1      PHE 572  24.174  34.248  34.993
  163    HZ   PHE 572           HZ       PHE 572  24.899  34.119  32.638
  164    H    TYR 573           H        TYR 573  30.016  39.215  36.295
  165    HA   TYR 573           HA       TYR 573  29.133  40.739  38.671
  166    HB2  TYR 573           HB2      TYR 573  32.026  40.218  37.933
  167    HB3  TYR 573           HB3      TYR 573  31.421  41.133  39.301
  168    HD1  TYR 573           HD1      TYR 573  30.480  39.929  41.302
  169    HD2  TYR 573           HD2      TYR 573  32.002  37.744  37.946
  170    HE1  TYR 573           HE1      TYR 573  31.047  38.049  42.815
  171    HE2  TYR 573           HE2      TYR 573  32.421  35.775  39.403
  172    HH   TYR 573           HH       TYR 573  32.402  35.024  41.519
  173    H    ARG 574           H        ARG 574  29.191  42.937  38.340
  174    HA   ARG 574           HA       ARG 574  28.925  44.064  35.768
  175    HB2  ARG 574           HB2      ARG 574  29.101  46.249  36.857
  176    HB3  ARG 574           HB3      ARG 574  28.004  45.085  37.677
  177    HG2  ARG 574           HG2      ARG 574  29.638  44.736  39.417
  178    HG3  ARG 574           HG3      ARG 574  30.783  45.820  38.578
  179    HD2  ARG 574           HD2      ARG 574  29.455  46.629  40.575
  180    HD3  ARG 574           HD3      ARG 574  29.697  47.708  39.194
  181    HE   ARG 574           HE       ARG 574  27.147  46.322  40.085
  182   HH11  ARG 574          HH11      ARG 574  28.374  49.178  38.191
  183   HH12  ARG 574          HH12      ARG 574  26.800  49.363  37.522
  184   HH21  ARG 574          HH21      ARG 574  25.226  46.961  39.280
  185   HH22  ARG 574          HH22      ARG 574  25.108  48.412  38.319
  186    H    ALA 575           H        ALA 575  30.193  44.929  34.277
  187    HA   ALA 575           HA       ALA 575  32.988  45.565  34.794
  188    HB1  ALA 575           HB1      ALA 575  33.815  43.906  33.149
  189    HB2  ALA 575           HB2      ALA 575  32.849  43.025  34.342
  190    HB3  ALA 575           HB3      ALA 575  32.106  43.442  32.804
  191    H    GLU 576           H        GLU 576  33.623  47.296  33.513
  192    HA   GLU 576           HA       GLU 576  31.693  48.296  31.599
  193    HB2  GLU 576           HB2      GLU 576  34.482  49.299  32.230
  194    HB3  GLU 576           HB3      GLU 576  33.216  50.105  31.242
  195    HG2  GLU 576           HG2      GLU 576  31.774  50.182  33.305
  196    HG3  GLU 576           HG3      GLU 576  33.127  49.459  34.192
  197    H    VAL 577           H        VAL 577  31.736  47.712  29.455
  198    HA   VAL 577           HA       VAL 577  33.579  45.915  28.236
  199    HB   VAL 577           HB       VAL 577  31.465  47.883  27.293
  200   HG11  VAL 577          HG11      VAL 577  33.298  46.185  25.679
  201   HG12  VAL 577          HG12      VAL 577  31.629  46.534  25.106
  202   HG13  VAL 577          HG13      VAL 577  32.737  47.876  25.454
  203   HG21  VAL 577          HG21      VAL 577  30.358  46.119  28.260
  204   HG22  VAL 577          HG22      VAL 577  30.397  45.614  26.558
  205   HG23  VAL 577          HG23      VAL 577  31.533  44.880  27.679
  206    H    GLU 578           H        GLU 578  35.487  46.113  27.364
  207    HA   GLU 578           HA       GLU 578  36.544  48.849  26.870
  208    HB2  GLU 578           HB2      GLU 578  37.600  47.531  28.740
  209    HB3  GLU 578           HB3      GLU 578  38.031  46.259  27.625
  210    HG2  GLU 578           HG2      GLU 578  39.976  47.600  27.871
  211    HG3  GLU 578           HG3      GLU 578  39.321  47.961  26.292
  212    H    ALA 579           H        ALA 579  36.262  45.627  25.361
  213    HA   ALA 579           HA       ALA 579  36.704  46.769  22.735
  214    HB1  ALA 579           HB1      ALA 579  39.041  46.715  23.566
  215    HB2  ALA 579           HB2      ALA 579  38.865  44.988  23.943
  216    HB3  ALA 579           HB3      ALA 579  38.742  45.521  22.252
  217    H    LEU 580           H        LEU 580  34.940  45.765  21.992
  218    HA   LEU 580           HA       LEU 580  34.900  42.760  22.139
  219    HB2  LEU 580           HB2      LEU 580  32.381  44.343  21.921
  220    HB3  LEU 580           HB3      LEU 580  32.604  42.686  22.453
  221    HG   LEU 580           HG       LEU 580  32.905  45.238  23.920
  222   HD11  LEU 580          HD11      LEU 580  31.285  42.694  24.330
  223   HD12  LEU 580          HD12      LEU 580  31.499  43.783  25.667
  224   HD13  LEU 580          HD13      LEU 580  30.779  44.404  24.183
  225   HD21  LEU 580          HD21      LEU 580  34.806  44.473  24.918
  226   HD22  LEU 580          HD22      LEU 580  33.663  43.633  25.938
  227   HD23  LEU 580          HD23      LEU 580  34.454  42.783  24.554
  228    H    HIS 581           H        HIS 581  34.999  41.858  20.267
  229    HA   HIS 581           HA       HIS 581  33.556  43.135  18.018
  230    HB2  HIS 581           HB2      HIS 581  36.081  41.435  17.726
  231    HB3  HIS 581           HB3      HIS 581  35.049  42.041  16.434
  232    HD2  HIS 581           HD2      HIS 581  37.227  43.545  19.366
  233    HE1  HIS 581           HE1      HIS 581  37.482  46.257  16.136
  234    HE2  HIS 581           HE2      HIS 581  38.204  45.755  18.492
  235    H    SER 582           H        SER 582  32.014  42.014  17.082
  236    HA   SER 582           HA       SER 582  31.236  39.432  18.057
  237    HB2  SER 582           HB2      SER 582  30.116  40.952  15.629
  238    HB3  SER 582           HB3      SER 582  29.260  39.756  16.593
  239    HG   SER 582           HG       SER 582  29.313  41.143  18.278
  240    H    SER 583           H        SER 583  33.378  40.486  15.671
  241    HA   SER 583           HA       SER 583  33.205  38.391  13.720
  242    HB2  SER 583           HB2      SER 583  35.266  39.522  12.792
  243    HB3  SER 583           HB3      SER 583  33.887  40.590  13.013
  244    HG   SER 583           HG       SER 583  35.688  41.546  13.790
  245    H    GLY 584           H        GLY 584  33.894  37.640  16.653
  246    HA2  GLY 584           HA2      GLY 584  35.639  35.469  15.980
  247    HA3  GLY 584           HA3      GLY 584  36.412  36.691  17.012
  248    H    MET 585           H        MET 585  36.173  35.569  19.124
  249    HA   MET 585           HA       MET 585  33.497  34.458  19.903
  250    HB2  MET 585           HB2      MET 585  34.746  32.693  21.033
  251    HB3  MET 585           HB3      MET 585  34.893  32.583  19.284
  252    HG2  MET 585           HG2      MET 585  37.171  33.669  19.413
  253    HG3  MET 585           HG3      MET 585  37.000  33.767  21.147
  254    HE1  MET 585           HE1      MET 585  35.496  30.807  21.634
  255    HE2  MET 585           HE2      MET 585  36.972  30.087  22.313
  256    HE3  MET 585           HE3      MET 585  36.558  31.795  22.649
  257    H    THR 586           H        THR 586  36.287  36.379  21.084
  258    HA   THR 586           HA       THR 586  34.808  36.494  23.672
  259    HB   THR 586           HB       THR 586  37.099  36.618  24.843
  260    HG1  THR 586           HG1      THR 586  38.524  36.646  23.265
  261   HG21  THR 586          HG21      THR 586  35.902  34.788  25.400
  262   HG22  THR 586          HG22      THR 586  35.782  34.162  23.745
  263   HG23  THR 586          HG23      THR 586  37.329  34.062  24.612
  264    H    ALA 587           H        ALA 587  35.046  38.220  24.902
  265    HA   ALA 587           HA       ALA 587  35.432  40.814  23.537
  266    HB1  ALA 587           HB1      ALA 587  33.091  39.469  24.897
  267    HB2  ALA 587           HB2      ALA 587  33.350  41.128  25.353
  268    HB3  ALA 587           HB3      ALA 587  33.106  40.773  23.650
  269    H    VAL 588           H        VAL 588  36.243  42.330  24.822
  270    HA   VAL 588           HA       VAL 588  37.545  41.449  27.360
  271    HB   VAL 588           HB       VAL 588  38.484  43.969  26.009
  272   HG11  VAL 588          HG11      VAL 588  39.761  41.900  27.806
  273   HG12  VAL 588          HG12      VAL 588  40.662  43.196  27.019
  274   HG13  VAL 588          HG13      VAL 588  39.401  43.635  28.151
  275   HG21  VAL 588          HG21      VAL 588  38.818  42.367  24.157
  276   HG22  VAL 588          HG22      VAL 588  40.365  42.502  24.972
  277   HG23  VAL 588          HG23      VAL 588  39.358  41.110  25.322
  278    H    VAL 589           H        VAL 589  37.045  42.318  29.255
  279    HA   VAL 589           HA       VAL 589  35.396  44.769  29.369
  280    HB   VAL 589           HB       VAL 589  33.849  43.585  30.879
  281   HG11  VAL 589          HG11      VAL 589  32.348  42.959  29.175
  282   HG12  VAL 589          HG12      VAL 589  33.494  43.902  28.227
  283   HG13  VAL 589          HG13      VAL 589  33.589  42.150  28.218
  284   HG21  VAL 589          HG21      VAL 589  33.737  40.955  30.340
  285   HG22  VAL 589          HG22      VAL 589  35.488  41.160  30.181
  286   HG23  VAL 589          HG23      VAL 589  34.712  41.613  31.671
  287    H    LYS 590           H        LYS 590  35.677  45.903  31.252
  288    HA   LYS 590           HA       LYS 590  37.721  44.910  33.141
  289    HB2  LYS 590           HB2      LYS 590  38.251  47.021  32.090
  290    HB3  LYS 590           HB3      LYS 590  36.708  47.722  32.541
  291    HG2  LYS 590           HG2      LYS 590  37.359  47.487  34.965
  292    HG3  LYS 590           HG3      LYS 590  38.918  46.808  34.430
  293    HD2  LYS 590           HD2      LYS 590  39.655  48.834  33.541
  294    HD3  LYS 590           HD3      LYS 590  37.982  49.540  33.549
  295    HE2  LYS 590           HE2      LYS 590  38.262  49.144  36.122
  296    HE3  LYS 590           HE3      LYS 590  39.995  49.319  35.747
  297    HZ1  LYS 590           HZ1      LYS 590  38.873  51.420  36.311
  298    HZ2  LYS 590           HZ2      LYS 590  39.554  51.515  34.850
  299    HZ3  LYS 590           HZ3      LYS 590  37.952  51.335  35.001
  300    H    PHE 591           H        PHE 591  36.838  43.749  34.792
  301    HA   PHE 591           HA       PHE 591  34.467  44.154  36.192
  302    HB2  PHE 591           HB2      PHE 591  37.149  43.150  37.250
  303    HB3  PHE 591           HB3      PHE 591  35.639  43.094  38.125
  304    HD1  PHE 591           HD1      PHE 591  37.255  41.918  34.924
  305    HD2  PHE 591           HD2      PHE 591  34.008  41.449  37.714
  306    HE1  PHE 591           HE1      PHE 591  36.579  39.774  33.809
  307    HE2  PHE 591           HE2      PHE 591  33.433  39.265  36.666
  308    HZ   PHE 591           HZ       PHE 591  34.707  38.453  34.715
  309    H    ILE 592           H        ILE 592  33.576  45.802  37.012
  310    HA   ILE 592           HA       ILE 592  34.992  48.267  37.166
  311    HB   ILE 592           HB       ILE 592  32.283  47.969  38.470
  312   HG12  ILE 592          HG12      ILE 592  32.882  47.676  35.537
  313   HG13  ILE 592          HG13      ILE 592  31.724  46.811  36.545
  314   HG21  ILE 592          HG21      ILE 592  33.476  50.161  36.759
  315   HG22  ILE 592          HG22      ILE 592  31.960  50.224  37.703
  316   HG23  ILE 592          HG23      ILE 592  33.518  50.145  38.529
  317   HD11  ILE 592          HD11      ILE 592  31.337  49.675  35.558
  318   HD12  ILE 592          HD12      ILE 592  30.788  48.243  34.702
  319   HD13  ILE 592          HD13      ILE 592  30.080  48.634  36.265
  320    H    ASP 593           H        ASP 593  33.836  46.048  39.699
  321    HA   ASP 593           HA       ASP 593  34.686  47.856  41.804
  322    HB2  ASP 593           HB2      ASP 593  34.130  44.889  42.064
  323    HB3  ASP 593           HB3      ASP 593  34.152  46.131  43.336
  324    H    TYR 594           H        TYR 594  36.439  45.531  39.953
  325    HA   TYR 594           HA       TYR 594  38.358  44.792  42.141
  326    HB2  TYR 594           HB2      TYR 594  37.741  43.566  39.468
  327    HB3  TYR 594           HB3      TYR 594  38.947  42.978  40.605
  328    HD1  TYR 594           HD1      TYR 594  35.283  43.666  40.216
  329    HD2  TYR 594           HD2      TYR 594  38.282  41.565  42.490
  330    HE1  TYR 594           HE1      TYR 594  33.529  42.245  41.175
  331    HE2  TYR 594           HE2      TYR 594  36.494  40.189  43.546
  332    HH   TYR 594           HH       TYR 594  33.084  40.683  42.801
  333    H    GLY 595           H        GLY 595  38.319  45.720  38.701
  334    HA2  GLY 595           HA2      GLY 595  38.956  47.906  38.130
  335    HA3  GLY 595           HA3      GLY 595  40.344  47.903  39.178
  336    H    ASN 596           H        ASN 596  39.591  45.313  36.739
  337    HA   ASN 596           HA       ASN 596  41.546  46.381  34.907
  338    HB2  ASN 596           HB2      ASN 596  43.219  44.728  35.166
  339    HB3  ASN 596           HB3      ASN 596  42.899  45.331  36.774
  340   HD21  ASN 596          HD22      ASN 596  43.164  42.513  34.920
  341   HD22  ASN 596          HD21      ASN 596  42.447  41.418  36.065
  342    H    TYR 597           H        TYR 597  41.821  44.373  33.045
  343    HA   TYR 597           HA       TYR 597  39.140  43.165  32.707
  344    HB2  TYR 597           HB2      TYR 597  39.412  43.752  30.198
  345    HB3  TYR 597           HB3      TYR 597  38.827  45.007  31.210
  346    HD1  TYR 597           HD2      TYR 597  40.313  46.802  32.145
  347    HD2  TYR 597           HD1      TYR 597  41.494  44.298  28.825
  348    HE1  TYR 597           HE2      TYR 597  42.205  48.280  31.711
  349    HE2  TYR 597           HE1      TYR 597  43.251  45.944  28.240
  350    HH   TYR 597           HH       TYR 597  44.191  47.999  28.753
  351    H    GLU 598           H        GLU 598  38.764  41.619  31.203
  352    HA   GLU 598           HA       GLU 598  40.919  40.139  29.964
  353    HB2  GLU 598           HB2      GLU 598  40.424  38.038  31.208
  354    HB3  GLU 598           HB3      GLU 598  41.117  39.283  32.214
  355    HG2  GLU 598           HG2      GLU 598  38.824  39.828  33.133
  356    HG3  GLU 598           HG3      GLU 598  38.125  38.635  32.071
  357    H    GLU 599           H        GLU 599  40.277  38.434  28.733
  358    HA   GLU 599           HA       GLU 599  38.002  38.669  27.127
  359    HB2  GLU 599           HB2      GLU 599  38.792  36.555  26.196
  360    HB3  GLU 599           HB3      GLU 599  40.084  37.702  26.389
  361    HG2  GLU 599           HG2      GLU 599  39.604  35.265  28.160
  362    HG3  GLU 599           HG3      GLU 599  40.703  35.383  26.795
  363    H    VAL 600           H        VAL 600  35.995  38.110  27.347
  364    HA   VAL 600           HA       VAL 600  35.201  35.619  28.719
  365    HB   VAL 600           HB       VAL 600  33.787  38.336  28.746
  366   HG11  VAL 600          HG11      VAL 600  32.867  35.810  30.122
  367   HG12  VAL 600          HG12      VAL 600  32.155  37.451  30.208
  368   HG13  VAL 600          HG13      VAL 600  32.152  36.579  28.676
  369   HG21  VAL 600          HG21      VAL 600  33.973  38.542  31.085
  370   HG22  VAL 600          HG22      VAL 600  34.924  37.071  31.281
  371   HG23  VAL 600          HG23      VAL 600  35.597  38.457  30.411
  372    H    LEU 601           H        LEU 601  33.536  34.471  27.414
  373    HA   LEU 601           HA       LEU 601  33.316  35.022  24.657
  374    HB2  LEU 601           HB2      LEU 601  32.406  32.989  26.235
  375    HB3  LEU 601           HB3      LEU 601  30.886  33.832  25.960
  376    HG   LEU 601           HG       LEU 601  30.989  32.040  24.608
  377   HD11  LEU 601          HD11      LEU 601  29.908  33.907  23.482
  378   HD12  LEU 601          HD12      LEU 601  31.418  34.236  22.564
  379   HD13  LEU 601          HD13      LEU 601  30.569  32.716  22.399
  380   HD21  LEU 601          HD21      LEU 601  33.080  32.263  22.749
  381   HD22  LEU 601          HD22      LEU 601  33.809  32.650  24.320
  382   HD23  LEU 601          HD23      LEU 601  32.921  31.142  24.134
  383    H    LEU 602           H        LEU 602  31.771  36.036  23.384
  384    HA   LEU 602           HA       LEU 602  30.570  38.436  24.245
  385    HB2  LEU 602           HB2      LEU 602  29.948  36.489  21.971
  386    HB3  LEU 602           HB3      LEU 602  29.513  38.197  21.992
  387    HG   LEU 602           HG       LEU 602  32.460  37.215  22.187
  388   HD11  LEU 602          HD11      LEU 602  31.079  37.695  19.550
  389   HD12  LEU 602          HD12      LEU 602  32.755  37.183  19.856
  390   HD13  LEU 602          HD13      LEU 602  31.427  36.093  20.257
  391   HD21  LEU 602          HD21      LEU 602  31.885  39.620  22.554
  392   HD22  LEU 602          HD22      LEU 602  33.116  39.204  21.310
  393   HD23  LEU 602          HD23      LEU 602  31.472  39.683  20.810
  394    H    SER 603           H        SER 603  29.147  35.208  23.938
  395    HA   SER 603           HA       SER 603  26.464  35.970  24.668
  396    HB2  SER 603           HB2      SER 603  27.846  33.241  24.769
  397    HB3  SER 603           HB3      SER 603  26.119  33.460  24.745
  398    HG   SER 603           HG       SER 603  26.920  33.169  22.618
  399    H    ASN 604           H        ASN 604  29.140  35.809  26.596
  400    HA   ASN 604           HA       ASN 604  27.835  34.847  29.118
  401    HB2  ASN 604           HB2      ASN 604  30.624  35.032  28.004
  402    HB3  ASN 604           HB3      ASN 604  30.347  34.690  29.690
  403   HD21  ASN 604          HD22      ASN 604  31.684  32.869  28.652
  404   HD22  ASN 604          HD21      ASN 604  30.788  31.482  28.051
  405    H    ILE 605           H        ILE 605  28.308  37.653  27.487
  406    HA   ILE 605           HA       ILE 605  28.496  39.257  30.017
  407    HB   ILE 605           HB       ILE 605  29.031  40.237  27.218
  408   HG12  ILE 605          HG12      ILE 605  31.217  39.975  29.316
  409   HG13  ILE 605          HG13      ILE 605  30.772  38.525  28.404
  410   HG21  ILE 605          HG21      ILE 605  28.279  42.037  28.488
  411   HG22  ILE 605          HG22      ILE 605  29.123  41.490  29.944
  412   HG23  ILE 605          HG23      ILE 605  30.041  42.153  28.535
  413   HD11  ILE 605          HD11      ILE 605  31.595  41.157  27.150
  414   HD12  ILE 605          HD12      ILE 605  32.621  39.715  27.335
  415   HD13  ILE 605          HD13      ILE 605  31.189  39.648  26.292
  416    H    LYS 606           H        LYS 606  26.515  39.719  30.568
  417    HA   LYS 606           HA       LYS 606  24.212  40.001  28.713
  418    HB2  LYS 606           HB2      LYS 606  24.556  39.899  31.736
  419    HB3  LYS 606           HB3      LYS 606  23.002  40.229  30.948
  420    HG2  LYS 606           HG2      LYS 606  23.161  38.056  29.757
  421    HG3  LYS 606           HG3      LYS 606  24.651  37.676  30.577
  422    HD2  LYS 606           HD2      LYS 606  23.045  36.502  31.828
  423    HD3  LYS 606           HD3      LYS 606  23.236  37.935  32.821
  424    HE2  LYS 606           HE2      LYS 606  21.310  39.025  31.782
  425    HE3  LYS 606           HE3      LYS 606  21.119  37.700  30.644
  426    HZ1  LYS 606           HZ1      LYS 606  19.544  37.266  32.257
  427    HZ2  LYS 606           HZ2      LYS 606  20.750  36.362  32.841
  428    HZ3  LYS 606           HZ3      LYS 606  20.429  37.831  33.488
  429    HA   PRO 607           HA       PRO 607  24.258  44.537  28.860
  430    HB2  PRO 607           HB2      PRO 607  21.613  45.181  29.029
  431    HB3  PRO 607           HB3      PRO 607  22.404  44.810  27.483
  432    HG2  PRO 607           HG2      PRO 607  20.725  42.990  29.221
  433    HG3  PRO 607           HG3      PRO 607  20.737  43.138  27.443
  434    HD2  PRO 607           HD2      PRO 607  22.077  41.083  28.728
  435    HD3  PRO 607           HD3      PRO 607  22.770  41.861  27.289
  436    H    ILE 608           H        ILE 608  23.646  46.320  30.316
  437    HA   ILE 608           HA       ILE 608  23.283  45.322  33.059
  438    HB   ILE 608           HB       ILE 608  24.956  47.192  31.930
  439   HG12  ILE 608          HG12      ILE 608  24.118  46.913  34.828
  440   HG13  ILE 608          HG13      ILE 608  25.203  45.805  33.961
  441   HG21  ILE 608          HG21      ILE 608  23.126  48.786  33.716
  442   HG22  ILE 608          HG22      ILE 608  24.506  49.359  32.737
  443   HG23  ILE 608          HG23      ILE 608  23.012  48.887  31.934
  444   HD11  ILE 608          HD11      ILE 608  25.762  48.689  34.708
  445   HD12  ILE 608          HD12      ILE 608  26.574  47.230  35.294
  446   HD13  ILE 608          HD13      ILE 608  26.792  47.726  33.608
  447    H    LEU 609           H        LEU 609  21.517  47.281  30.710
  448    HA   LEU 609           HA       LEU 609  19.220  47.348  32.533
  449    HB2  LEU 609           HB2      LEU 609  20.375  49.471  32.036
  450    HB3  LEU 609           HB3      LEU 609  20.118  49.275  30.318
  451    HG   LEU 609           HG       LEU 609  18.710  50.926  31.679
  452   HD11  LEU 609          HD11      LEU 609  16.783  50.660  30.251
  453   HD12  LEU 609          HD12      LEU 609  18.273  50.369  29.317
  454   HD13  LEU 609          HD13      LEU 609  17.268  48.998  29.832
  455   HD21  LEU 609          HD21      LEU 609  17.041  48.422  32.097
  456   HD22  LEU 609          HD22      LEU 609  18.003  49.139  33.395
  457   HD23  LEU 609          HD23      LEU 609  16.669  50.073  32.674
  458    H    GLU 610           H        GLU 610  17.888  45.732  32.018
  459    HA   GLU 610           HA       GLU 610  16.735  45.561  29.315
  460    HB2  GLU 610           HB2      GLU 610  18.512  43.866  29.515
  461    HB3  GLU 610           HB3      GLU 610  17.820  43.277  31.019
  462    HG2  GLU 610           HG2      GLU 610  15.702  42.712  29.754
  463    HG3  GLU 610           HG3      GLU 610  16.497  43.263  28.274
  464    H1   TYR 611           H1       TYR 611  32.644  37.124  52.978
  465    H2   TYR 611           H2       TYR 611  31.392  37.419  51.961
  466    H3   TYR 611           H3       TYR 611  32.216  38.644  52.670
  467    HA   TYR 611           HA       TYR 611  34.177  38.284  51.515
  468    HB2  TYR 611           HB2      TYR 611  32.715  36.131  49.924
  469    HB3  TYR 611           HB3      TYR 611  34.337  36.733  49.635
  470    HD1  TYR 611           HD2      TYR 611  35.587  37.014  52.153
  471    HD2  TYR 611           HD1      TYR 611  32.976  33.857  50.795
  472    HE1  TYR 611           HE2      TYR 611  36.421  35.532  53.982
  473    HE2  TYR 611           HE1      TYR 611  34.131  32.278  52.331
  474    HH   TYR 611           HH       TYR 611  35.205  32.206  54.228
  475    H    SER 612           H        SER 612  34.625  39.671  50.110
  476    HA   SER 612           HA       SER 612  32.501  40.916  48.472
  477    HB2  SER 612           HB2      SER 612  33.070  43.147  49.451
  478    HB3  SER 612           HB3      SER 612  32.659  42.034  50.750
  479    HG   SER 612           HG       SER 612  34.676  42.070  51.355
  480    HA   PRO 613           HA       PRO 613  35.512  41.675  45.284
  481    HB2  PRO 613           HB2      PRO 613  35.479  44.623  45.626
  482    HB3  PRO 613           HB3      PRO 613  35.125  43.635  44.181
  483    HG2  PRO 613           HG2      PRO 613  33.226  44.857  45.786
  484    HG3  PRO 613           HG3      PRO 613  32.892  43.436  44.754
  485    HD2  PRO 613           HD2      PRO 613  33.216  43.695  47.669
  486    HD3  PRO 613           HD3      PRO 613  32.436  42.329  46.781
  487    H    SER 614           H        SER 614  36.366  43.035  48.409
  488    HA   SER 614           HA       SER 614  39.146  43.426  47.903
  489    HB2  SER 614           HB2      SER 614  37.776  42.518  50.447
  490    HB3  SER 614           HB3      SER 614  39.419  43.178  50.326
  491    HG   SER 614           HG       SER 614  37.027  44.510  49.680
  492    H    SER 615           H        SER 615  37.438  40.431  47.609
  493    HA   SER 615           HA       SER 615  39.101  38.472  48.589
  494    HB2  SER 615           HB2      SER 615  37.014  38.136  47.182
  495    HB3  SER 615           HB3      SER 615  37.981  38.421  45.729
  496    HG   SER 615           HG       SER 615  37.811  36.270  47.255
  497    HA   PRO 616           HA       PRO 616  43.025  39.235  46.582
  498    HB2  PRO 616           HB2      PRO 616  44.332  36.790  46.803
  499    HB3  PRO 616           HB3      PRO 616  44.043  38.017  48.075
  500    HG2  PRO 616           HG2      PRO 616  42.606  35.462  47.589
  501    HG3  PRO 616           HG3      PRO 616  43.148  36.224  49.116
  502    HD2  PRO 616           HD2      PRO 616  40.562  36.377  48.038
  503    HD3  PRO 616           HD3      PRO 616  41.206  37.551  49.213
  504   HC11  DA2 617          HC11      DA2 617  37.088  40.382  39.380
  505   HC12  DA2 617          HC12      DA2 617  36.965  38.944  38.327
  506   HC13  DA2 617          HC13      DA2 617  35.510  39.704  38.990
  507   HC21  DA2 617          HC21      DA2 617  35.038  38.194  41.641
  508   HC22  DA2 617          HC22      DA2 617  35.500  36.793  40.624
  509   HC23  DA2 617          HC23      DA2 617  34.558  38.111  39.927
  510    H2   DA2 617           H        DA2 617  43.163  39.714  44.539
  511    HA   DA2 617           HA       DA2 617  42.388  37.874  42.331
  512   HCB1  DA2 617          HCB1      DA2 617  42.669  40.144  41.033
  513   HCB2  DA2 617          HCB2      DA2 617  42.690  40.895  42.587
  514   HCG1  DA2 617          HCG1      DA2 617  40.451  40.241  43.070
  515   HCG2  DA2 617          HCG2      DA2 617  40.485  40.830  41.419
  516   HCD1  DA2 617          HCD1      DA2 617  40.787  38.155  40.876
  517   HCD2  DA2 617          HCD2      DA2 617  39.991  38.023  42.437
  518    HNE  DA2 617           HNE      DA2 617  38.954  39.520  40.026
  519   HNH2  DA2 617          HNH2      DA2 617  38.409  37.145  42.681
  520   HNH1  DA2 617          HNH1      DA2 617  36.759  36.925  42.290
  521    H    TYR 618           H        TYR 618  43.695  37.955  40.358
  522    HA   TYR 618           HA       TYR 618  46.570  37.406  40.882
  523    HB2  TYR 618           HB2      TYR 618  45.030  37.062  38.334
  524    HB3  TYR 618           HB3      TYR 618  46.578  36.346  38.781
  525    HD1  TYR 618           HD1      TYR 618  46.563  34.680  40.861
  526    HD2  TYR 618           HD2      TYR 618  43.070  35.907  38.644
  527    HE1  TYR 618           HE1      TYR 618  45.252  32.854  41.909
  528    HE2  TYR 618           HE2      TYR 618  41.716  34.203  39.822
  529    HH   TYR 618           HH       TYR 618  41.783  32.500  41.229
  530    H    THR 619           H        THR 619  44.637  39.809  39.128
  531    HA   THR 619           HA       THR 619  45.367  41.863  38.153
  532    HB   THR 619           HB       THR 619  47.116  42.945  39.682
  533    HG1  THR 619           HG1      THR 619  47.664  41.856  41.406
  534   HG21  THR 619          HG21      THR 619  44.822  43.554  39.786
  535   HG22  THR 619          HG22      THR 619  44.323  41.947  40.374
  536   HG23  THR 619          HG23      THR 619  45.121  43.061  41.460
  537    HA   PRO 620           HA       PRO 620  49.119  40.136  35.920
  538    HB2  PRO 620           HB2      PRO 620  48.063  39.934  33.449
  539    HB3  PRO 620           HB3      PRO 620  47.941  38.599  34.650
  540    HG2  PRO 620           HG2      PRO 620  45.806  40.534  33.818
  541    HG3  PRO 620           HG3      PRO 620  45.617  38.824  34.220
  542    HD2  PRO 620           HD2      PRO 620  45.048  40.814  35.978
  543    HD3  PRO 620           HD3      PRO 620  45.568  39.211  36.493
  544    H    GLN 621           H        GLN 621  50.511  41.813  35.595
  545    HA   GLN 621           HA       GLN 621  49.817  44.079  33.922
  546    HB2  GLN 621           HB2      GLN 621  48.821  44.629  36.304
  547    HB3  GLN 621           HB3      GLN 621  50.467  44.611  36.881
  548    HG2  GLN 621           HG2      GLN 621  50.957  46.623  35.315
  549    HG3  GLN 621           HG3      GLN 621  49.244  46.591  34.919
  550   HE21  GLN 621          HE22      GLN 621  47.768  47.347  36.350
  551   HE22  GLN 621          HE21      GLN 621  48.206  48.108  37.875
  552    H    SER 622           H        SER 622  51.532  45.159  33.221
  553    HA   SER 622           HA       SER 622  53.704  45.375  32.467
  554    HB2  SER 622           HB2      SER 622  54.239  45.925  35.395
  555    HB3  SER 622           HB3      SER 622  55.208  46.332  33.984
  556    HG   SER 622           HG       SER 622  54.091  48.025  34.299
  557    HA   PRO 623           HA       PRO 623  54.802  40.881  33.465
  558    HB2  PRO 623           HB2      PRO 623  56.128  41.187  30.844
  559    HB3  PRO 623           HB3      PRO 623  55.040  39.901  31.401
  560    HG2  PRO 623           HG2      PRO 623  54.420  42.135  29.762
  561    HG3  PRO 623           HG3      PRO 623  53.212  41.017  30.492
  562    HD2  PRO 623           HD2      PRO 623  53.537  43.749  31.108
  563    HD3  PRO 623           HD3      PRO 623  52.558  42.536  31.975
  Start of MODEL   17
    1    H1   MET 553           H1       MET 553  30.797  41.829  16.234
    2    H2   MET 553           H2       MET 553  29.737  42.095  15.001
    3    H3   MET 553           H3       MET 553  30.638  40.750  15.020
    4    HA   MET 553           HA       MET 553  28.564  40.100  15.653
    5    HB2  MET 553           HB2      MET 553  30.466  40.373  18.032
    6    HB3  MET 553           HB3      MET 553  28.890  39.590  18.150
    7    HG2  MET 553           HG2      MET 553  30.424  37.955  18.058
    8    HG3  MET 553           HG3      MET 553  29.599  37.906  16.519
    9    HE1  MET 553           HE1      MET 553  33.150  38.225  18.392
   10    HE2  MET 553           HE2      MET 553  34.091  39.124  17.201
   11    HE3  MET 553           HE3      MET 553  32.741  39.910  18.053
   12    H    LYS 554           H        LYS 554  26.763  41.599  15.670
   13    HA   LYS 554           HA       LYS 554  26.835  44.108  17.036
   14    HB2  LYS 554           HB2      LYS 554  25.823  43.386  14.832
   15    HB3  LYS 554           HB3      LYS 554  24.415  42.815  15.746
   16    HG2  LYS 554           HG2      LYS 554  23.750  45.103  16.211
   17    HG3  LYS 554           HG3      LYS 554  25.389  45.677  15.915
   18    HD2  LYS 554           HD2      LYS 554  23.969  46.348  14.058
   19    HD3  LYS 554           HD3      LYS 554  25.092  45.109  13.477
   20    HE2  LYS 554           HE2      LYS 554  23.267  43.424  13.700
   21    HE3  LYS 554           HE3      LYS 554  22.170  44.699  14.220
   22    HZ1  LYS 554           HZ1      LYS 554  22.564  45.763  11.976
   23    HZ2  LYS 554           HZ2      LYS 554  23.471  44.476  11.562
   24    HZ3  LYS 554           HZ3      LYS 554  21.908  44.324  11.852
   25    H    MET 555           H        MET 555  25.595  41.094  18.347
   26    HA   MET 555           HA       MET 555  23.636  42.237  20.020
   27    HB2  MET 555           HB2      MET 555  23.390  40.232  21.082
   28    HB3  MET 555           HB3      MET 555  24.004  39.772  19.521
   29    HG2  MET 555           HG2      MET 555  25.646  39.892  22.082
   30    HG3  MET 555           HG3      MET 555  24.976  38.446  21.363
   31    HE1  MET 555           HE1      MET 555  27.420  37.204  18.907
   32    HE2  MET 555           HE2      MET 555  26.899  36.815  20.557
   33    HE3  MET 555           HE3      MET 555  25.693  37.268  19.340
   34    H    TRP 556           H        TRP 556  27.035  42.609  20.295
   35    HA   TRP 556           HA       TRP 556  26.581  44.563  22.509
   36    HB2  TRP 556           HB2      TRP 556  28.735  42.444  22.225
   37    HB3  TRP 556           HB3      TRP 556  28.981  43.870  23.224
   38    HD1  TRP 556           HD1      TRP 556  28.054  40.417  23.757
   39    HE1  TRP 556           HE1      TRP 556  26.862  40.110  25.915
   40    HE3  TRP 556           HE3      TRP 556  26.535  45.301  24.551
   41    HZ2  TRP 556           HZ2      TRP 556  25.522  41.764  27.923
   42    HZ3  TRP 556           HZ3      TRP 556  25.462  45.884  26.671
   43    HH2  TRP 556           HH2      TRP 556  24.898  44.163  28.326
   44    H    LYS 557           H        LYS 557  28.386  46.163  22.767
   45    HA   LYS 557           HA       LYS 557  30.214  46.799  20.641
   46    HB2  LYS 557           HB2      LYS 557  27.561  48.229  20.717
   47    HB3  LYS 557           HB3      LYS 557  28.932  49.278  20.779
   48    HG2  LYS 557           HG2      LYS 557  29.930  48.284  18.770
   49    HG3  LYS 557           HG3      LYS 557  28.581  47.170  18.580
   50    HD2  LYS 557           HD2      LYS 557  27.038  48.810  18.053
   51    HD3  LYS 557           HD3      LYS 557  28.048  50.135  18.689
   52    HE2  LYS 557           HE2      LYS 557  29.632  49.833  16.832
   53    HE3  LYS 557           HE3      LYS 557  28.703  48.487  16.216
   54    HZ1  LYS 557           HZ1      LYS 557  28.202  50.722  15.108
   55    HZ2  LYS 557           HZ2      LYS 557  26.998  49.807  15.524
   56    HZ3  LYS 557           HZ3      LYS 557  27.329  51.097  16.452
   57    HA   PRO 558           HA       PRO 558  32.385  48.384  24.041
   58    HB2  PRO 558           HB2      PRO 558  33.865  50.400  23.299
   59    HB3  PRO 558           HB3      PRO 558  34.037  48.805  22.528
   60    HG2  PRO 558           HG2      PRO 558  32.456  51.139  21.432
   61    HG3  PRO 558           HG3      PRO 558  33.643  50.121  20.549
   62    HD2  PRO 558           HD2      PRO 558  30.973  49.705  20.411
   63    HD3  PRO 558           HD3      PRO 558  32.092  48.340  20.356
   64    H    GLY 559           H        GLY 559  32.826  50.097  25.662
   65    HA2  GLY 559           HA2      GLY 559  32.215  51.642  27.208
   66    HA3  GLY 559           HA3      GLY 559  31.517  52.603  25.927
   67    H    ASP 560           H        ASP 560  30.613  49.522  27.724
   68    HA   ASP 560           HA       ASP 560  28.055  50.843  28.337
   69    HB2  ASP 560           HB2      ASP 560  27.909  49.516  26.115
   70    HB3  ASP 560           HB3      ASP 560  28.021  48.051  27.037
   71    H    GLU 561           H        GLU 561  27.735  50.664  30.470
   72    HA   GLU 561           HA       GLU 561  29.009  48.535  32.010
   73    HB2  GLU 561           HB2      GLU 561  27.893  49.242  34.018
   74    HB3  GLU 561           HB3      GLU 561  28.359  50.706  33.137
   75    HG2  GLU 561           HG2      GLU 561  25.990  50.801  32.336
   76    HG3  GLU 561           HG3      GLU 561  25.623  49.413  33.388
   77    H    CYS 562           H        CYS 562  28.479  46.583  32.517
   78    HA   CYS 562           HA       CYS 562  25.820  45.477  31.985
   79    HB2  CYS 562           HB2      CYS 562  28.340  44.400  30.586
   80    HB3  CYS 562           HB3      CYS 562  26.683  43.839  30.402
   81    HG   CYS 562           HG       CYS 562  27.914  46.837  29.514
   82    H    PHE 563           H        PHE 563  26.237  42.830  32.288
   83    HA   PHE 563           HA       PHE 563  27.927  42.431  34.724
   84    HB2  PHE 563           HB2      PHE 563  25.121  41.448  34.081
   85    HB3  PHE 563           HB3      PHE 563  26.203  40.397  34.887
   86    HD1  PHE 563           HD1      PHE 563  27.056  40.884  37.245
   87    HD2  PHE 563           HD2      PHE 563  24.208  43.438  35.256
   88    HE1  PHE 563           HE1      PHE 563  26.563  42.016  39.383
   89    HE2  PHE 563           HE2      PHE 563  23.603  44.446  37.486
   90    HZ   PHE 563           HZ       PHE 563  24.867  43.815  39.493
   91    H    ALA 564           H        ALA 564  29.436  40.900  34.514
   92    HA   ALA 564           HA       ALA 564  29.401  39.264  32.022
   93    HB1  ALA 564           HB1      ALA 564  31.669  40.807  33.393
   94    HB2  ALA 564           HB2      ALA 564  31.906  39.641  32.101
   95    HB3  ALA 564           HB3      ALA 564  30.940  41.155  31.824
   96    H    LEU 565           H        LEU 565  29.883  37.223  32.114
   97    HA   LEU 565           HA       LEU 565  29.789  35.933  34.668
   98    HB2  LEU 565           HB2      LEU 565  28.631  35.225  32.526
   99    HB3  LEU 565           HB3      LEU 565  30.203  34.619  31.966
  100    HG   LEU 565           HG       LEU 565  30.195  32.845  33.529
  101   HD11  LEU 565          HD11      LEU 565  28.041  34.456  34.960
  102   HD12  LEU 565          HD12      LEU 565  28.245  32.732  35.285
  103   HD13  LEU 565          HD13      LEU 565  29.598  33.846  35.580
  104   HD21  LEU 565          HD21      LEU 565  28.026  31.741  33.115
  105   HD22  LEU 565          HD22      LEU 565  27.333  33.272  32.553
  106   HD23  LEU 565          HD23      LEU 565  28.672  32.541  31.658
  107    H    TYR 566           H        TYR 566  31.450  35.812  35.875
  108    HA   TYR 566           HA       TYR 566  34.181  35.683  35.044
  109    HB2  TYR 566           HB2      TYR 566  33.235  36.590  37.240
  110    HB3  TYR 566           HB3      TYR 566  33.232  34.910  37.804
  111    HD1  TYR 566           HD1      TYR 566  35.697  36.919  35.724
  112    HD2  TYR 566           HD2      TYR 566  34.953  34.780  39.381
  113    HE1  TYR 566           HE1      TYR 566  38.061  37.201  36.347
  114    HE2  TYR 566           HE2      TYR 566  37.375  34.962  39.959
  115    HH   TYR 566           HH       TYR 566  39.761  36.475  37.907
  116    H    TRP 567           H        TRP 567  35.428  33.641  36.429
  117    HA   TRP 567           HA       TRP 567  34.480  31.206  34.903
  118    HB2  TRP 567           HB2      TRP 567  36.781  30.881  34.180
  119    HB3  TRP 567           HB3      TRP 567  36.191  32.436  33.557
  120    HD1  TRP 567           HD1      TRP 567  37.445  34.589  34.475
  121    HE1  TRP 567           HE1      TRP 567  39.496  34.966  35.960
  122    HE3  TRP 567           HE3      TRP 567  38.388  29.775  35.790
  123    HZ2  TRP 567           HZ2      TRP 567  40.917  33.406  38.074
  124    HZ3  TRP 567           HZ3      TRP 567  40.064  29.229  37.538
  125    HH2  TRP 567           HH2      TRP 567  41.244  31.023  38.736
  126    H    GLU 568           H        GLU 568  36.322  32.596  37.546
  127    HA   GLU 568           HA       GLU 568  37.381  30.377  38.822
  128    HB2  GLU 568           HB2      GLU 568  37.910  32.565  39.526
  129    HB3  GLU 568           HB3      GLU 568  36.206  33.026  39.594
  130    HG2  GLU 568           HG2      GLU 568  37.118  33.068  41.804
  131    HG3  GLU 568           HG3      GLU 568  35.887  31.880  41.747
  132    H    ASP 569           H        ASP 569  34.143  31.757  39.138
  133    HA   ASP 569           HA       ASP 569  33.170  29.497  40.761
  134    HB2  ASP 569           HB2      ASP 569  31.693  31.348  41.891
  135    HB3  ASP 569           HB3      ASP 569  33.359  31.222  42.389
  136    H    ASN 570           H        ASN 570  32.823  31.312  37.972
  137    HA   ASN 570           HA       ASN 570  31.308  31.622  36.362
  138    HB2  ASN 570           HB2      ASN 570  31.425  29.018  36.754
  139    HB3  ASN 570           HB3      ASN 570  29.836  29.227  37.484
  140   HD21  ASN 570          HD22      ASN 570  28.541  28.177  36.192
  141   HD22  ASN 570          HD21      ASN 570  28.259  28.556  34.501
  142    H    LYS 571           H        LYS 571  30.908  33.297  38.433
  143    HA   LYS 571           HA       LYS 571  27.999  33.766  38.271
  144    HB2  LYS 571           HB2      LYS 571  29.952  33.891  40.574
  145    HB3  LYS 571           HB3      LYS 571  29.077  35.350  40.430
  146    HG2  LYS 571           HG2      LYS 571  27.893  32.574  40.829
  147    HG3  LYS 571           HG3      LYS 571  27.914  33.904  41.961
  148    HD2  LYS 571           HD2      LYS 571  26.496  35.245  40.246
  149    HD3  LYS 571           HD3      LYS 571  26.324  33.750  39.333
  150    HE2  LYS 571           HE2      LYS 571  25.301  32.714  41.431
  151    HE3  LYS 571           HE3      LYS 571  25.335  34.341  42.122
  152    HZ1  LYS 571           HZ1      LYS 571  23.952  33.707  39.576
  153    HZ2  LYS 571           HZ2      LYS 571  23.202  33.799  41.041
  154    HZ3  LYS 571           HZ3      LYS 571  23.907  35.091  40.348
  155    H    PHE 572           H        PHE 572  27.228  35.885  37.985
  156    HA   PHE 572           HA       PHE 572  29.018  37.477  36.298
  157    HB2  PHE 572           HB2      PHE 572  26.138  38.110  37.050
  158    HB3  PHE 572           HB3      PHE 572  27.087  38.830  35.778
  159    HD1  PHE 572           HD1      PHE 572  25.240  35.871  36.837
  160    HD2  PHE 572           HD2      PHE 572  27.415  37.690  33.618
  161    HE1  PHE 572           HE1      PHE 572  24.371  34.133  35.286
  162    HE2  PHE 572           HE2      PHE 572  26.395  36.038  32.007
  163    HZ   PHE 572           HZ       PHE 572  24.983  34.221  32.853
  164    H    TYR 573           H        TYR 573  30.088  39.145  36.850
  165    HA   TYR 573           HA       TYR 573  29.483  40.686  39.325
  166    HB2  TYR 573           HB2      TYR 573  32.168  40.243  37.948
  167    HB3  TYR 573           HB3      TYR 573  31.899  41.229  39.365
  168    HD1  TYR 573           HD2      TYR 573  31.759  37.735  38.089
  169    HD2  TYR 573           HD1      TYR 573  31.558  40.271  41.563
  170    HE1  TYR 573           HE2      TYR 573  32.071  35.739  39.562
  171    HE2  TYR 573           HE1      TYR 573  31.817  38.289  43.027
  172    HH   TYR 573           HH       TYR 573  32.449  35.100  41.776
  173    H    ARG 574           H        ARG 574  29.593  43.024  39.028
  174    HA   ARG 574           HA       ARG 574  28.679  44.091  36.521
  175    HB2  ARG 574           HB2      ARG 574  29.942  45.399  38.983
  176    HB3  ARG 574           HB3      ARG 574  29.266  46.296  37.619
  177    HG2  ARG 574           HG2      ARG 574  27.051  45.197  38.053
  178    HG3  ARG 574           HG3      ARG 574  27.718  44.413  39.463
  179    HD2  ARG 574           HD2      ARG 574  26.508  46.500  40.202
  180    HD3  ARG 574           HD3      ARG 574  28.172  46.478  40.610
  181    HE   ARG 574           HE       ARG 574  28.614  48.285  39.163
  182   HH11  ARG 574          HH11      ARG 574  25.311  47.312  38.888
  183   HH12  ARG 574          HH12      ARG 574  24.838  48.683  37.948
  184   HH21  ARG 574          HH21      ARG 574  28.119  49.952  37.778
  185   HH22  ARG 574          HH22      ARG 574  26.556  50.010  37.034
  186    H    ALA 575           H        ALA 575  29.637  45.280  34.905
  187    HA   ALA 575           HA       ALA 575  32.519  45.621  34.908
  188    HB1  ALA 575           HB1      ALA 575  31.240  43.690  32.909
  189    HB2  ALA 575           HB2      ALA 575  32.920  44.258  32.921
  190    HB3  ALA 575           HB3      ALA 575  32.340  43.216  34.231
  191    H    GLU 576           H        GLU 576  33.029  47.370  33.825
  192    HA   GLU 576           HA       GLU 576  31.198  48.591  31.850
  193    HB2  GLU 576           HB2      GLU 576  33.995  49.487  32.691
  194    HB3  GLU 576           HB3      GLU 576  32.911  50.204  31.471
  195    HG2  GLU 576           HG2      GLU 576  31.259  50.370  33.574
  196    HG3  GLU 576           HG3      GLU 576  32.799  50.323  34.435
  197    H    VAL 577           H        VAL 577  31.031  47.640  29.933
  198    HA   VAL 577           HA       VAL 577  32.861  45.938  28.596
  199    HB   VAL 577           HB       VAL 577  30.619  47.722  27.856
  200   HG11  VAL 577          HG11      VAL 577  32.634  46.567  25.878
  201   HG12  VAL 577          HG12      VAL 577  30.930  46.783  25.445
  202   HG13  VAL 577          HG13      VAL 577  31.924  48.171  26.006
  203   HG21  VAL 577          HG21      VAL 577  30.255  45.458  28.795
  204   HG22  VAL 577          HG22      VAL 577  29.522  45.729  27.206
  205   HG23  VAL 577          HG23      VAL 577  30.989  44.745  27.335
  206    H    GLU 578           H        GLU 578  34.780  46.322  27.532
  207    HA   GLU 578           HA       GLU 578  35.534  49.155  26.975
  208    HB2  GLU 578           HB2      GLU 578  37.151  47.987  28.561
  209    HB3  GLU 578           HB3      GLU 578  37.395  46.761  27.329
  210    HG2  GLU 578           HG2      GLU 578  39.250  48.336  27.441
  211    HG3  GLU 578           HG3      GLU 578  38.482  48.405  25.869
  212    H    ALA 579           H        ALA 579  35.739  45.792  25.556
  213    HA   ALA 579           HA       ALA 579  35.280  46.987  22.955
  214    HB1  ALA 579           HB1      ALA 579  37.689  47.559  23.353
  215    HB2  ALA 579           HB2      ALA 579  38.020  45.918  23.838
  216    HB3  ALA 579           HB3      ALA 579  37.619  46.256  22.128
  217    H    LEU 580           H        LEU 580  33.922  45.667  22.048
  218    HA   LEU 580           HA       LEU 580  33.979  42.780  22.763
  219    HB2  LEU 580           HB2      LEU 580  31.614  44.576  22.144
  220    HB3  LEU 580           HB3      LEU 580  31.501  42.873  22.509
  221    HG   LEU 580           HG       LEU 580  31.494  45.149  24.221
  222   HD11  LEU 580          HD11      LEU 580  30.527  42.406  24.422
  223   HD12  LEU 580          HD12      LEU 580  31.256  42.946  25.954
  224   HD13  LEU 580          HD13      LEU 580  29.984  43.886  25.210
  225   HD21  LEU 580          HD21      LEU 580  33.659  45.146  24.763
  226   HD22  LEU 580          HD22      LEU 580  32.899  44.378  26.130
  227   HD23  LEU 580          HD23      LEU 580  33.795  43.366  24.973
  228    H    HIS 581           H        HIS 581  35.648  42.997  21.006
  229    HA   HIS 581           HA       HIS 581  34.445  42.202  18.433
  230    HB2  HIS 581           HB2      HIS 581  34.929  44.746  18.614
  231    HB3  HIS 581           HB3      HIS 581  36.637  44.290  18.547
  232    HD2  HIS 581           HD2      HIS 581  37.442  44.641  16.063
  233    HE1  HIS 581           HE1      HIS 581  34.054  43.125  14.000
  234    HE2  HIS 581           HE2      HIS 581  36.445  43.852  13.772
  235    H    SER 582           H        SER 582  36.196  41.033  20.831
  236    HA   SER 582           HA       SER 582  38.809  40.460  19.682
  237    HB2  SER 582           HB2      SER 582  37.424  39.385  22.194
  238    HB3  SER 582           HB3      SER 582  39.113  39.148  21.722
  239    HG   SER 582           HG       SER 582  39.114  40.932  22.932
  240    H    SER 583           H        SER 583  39.523  38.735  18.654
  241    HA   SER 583           HA       SER 583  39.768  36.761  17.675
  242    HB2  SER 583           HB2      SER 583  39.801  34.876  19.176
  243    HB3  SER 583           HB3      SER 583  40.343  36.341  20.002
  244    HG   SER 583           HG       SER 583  38.033  36.402  20.775
  245    H    GLY 584           H        GLY 584  36.938  37.780  17.332
  246    HA2  GLY 584           HA2      GLY 584  35.239  37.148  15.983
  247    HA3  GLY 584           HA3      GLY 584  35.909  35.485  15.870
  248    H    MET 585           H        MET 585  35.628  35.988  19.123
  249    HA   MET 585           HA       MET 585  32.749  35.299  19.261
  250    HB2  MET 585           HB2      MET 585  33.149  33.153  20.413
  251    HB3  MET 585           HB3      MET 585  33.678  33.169  18.753
  252    HG2  MET 585           HG2      MET 585  35.959  33.097  19.338
  253    HG3  MET 585           HG3      MET 585  35.689  33.936  20.857
  254    HE1  MET 585           HE1      MET 585  36.913  30.845  22.611
  255    HE2  MET 585           HE2      MET 585  37.673  31.648  21.192
  256    HE3  MET 585           HE3      MET 585  36.977  32.620  22.494
  257    H    THR 586           H        THR 586  35.500  36.738  20.921
  258    HA   THR 586           HA       THR 586  34.034  36.733  23.536
  259    HB   THR 586           HB       THR 586  36.197  37.192  24.535
  260    HG1  THR 586           HG1      THR 586  37.989  36.833  23.287
  261   HG21  THR 586          HG21      THR 586  35.234  34.935  24.503
  262   HG22  THR 586          HG22      THR 586  36.209  34.556  23.062
  263   HG23  THR 586          HG23      THR 586  36.995  35.002  24.601
  264    H    ALA 587           H        ALA 587  35.000  38.632  24.799
  265    HA   ALA 587           HA       ALA 587  34.953  41.318  23.571
  266    HB1  ALA 587           HB1      ALA 587  32.934  41.429  25.484
  267    HB2  ALA 587           HB2      ALA 587  32.647  41.248  23.712
  268    HB3  ALA 587           HB3      ALA 587  32.633  39.849  24.782
  269    H    VAL 588           H        VAL 588  35.814  42.793  24.903
  270    HA   VAL 588           HA       VAL 588  37.197  41.792  27.357
  271    HB   VAL 588           HB       VAL 588  37.847  44.373  25.949
  272   HG11  VAL 588          HG11      VAL 588  39.184  42.644  28.038
  273   HG12  VAL 588          HG12      VAL 588  40.136  43.739  27.031
  274   HG13  VAL 588          HG13      VAL 588  38.803  44.385  27.998
  275   HG21  VAL 588          HG21      VAL 588  39.769  43.080  24.837
  276   HG22  VAL 588          HG22      VAL 588  38.932  41.585  25.337
  277   HG23  VAL 588          HG23      VAL 588  38.185  42.718  24.181
  278    H    VAL 589           H        VAL 589  36.578  42.554  29.232
  279    HA   VAL 589           HA       VAL 589  34.828  44.949  29.457
  280    HB   VAL 589           HB       VAL 589  33.411  43.745  30.989
  281   HG11  VAL 589          HG11      VAL 589  32.001  42.862  29.441
  282   HG12  VAL 589          HG12      VAL 589  33.046  43.848  28.427
  283   HG13  VAL 589          HG13      VAL 589  33.308  42.086  28.499
  284   HG21  VAL 589          HG21      VAL 589  34.342  41.793  31.960
  285   HG22  VAL 589          HG22      VAL 589  33.646  40.956  30.579
  286   HG23  VAL 589          HG23      VAL 589  35.317  41.437  30.537
  287    H    LYS 590           H        LYS 590  35.121  46.125  31.371
  288    HA   LYS 590           HA       LYS 590  37.306  45.179  33.154
  289    HB2  LYS 590           HB2      LYS 590  37.877  47.340  32.286
  290    HB3  LYS 590           HB3      LYS 590  36.265  47.969  32.532
  291    HG2  LYS 590           HG2      LYS 590  36.621  47.975  34.995
  292    HG3  LYS 590           HG3      LYS 590  38.134  47.090  34.806
  293    HD2  LYS 590           HD2      LYS 590  39.226  48.946  33.768
  294    HD3  LYS 590           HD3      LYS 590  37.725  49.844  33.613
  295    HE2  LYS 590           HE2      LYS 590  38.042  49.202  36.413
  296    HE3  LYS 590           HE3      LYS 590  39.639  49.656  35.823
  297    HZ1  LYS 590           HZ1      LYS 590  37.234  51.343  35.613
  298    HZ2  LYS 590           HZ2      LYS 590  38.549  51.570  36.601
  299    HZ3  LYS 590           HZ3      LYS 590  38.702  51.692  35.003
  300    H    PHE 591           H        PHE 591  36.690  44.134  34.887
  301    HA   PHE 591           HA       PHE 591  34.170  44.251  36.114
  302    HB2  PHE 591           HB2      PHE 591  36.930  43.496  37.092
  303    HB3  PHE 591           HB3      PHE 591  35.449  43.180  38.013
  304    HD1  PHE 591           HD2      PHE 591  33.488  42.068  36.497
  305    HD2  PHE 591           HD1      PHE 591  37.725  41.662  35.778
  306    HE1  PHE 591           HE2      PHE 591  33.095  39.885  35.416
  307    HE2  PHE 591           HE1      PHE 591  37.301  39.526  34.582
  308    HZ   PHE 591           HZ       PHE 591  34.971  38.673  34.343
  309    H    ILE 592           H        ILE 592  33.260  46.120  36.997
  310    HA   ILE 592           HA       ILE 592  34.705  48.460  37.387
  311    HB   ILE 592           HB       ILE 592  32.011  48.082  38.698
  312   HG12  ILE 592          HG12      ILE 592  32.576  47.966  35.729
  313   HG13  ILE 592          HG13      ILE 592  31.571  46.920  36.741
  314   HG21  ILE 592          HG21      ILE 592  32.954  50.305  36.863
  315   HG22  ILE 592          HG22      ILE 592  31.637  50.339  38.045
  316   HG23  ILE 592          HG23      ILE 592  33.308  50.371  38.605
  317   HD11  ILE 592          HD11      ILE 592  30.089  48.258  35.341
  318   HD12  ILE 592          HD12      ILE 592  29.970  48.878  37.004
  319   HD13  ILE 592          HD13      ILE 592  30.934  49.731  35.764
  320    H    ASP 593           H        ASP 593  34.180  45.966  39.783
  321    HA   ASP 593           HA       ASP 593  35.019  47.728  42.054
  322    HB2  ASP 593           HB2      ASP 593  33.093  45.878  42.128
  323    HB3  ASP 593           HB3      ASP 593  34.452  44.792  42.321
  324    H    TYR 594           H        TYR 594  36.354  45.271  39.948
  325    HA   TYR 594           HA       TYR 594  38.659  44.696  41.716
  326    HB2  TYR 594           HB2      TYR 594  37.694  43.512  39.138
  327    HB3  TYR 594           HB3      TYR 594  39.110  42.976  40.074
  328    HD1  TYR 594           HD1      TYR 594  35.389  43.261  40.068
  329    HD2  TYR 594           HD2      TYR 594  38.800  41.380  41.910
  330    HE1  TYR 594           HE1      TYR 594  33.878  41.848  41.337
  331    HE2  TYR 594           HE2      TYR 594  37.298  39.985  43.269
  332    HH   TYR 594           HH       TYR 594  33.785  40.296  43.238
  333    H    GLY 595           H        GLY 595  37.869  46.499  38.807
  334    HA2  GLY 595           HA2      GLY 595  38.941  48.339  38.024
  335    HA3  GLY 595           HA3      GLY 595  40.315  48.011  39.076
  336    H    ASN 596           H        ASN 596  39.272  45.812  36.387
  337    HA   ASN 596           HA       ASN 596  41.319  46.681  34.602
  338    HB2  ASN 596           HB2      ASN 596  42.821  44.656  34.875
  339    HB3  ASN 596           HB3      ASN 596  42.781  45.661  36.304
  340   HD21  ASN 596          HD22      ASN 596  42.204  44.714  38.270
  341   HD22  ASN 596          HD21      ASN 596  41.680  43.057  38.368
  342    H    TYR 597           H        TYR 597  41.539  44.868  32.705
  343    HA   TYR 597           HA       TYR 597  38.890  43.576  32.357
  344    HB2  TYR 597           HB2      TYR 597  38.724  44.570  30.039
  345    HB3  TYR 597           HB3      TYR 597  38.468  45.665  31.345
  346    HD1  TYR 597           HD2      TYR 597  39.963  47.255  32.153
  347    HD2  TYR 597           HD1      TYR 597  40.795  45.190  28.443
  348    HE1  TYR 597           HE2      TYR 597  41.760  48.837  31.693
  349    HE2  TYR 597           HE1      TYR 597  42.646  46.776  28.000
  350    HH   TYR 597           HH       TYR 597  43.609  48.862  28.748
  351    H    GLU 598           H        GLU 598  38.582  42.060  30.902
  352    HA   GLU 598           HA       GLU 598  40.817  40.694  29.653
  353    HB2  GLU 598           HB2      GLU 598  40.060  38.533  30.873
  354    HB3  GLU 598           HB3      GLU 598  41.110  39.638  31.724
  355    HG2  GLU 598           HG2      GLU 598  39.128  40.447  33.054
  356    HG3  GLU 598           HG3      GLU 598  38.111  39.262  32.218
  357    H    GLU 599           H        GLU 599  39.966  38.801  28.335
  358    HA   GLU 599           HA       GLU 599  37.402  39.431  27.214
  359    HB2  GLU 599           HB2      GLU 599  37.812  37.640  25.637
  360    HB3  GLU 599           HB3      GLU 599  39.175  38.775  25.781
  361    HG2  GLU 599           HG2      GLU 599  40.219  36.957  27.330
  362    HG3  GLU 599           HG3      GLU 599  39.060  35.862  26.558
  363    H    VAL 600           H        VAL 600  35.567  38.238  27.117
  364    HA   VAL 600           HA       VAL 600  34.930  35.630  28.428
  365    HB   VAL 600           HB       VAL 600  33.535  38.318  28.864
  366   HG11  VAL 600          HG11      VAL 600  32.753  35.437  29.519
  367   HG12  VAL 600          HG12      VAL 600  32.106  36.815  30.422
  368   HG13  VAL 600          HG13      VAL 600  31.837  36.693  28.669
  369   HG21  VAL 600          HG21      VAL 600  34.014  37.657  31.304
  370   HG22  VAL 600          HG22      VAL 600  35.214  36.531  30.569
  371   HG23  VAL 600          HG23      VAL 600  35.346  38.290  30.345
  372    H    LEU 601           H        LEU 601  33.382  34.518  27.089
  373    HA   LEU 601           HA       LEU 601  32.799  35.206  24.393
  374    HB2  LEU 601           HB2      LEU 601  32.354  33.046  25.957
  375    HB3  LEU 601           HB3      LEU 601  30.762  33.780  26.056
  376    HG   LEU 601           HG       LEU 601  30.627  32.056  24.545
  377   HD11  LEU 601          HD11      LEU 601  30.915  34.351  22.597
  378   HD12  LEU 601          HD12      LEU 601  30.031  32.836  22.409
  379   HD13  LEU 601          HD13      LEU 601  29.456  33.983  23.592
  380   HD21  LEU 601          HD21      LEU 601  32.971  32.998  22.886
  381   HD22  LEU 601          HD22      LEU 601  33.111  31.812  24.218
  382   HD23  LEU 601          HD23      LEU 601  32.100  31.455  22.823
  383    H    LEU 602           H        LEU 602  31.347  36.594  23.440
  384    HA   LEU 602           HA       LEU 602  29.846  38.587  24.608
  385    HB2  LEU 602           HB2      LEU 602  29.287  36.889  22.136
  386    HB3  LEU 602           HB3      LEU 602  28.500  38.394  22.414
  387    HG   LEU 602           HG       LEU 602  31.584  38.315  22.440
  388   HD11  LEU 602          HD11      LEU 602  29.712  38.650  20.101
  389   HD12  LEU 602          HD12      LEU 602  31.522  38.627  20.039
  390   HD13  LEU 602          HD13      LEU 602  30.603  37.158  20.400
  391   HD21  LEU 602          HD21      LEU 602  30.199  40.267  23.231
  392   HD22  LEU 602          HD22      LEU 602  31.393  40.608  21.950
  393   HD23  LEU 602          HD23      LEU 602  29.663  40.474  21.540
  394    H    SER 603           H        SER 603  28.823  35.210  24.323
  395    HA   SER 603           HA       SER 603  26.051  35.616  25.090
  396    HB2  SER 603           HB2      SER 603  25.999  33.163  25.402
  397    HB3  SER 603           HB3      SER 603  26.642  33.627  23.823
  398    HG   SER 603           HG       SER 603  28.115  32.807  26.115
  399    H    ASN 604           H        ASN 604  28.890  35.729  26.849
  400    HA   ASN 604           HA       ASN 604  27.811  34.568  29.389
  401    HB2  ASN 604           HB2      ASN 604  30.618  34.721  28.237
  402    HB3  ASN 604           HB3      ASN 604  30.322  34.540  29.943
  403   HD21  ASN 604          HD22      ASN 604  30.943  32.346  30.199
  404   HD22  ASN 604          HD21      ASN 604  30.116  31.037  29.414
  405    H    ILE 605           H        ILE 605  27.612  37.264  27.978
  406    HA   ILE 605           HA       ILE 605  27.985  38.892  30.425
  407    HB   ILE 605           HB       ILE 605  28.205  40.092  27.694
  408   HG12  ILE 605          HG12      ILE 605  30.827  39.634  29.145
  409   HG13  ILE 605          HG13      ILE 605  30.251  38.348  28.098
  410   HG21  ILE 605          HG21      ILE 605  27.690  41.461  29.595
  411   HG22  ILE 605          HG22      ILE 605  29.126  40.898  30.463
  412   HG23  ILE 605          HG23      ILE 605  29.307  41.886  28.988
  413   HD11  ILE 605          HD11      ILE 605  31.639  39.808  26.755
  414   HD12  ILE 605          HD12      ILE 605  29.959  39.994  26.228
  415   HD13  ILE 605          HD13      ILE 605  30.687  41.238  27.239
  416    H    LYS 606           H        LYS 606  26.152  39.481  30.995
  417    HA   LYS 606           HA       LYS 606  23.832  39.774  29.143
  418    HB2  LYS 606           HB2      LYS 606  23.849  38.883  32.058
  419    HB3  LYS 606           HB3      LYS 606  22.405  39.051  31.043
  420    HG2  LYS 606           HG2      LYS 606  24.605  37.013  30.520
  421    HG3  LYS 606           HG3      LYS 606  23.006  36.723  31.198
  422    HD2  LYS 606           HD2      LYS 606  21.911  37.438  29.169
  423    HD3  LYS 606           HD3      LYS 606  23.460  37.884  28.413
  424    HE2  LYS 606           HE2      LYS 606  24.181  35.427  29.048
  425    HE3  LYS 606           HE3      LYS 606  22.488  35.203  29.387
  426    HZ1  LYS 606           HZ1      LYS 606  23.333  36.198  26.727
  427    HZ2  LYS 606           HZ2      LYS 606  23.230  34.584  27.076
  428    HZ3  LYS 606           HZ3      LYS 606  21.928  35.510  27.154
  429    HA   PRO 607           HA       PRO 607  23.864  43.943  30.389
  430    HB2  PRO 607           HB2      PRO 607  21.358  44.806  29.777
  431    HB3  PRO 607           HB3      PRO 607  22.515  44.218  28.530
  432    HG2  PRO 607           HG2      PRO 607  20.252  42.721  29.906
  433    HG3  PRO 607           HG3      PRO 607  20.643  42.702  28.150
  434    HD2  PRO 607           HD2      PRO 607  21.422  40.763  29.934
  435    HD3  PRO 607           HD3      PRO 607  22.343  41.191  28.444
  436    H    ILE 608           H        ILE 608  23.279  45.534  31.751
  437    HA   ILE 608           HA       ILE 608  22.502  44.785  34.395
  438    HB   ILE 608           HB       ILE 608  23.885  46.968  33.016
  439   HG12  ILE 608          HG12      ILE 608  23.915  46.011  35.865
  440   HG13  ILE 608          HG13      ILE 608  24.780  45.287  34.486
  441   HG21  ILE 608          HG21      ILE 608  23.457  48.877  34.163
  442   HG22  ILE 608          HG22      ILE 608  21.827  48.300  33.880
  443   HG23  ILE 608          HG23      ILE 608  22.594  48.069  35.484
  444   HD11  ILE 608          HD11      ILE 608  25.407  48.124  35.373
  445   HD12  ILE 608          HD12      ILE 608  26.184  46.693  36.043
  446   HD13  ILE 608          HD13      ILE 608  26.315  47.020  34.310
  447    H    LEU 609           H        LEU 609  20.717  46.431  31.825
  448    HA   LEU 609           HA       LEU 609  18.224  46.157  33.438
  449    HB2  LEU 609           HB2      LEU 609  17.457  48.262  32.940
  450    HB3  LEU 609           HB3      LEU 609  19.094  48.480  33.483
  451    HG   LEU 609           HG       LEU 609  18.860  50.064  31.850
  452   HD11  LEU 609          HD11      LEU 609  20.988  48.825  31.686
  453   HD12  LEU 609          HD12      LEU 609  20.257  47.754  30.474
  454   HD13  LEU 609          HD13      LEU 609  20.490  49.481  30.126
  455   HD21  LEU 609          HD21      LEU 609  16.860  49.413  30.640
  456   HD22  LEU 609          HD22      LEU 609  18.139  49.553  29.448
  457   HD23  LEU 609          HD23      LEU 609  17.681  47.955  30.006
  458    H    GLU 610           H        GLU 610  16.268  46.627  32.026
  459    HA   GLU 610           HA       GLU 610  15.965  45.269  29.523
  460    HB2  GLU 610           HB2      GLU 610  14.877  43.212  30.398
  461    HB3  GLU 610           HB3      GLU 610  16.559  43.313  30.848
  462    HG2  GLU 610           HG2      GLU 610  16.090  43.709  33.129
  463    HG3  GLU 610           HG3      GLU 610  14.447  44.229  32.834
  464    H1   TYR 611           H1       TYR 611  49.411  43.758  29.942
  465    H2   TYR 611           H2       TYR 611  49.149  42.586  31.079
  466    H3   TYR 611           H3       TYR 611  49.481  44.127  31.531
  467    HA   TYR 611           HA       TYR 611  47.494  44.944  30.839
  468    HB2  TYR 611           HB2      TYR 611  46.918  42.136  29.761
  469    HB3  TYR 611           HB3      TYR 611  45.816  43.526  29.818
  470    HD1  TYR 611           HD2      TYR 611  46.254  45.562  28.635
  471    HD2  TYR 611           HD1      TYR 611  48.443  41.954  27.712
  472    HE1  TYR 611           HE2      TYR 611  46.960  46.532  26.452
  473    HE2  TYR 611           HE1      TYR 611  49.302  43.028  25.631
  474    HH   TYR 611           HH       TYR 611  49.406  44.966  24.440
  475    H    SER 612           H        SER 612  46.184  45.073  32.700
  476    HA   SER 612           HA       SER 612  45.329  44.704  34.703
  477    HB2  SER 612           HB2      SER 612  45.828  41.732  34.694
  478    HB3  SER 612           HB3      SER 612  44.544  42.653  35.488
  479    HG   SER 612           HG       SER 612  43.923  41.590  33.592
  480    HA   PRO 613           HA       PRO 613  48.909  45.213  37.027
  481    HB2  PRO 613           HB2      PRO 613  48.053  45.350  39.666
  482    HB3  PRO 613           HB3      PRO 613  47.615  46.566  38.430
  483    HG2  PRO 613           HG2      PRO 613  46.037  44.129  39.355
  484    HG3  PRO 613           HG3      PRO 613  45.457  45.809  39.213
  485    HD2  PRO 613           HD2      PRO 613  45.078  43.931  37.221
  486    HD3  PRO 613           HD3      PRO 613  45.370  45.675  36.862
  487    H    SER 614           H        SER 614  50.556  44.220  38.487
  488    HA   SER 614           HA       SER 614  50.589  41.371  38.686
  489    HB2  SER 614           HB2      SER 614  52.336  43.272  40.267
  490    HB3  SER 614           HB3      SER 614  52.581  41.559  39.897
  491    HG   SER 614           HG       SER 614  53.576  42.783  38.342
  492    H    SER 615           H        SER 615  49.157  43.701  40.839
  493    HA   SER 615           HA       SER 615  49.349  42.596  43.384
  494    HB2  SER 615           HB2      SER 615  47.032  44.056  42.015
  495    HB3  SER 615           HB3      SER 615  47.283  43.930  43.762
  496    HG   SER 615           HG       SER 615  48.063  45.798  43.035
  497    HA   PRO 616           HA       PRO 616  46.699  38.859  42.809
  498    HB2  PRO 616           HB2      PRO 616  46.766  39.004  45.843
  499    HB3  PRO 616           HB3      PRO 616  46.801  37.569  44.781
  500    HG2  PRO 616           HG2      PRO 616  49.085  38.532  45.850
  501    HG3  PRO 616           HG3      PRO 616  49.054  38.067  44.109
  502    HD2  PRO 616           HD2      PRO 616  48.916  40.861  45.236
  503    HD3  PRO 616           HD3      PRO 616  49.849  40.177  43.860
  504   HC11  DA2 617          HC11      DA2 617  37.085  40.359  39.422
  505   HC12  DA2 617          HC12      DA2 617  37.196  39.022  38.296
  506   HC13  DA2 617          HC13      DA2 617  35.631  39.748  38.608
  507   HC21  DA2 617          HC21      DA2 617  34.497  38.556  41.139
  508   HC22  DA2 617          HC22      DA2 617  34.984  36.940  40.648
  509   HC23  DA2 617          HC23      DA2 617  34.440  38.071  39.426
  510    H2   DA2 617           H        DA2 617  44.494  38.535  42.967
  511    HA   DA2 617           HA       DA2 617  42.889  40.827  42.843
  512   HCB1  DA2 617          HCB1      DA2 617  41.885  37.969  43.220
  513   HCB2  DA2 617          HCB2      DA2 617  42.602  38.526  41.727
  514   HCG1  DA2 617          HCG1      DA2 617  40.081  39.795  42.866
  515   HCG2  DA2 617          HCG2      DA2 617  40.818  40.045  41.262
  516   HCD1  DA2 617          HCD1      DA2 617  40.528  37.719  40.711
  517   HCD2  DA2 617          HCD2      DA2 617  39.641  37.429  42.264
  518    HNE  DA2 617           HNE      DA2 617  38.785  39.247  40.038
  519   HNH2  DA2 617          HNH2      DA2 617  37.953  36.665  42.400
  520   HNH1  DA2 617          HNH1      DA2 617  36.264  36.936  42.220
  521    H    TYR 618           H        TYR 618  43.494  38.995  45.761
  522    HA   TYR 618           HA       TYR 618  42.465  41.195  47.378
  523    HB2  TYR 618           HB2      TYR 618  41.111  39.662  48.848
  524    HB3  TYR 618           HB3      TYR 618  40.420  40.190  47.329
  525    HD1  TYR 618           HD2      TYR 618  41.851  37.215  49.155
  526    HD2  TYR 618           HD1      TYR 618  39.935  38.657  45.563
  527    HE1  TYR 618           HE2      TYR 618  41.428  34.895  48.452
  528    HE2  TYR 618           HE1      TYR 618  39.410  36.318  44.910
  529    HH   TYR 618           HH       TYR 618  39.981  34.143  45.345
  530    H    THR 619           H        THR 619  43.887  41.522  48.881
  531    HA   THR 619           HA       THR 619  45.384  39.264  50.138
  532    HB   THR 619           HB       THR 619  47.252  41.021  50.435
  533    HG1  THR 619           HG1      THR 619  46.274  42.838  49.929
  534   HG21  THR 619          HG21      THR 619  48.186  40.560  48.217
  535   HG22  THR 619          HG22      THR 619  47.220  39.151  48.705
  536   HG23  THR 619          HG23      THR 619  46.559  40.340  47.551
  537    HA   PRO 620           HA       PRO 620  42.932  41.377  53.407
  538    HB2  PRO 620           HB2      PRO 620  42.959  38.500  54.328
  539    HB3  PRO 620           HB3      PRO 620  41.662  39.729  54.537
  540    HG2  PRO 620           HG2      PRO 620  41.396  37.894  52.620
  541    HG3  PRO 620           HG3      PRO 620  41.013  39.620  52.313
  542    HD2  PRO 620           HD2      PRO 620  43.490  38.094  51.533
  543    HD3  PRO 620           HD3      PRO 620  42.524  39.285  50.583
  544    H    GLN 621           H        GLN 621  43.894  42.210  54.923
  545    HA   GLN 621           HA       GLN 621  45.476  43.083  56.222
  546    HB2  GLN 621           HB2      GLN 621  45.568  40.175  57.104
  547    HB3  GLN 621           HB3      GLN 621  46.250  41.508  58.040
  548    HG2  GLN 621           HG2      GLN 621  43.282  41.248  57.379
  549    HG3  GLN 621           HG3      GLN 621  44.057  40.795  58.893
  550   HE21  GLN 621          HE22      GLN 621  42.073  42.610  59.124
  551   HE22  GLN 621          HE21      GLN 621  42.847  44.155  59.547
  552    H    SER 622           H        SER 622  46.694  42.103  53.607
  553    HA   SER 622           HA       SER 622  49.516  41.784  54.479
  554    HB2  SER 622           HB2      SER 622  48.053  40.099  52.401
  555    HB3  SER 622           HB3      SER 622  49.778  40.004  52.736
  556    HG   SER 622           HG       SER 622  47.671  39.534  54.540
  557    HA   PRO 623           HA       PRO 623  49.363  44.298  50.520
  558    HB2  PRO 623           HB2      PRO 623  48.627  46.903  51.092
  559    HB3  PRO 623           HB3      PRO 623  47.415  45.650  50.654
  560    HG2  PRO 623           HG2      PRO 623  48.202  46.699  53.301
  561    HG3  PRO 623           HG3      PRO 623  46.559  46.277  52.657
  562    HD2  PRO 623           HD2      PRO 623  48.135  44.723  54.344
  563    HD3  PRO 623           HD3      PRO 623  46.826  44.071  53.323
  Start of MODEL   18
    1    H1   MET 553           H1       MET 553  18.765  37.265  13.985
    2    H2   MET 553           H2       MET 553  18.152  38.497  14.922
    3    H3   MET 553           H3       MET 553  19.115  37.330  15.554
    4    HA   MET 553           HA       MET 553  21.007  38.038  14.501
    5    HB2  MET 553           HB2      MET 553  19.517  38.820  12.426
    6    HB3  MET 553           HB3      MET 553  19.681  40.409  13.190
    7    HG2  MET 553           HG2      MET 553  21.871  38.593  12.219
    8    HG3  MET 553           HG3      MET 553  21.367  40.180  11.610
    9    HE1  MET 553           HE1      MET 553  24.002  39.671  11.553
   10    HE2  MET 553           HE2      MET 553  23.663  41.405  11.512
   11    HE3  MET 553           HE3      MET 553  24.980  40.778  12.539
   12    H    LYS 554           H        LYS 554  21.846  38.716  16.388
   13    HA   LYS 554           HA       LYS 554  21.677  41.527  17.066
   14    HB2  LYS 554           HB2      LYS 554  19.781  40.366  18.334
   15    HB3  LYS 554           HB3      LYS 554  20.970  39.372  19.131
   16    HG2  LYS 554           HG2      LYS 554  20.464  41.011  20.711
   17    HG3  LYS 554           HG3      LYS 554  22.054  41.441  20.092
   18    HD2  LYS 554           HD2      LYS 554  20.706  43.405  20.403
   19    HD3  LYS 554           HD3      LYS 554  21.074  43.180  18.682
   20    HE2  LYS 554           HE2      LYS 554  18.745  42.044  18.533
   21    HE3  LYS 554           HE3      LYS 554  18.480  42.570  20.185
   22    HZ1  LYS 554           HZ1      LYS 554  18.773  44.231  17.801
   23    HZ2  LYS 554           HZ2      LYS 554  17.612  44.327  18.890
   24    HZ3  LYS 554           HZ3      LYS 554  19.151  44.863  19.258
   25    H    MET 555           H        MET 555  23.566  42.245  18.161
   26    HA   MET 555           HA       MET 555  25.500  40.273  19.214
   27    HB2  MET 555           HB2      MET 555  25.931  40.737  16.714
   28    HB3  MET 555           HB3      MET 555  26.364  42.366  17.149
   29    HG2  MET 555           HG2      MET 555  28.089  41.393  18.745
   30    HG3  MET 555           HG3      MET 555  27.694  39.803  18.104
   31    HE1  MET 555           HE1      MET 555  31.389  40.762  16.904
   32    HE2  MET 555           HE2      MET 555  30.640  41.633  18.244
   33    HE3  MET 555           HE3      MET 555  30.422  39.863  18.094
   34    H    TRP 556           H        TRP 556  26.789  41.130  20.924
   35    HA   TRP 556           HA       TRP 556  26.200  43.515  22.355
   36    HB2  TRP 556           HB2      TRP 556  28.524  41.585  22.214
   37    HB3  TRP 556           HB3      TRP 556  28.641  43.044  23.160
   38    HD1  TRP 556           HD1      TRP 556  27.893  39.550  23.806
   39    HE1  TRP 556           HE1      TRP 556  26.539  39.222  25.898
   40    HE3  TRP 556           HE3      TRP 556  26.253  44.375  24.558
   41    HZ2  TRP 556           HZ2      TRP 556  25.471  40.901  28.049
   42    HZ3  TRP 556           HZ3      TRP 556  24.978  44.909  26.582
   43    HH2  TRP 556           HH2      TRP 556  24.503  43.191  28.287
   44    H    LYS 557           H        LYS 557  27.840  45.352  22.792
   45    HA   LYS 557           HA       LYS 557  29.547  46.296  20.632
   46    HB2  LYS 557           HB2      LYS 557  26.871  47.690  21.248
   47    HB3  LYS 557           HB3      LYS 557  28.235  48.574  20.631
   48    HG2  LYS 557           HG2      LYS 557  28.408  47.352  18.650
   49    HG3  LYS 557           HG3      LYS 557  27.086  46.241  19.087
   50    HD2  LYS 557           HD2      LYS 557  25.463  47.961  19.091
   51    HD3  LYS 557           HD3      LYS 557  26.666  49.257  18.955
   52    HE2  LYS 557           HE2      LYS 557  27.304  48.023  16.695
   53    HE3  LYS 557           HE3      LYS 557  25.732  47.269  16.904
   54    HZ1  LYS 557           HZ1      LYS 557  24.827  49.620  17.050
   55    HZ2  LYS 557           HZ2      LYS 557  26.312  50.142  16.616
   56    HZ3  LYS 557           HZ3      LYS 557  25.476  49.269  15.591
   57    HA   PRO 558           HA       PRO 558  31.679  47.788  24.025
   58    HB2  PRO 558           HB2      PRO 558  33.204  49.858  23.039
   59    HB3  PRO 558           HB3      PRO 558  33.383  48.141  22.577
   60    HG2  PRO 558           HG2      PRO 558  31.829  50.270  21.111
   61    HG3  PRO 558           HG3      PRO 558  33.075  49.167  20.435
   62    HD2  PRO 558           HD2      PRO 558  30.474  48.452  20.224
   63    HD3  PRO 558           HD3      PRO 558  31.731  47.253  20.694
   64    H    GLY 559           H        GLY 559  31.874  49.394  25.622
   65    HA2  GLY 559           HA2      GLY 559  31.204  51.088  27.020
   66    HA3  GLY 559           HA3      GLY 559  30.389  51.879  25.641
   67    H    ASP 560           H        ASP 560  29.966  48.993  27.776
   68    HA   ASP 560           HA       ASP 560  27.204  49.863  28.328
   69    HB2  ASP 560           HB2      ASP 560  27.393  48.486  26.095
   70    HB3  ASP 560           HB3      ASP 560  27.530  47.081  27.154
   71    H    GLU 561           H        GLU 561  27.264  49.889  30.543
   72    HA   GLU 561           HA       GLU 561  28.471  47.775  32.055
   73    HB2  GLU 561           HB2      GLU 561  27.101  48.329  33.909
   74    HB3  GLU 561           HB3      GLU 561  27.981  49.695  33.294
   75    HG2  GLU 561           HG2      GLU 561  25.023  49.172  32.704
   76    HG3  GLU 561           HG3      GLU 561  25.616  50.126  34.079
   77    H    CYS 562           H        CYS 562  28.018  45.770  32.466
   78    HA   CYS 562           HA       CYS 562  25.386  44.600  32.183
   79    HB2  CYS 562           HB2      CYS 562  27.685  43.452  30.519
   80    HB3  CYS 562           HB3      CYS 562  25.957  43.099  30.322
   81    HG   CYS 562           HG       CYS 562  27.500  45.889  29.670
   82    H    PHE 563           H        PHE 563  25.970  41.880  32.461
   83    HA   PHE 563           HA       PHE 563  27.603  41.761  34.983
   84    HB2  PHE 563           HB2      PHE 563  24.847  40.960  34.320
   85    HB3  PHE 563           HB3      PHE 563  25.855  39.701  35.051
   86    HD1  PHE 563           HD1      PHE 563  27.002  40.105  37.238
   87    HD2  PHE 563           HD2      PHE 563  23.866  42.657  35.763
   88    HE1  PHE 563           HE1      PHE 563  26.645  41.013  39.542
   89    HE2  PHE 563           HE2      PHE 563  23.527  43.557  38.065
   90    HZ   PHE 563           HZ       PHE 563  24.873  42.701  39.941
   91    H    ALA 564           H        ALA 564  29.471  40.589  34.454
   92    HA   ALA 564           HA       ALA 564  29.405  38.656  32.159
   93    HB1  ALA 564           HB1      ALA 564  31.900  39.774  33.334
   94    HB2  ALA 564           HB2      ALA 564  31.495  39.337  31.655
   95    HB3  ALA 564           HB3      ALA 564  30.848  40.842  32.365
   96    H    LEU 565           H        LEU 565  30.004  36.645  32.401
   97    HA   LEU 565           HA       LEU 565  30.054  35.345  34.987
   98    HB2  LEU 565           HB2      LEU 565  28.929  34.522  32.827
   99    HB3  LEU 565           HB3      LEU 565  30.578  34.151  32.262
  100    HG   LEU 565           HG       LEU 565  30.817  32.425  33.994
  101   HD11  LEU 565          HD11      LEU 565  28.045  33.301  34.833
  102   HD12  LEU 565          HD12      LEU 565  28.850  31.815  35.388
  103   HD13  LEU 565          HD13      LEU 565  29.579  33.388  35.760
  104   HD21  LEU 565          HD21      LEU 565  29.938  31.547  31.973
  105   HD22  LEU 565          HD22      LEU 565  28.939  30.883  33.263
  106   HD23  LEU 565          HD23      LEU 565  28.308  32.183  32.256
  107    H    TYR 566           H        TYR 566  31.907  35.490  36.132
  108    HA   TYR 566           HA       TYR 566  34.513  35.303  35.136
  109    HB2  TYR 566           HB2      TYR 566  33.411  36.205  37.323
  110    HB3  TYR 566           HB3      TYR 566  33.477  34.553  37.929
  111    HD1  TYR 566           HD1      TYR 566  35.740  36.900  36.043
  112    HD2  TYR 566           HD2      TYR 566  35.227  34.451  39.583
  113    HE1  TYR 566           HE1      TYR 566  38.101  37.227  36.612
  114    HE2  TYR 566           HE2      TYR 566  37.520  35.105  40.308
  115    HH   TYR 566           HH       TYR 566  39.636  36.999  38.270
  116    H    TRP 567           H        TRP 567  35.918  33.580  36.472
  117    HA   TRP 567           HA       TRP 567  35.356  30.993  35.013
  118    HB2  TRP 567           HB2      TRP 567  37.661  31.112  34.295
  119    HB3  TRP 567           HB3      TRP 567  36.862  32.614  33.875
  120    HD1  TRP 567           HD1      TRP 567  37.887  34.852  34.861
  121    HE1  TRP 567           HE1      TRP 567  39.966  35.397  36.259
  122    HE3  TRP 567           HE3      TRP 567  39.249  30.135  36.269
  123    HZ2  TRP 567           HZ2      TRP 567  41.655  34.091  38.105
  124    HZ3  TRP 567           HZ3      TRP 567  41.114  29.795  37.792
  125    HH2  TRP 567           HH2      TRP 567  42.291  31.757  38.841
  126    H    GLU 568           H        GLU 568  36.766  32.479  37.866
  127    HA   GLU 568           HA       GLU 568  38.119  30.212  38.894
  128    HB2  GLU 568           HB2      GLU 568  38.676  32.411  39.644
  129    HB3  GLU 568           HB3      GLU 568  36.997  32.836  39.922
  130    HG2  GLU 568           HG2      GLU 568  38.168  32.740  42.008
  131    HG3  GLU 568           HG3      GLU 568  36.782  31.685  41.868
  132    H    ASP 569           H        ASP 569  34.827  31.454  39.273
  133    HA   ASP 569           HA       ASP 569  34.061  29.056  40.784
  134    HB2  ASP 569           HB2      ASP 569  32.725  30.619  42.233
  135    HB3  ASP 569           HB3      ASP 569  34.457  30.969  42.244
  136    H    ASN 570           H        ASN 570  33.402  31.097  38.177
  137    HA   ASN 570           HA       ASN 570  31.808  31.080  36.553
  138    HB2  ASN 570           HB2      ASN 570  32.046  28.525  37.092
  139    HB3  ASN 570           HB3      ASN 570  30.548  28.679  37.974
  140   HD21  ASN 570          HD22      ASN 570  31.588  29.686  34.627
  141   HD22  ASN 570          HD21      ASN 570  30.114  29.016  33.954
  142    H    LYS 571           H        LYS 571  31.431  32.964  38.359
  143    HA   LYS 571           HA       LYS 571  28.455  33.174  38.526
  144    HB2  LYS 571           HB2      LYS 571  30.509  33.587  40.591
  145    HB3  LYS 571           HB3      LYS 571  29.531  35.020  40.361
  146    HG2  LYS 571           HG2      LYS 571  28.273  32.285  40.801
  147    HG3  LYS 571           HG3      LYS 571  28.616  33.435  42.075
  148    HD2  LYS 571           HD2      LYS 571  26.903  34.157  39.612
  149    HD3  LYS 571           HD3      LYS 571  26.209  33.447  41.036
  150    HE2  LYS 571           HE2      LYS 571  27.860  36.031  41.098
  151    HE3  LYS 571           HE3      LYS 571  26.119  36.007  40.836
  152    HZ1  LYS 571           HZ1      LYS 571  27.607  35.107  43.198
  153    HZ2  LYS 571           HZ2      LYS 571  26.552  36.346  43.102
  154    HZ3  LYS 571           HZ3      LYS 571  26.032  34.801  43.043
  155    H    PHE 572           H        PHE 572  27.535  35.139  38.042
  156    HA   PHE 572           HA       PHE 572  28.998  36.800  36.212
  157    HB2  PHE 572           HB2      PHE 572  26.221  36.928  37.418
  158    HB3  PHE 572           HB3      PHE 572  26.844  38.048  36.192
  159    HD1  PHE 572           HD2      PHE 572  27.407  37.293  33.958
  160    HD2  PHE 572           HD1      PHE 572  25.519  34.655  36.796
  161    HE1  PHE 572           HE2      PHE 572  26.623  35.828  32.096
  162    HE2  PHE 572           HE1      PHE 572  24.985  33.081  34.983
  163    HZ   PHE 572           HZ       PHE 572  25.499  33.663  32.626
  164    H    TYR 573           H        TYR 573  29.580  38.999  36.582
  165    HA   TYR 573           HA       TYR 573  29.254  40.325  39.241
  166    HB2  TYR 573           HB2      TYR 573  31.919  39.988  37.858
  167    HB3  TYR 573           HB3      TYR 573  31.595  41.001  39.244
  168    HD1  TYR 573           HD2      TYR 573  31.996  37.502  38.156
  169    HD2  TYR 573           HD1      TYR 573  31.443  40.088  41.560
  170    HE1  TYR 573           HE2      TYR 573  32.522  35.597  39.708
  171    HE2  TYR 573           HE1      TYR 573  32.002  38.209  43.071
  172    HH   TYR 573           HH       TYR 573  32.432  34.943  42.078
  173    H    ARG 574           H        ARG 574  29.091  42.514  39.040
  174    HA   ARG 574           HA       ARG 574  28.272  43.687  36.596
  175    HB2  ARG 574           HB2      ARG 574  29.510  45.019  39.045
  176    HB3  ARG 574           HB3      ARG 574  28.700  45.883  37.707
  177    HG2  ARG 574           HG2      ARG 574  26.662  44.461  38.243
  178    HG3  ARG 574           HG3      ARG 574  27.490  44.059  39.774
  179    HD2  ARG 574           HD2      ARG 574  26.705  46.820  38.752
  180    HD3  ARG 574           HD3      ARG 574  25.847  45.860  39.958
  181    HE   ARG 574           HE       ARG 574  27.784  46.194  41.510
  182   HH11  ARG 574          HH11      ARG 574  27.478  48.522  38.808
  183   HH12  ARG 574          HH12      ARG 574  28.602  49.588  39.551
  184   HH21  ARG 574          HH21      ARG 574  29.425  47.641  42.193
  185   HH22  ARG 574          HH22      ARG 574  29.453  49.190  41.351
  186    H    ALA 575           H        ALA 575  29.395  44.455  34.847
  187    HA   ALA 575           HA       ALA 575  32.172  45.350  35.068
  188    HB1  ALA 575           HB1      ALA 575  31.418  43.254  32.966
  189    HB2  ALA 575           HB2      ALA 575  33.036  43.896  33.326
  190    HB3  ALA 575           HB3      ALA 575  32.244  42.790  34.440
  191    H    GLU 576           H        GLU 576  32.576  47.017  33.677
  192    HA   GLU 576           HA       GLU 576  30.475  47.983  31.812
  193    HB2  GLU 576           HB2      GLU 576  33.177  49.221  32.566
  194    HB3  GLU 576           HB3      GLU 576  32.035  49.872  31.366
  195    HG2  GLU 576           HG2      GLU 576  30.434  50.021  33.446
  196    HG3  GLU 576           HG3      GLU 576  31.963  49.785  34.338
  197    H    VAL 577           H        VAL 577  30.415  46.925  29.923
  198    HA   VAL 577           HA       VAL 577  32.387  45.472  28.588
  199    HB   VAL 577           HB       VAL 577  29.945  47.097  27.864
  200   HG11  VAL 577          HG11      VAL 577  31.925  46.019  25.866
  201   HG12  VAL 577          HG12      VAL 577  30.161  46.072  25.511
  202   HG13  VAL 577          HG13      VAL 577  31.072  47.549  25.926
  203   HG21  VAL 577          HG21      VAL 577  29.803  44.846  28.933
  204   HG22  VAL 577          HG22      VAL 577  29.008  44.994  27.347
  205   HG23  VAL 577          HG23      VAL 577  30.587  44.162  27.485
  206    H    GLU 578           H        GLU 578  34.123  45.890  27.354
  207    HA   GLU 578           HA       GLU 578  34.619  48.732  26.636
  208    HB2  GLU 578           HB2      GLU 578  36.091  47.799  28.331
  209    HB3  GLU 578           HB3      GLU 578  36.448  46.414  27.309
  210    HG2  GLU 578           HG2      GLU 578  38.281  47.934  27.305
  211    HG3  GLU 578           HG3      GLU 578  37.641  47.830  25.696
  212    H    ALA 579           H        ALA 579  34.835  45.353  25.323
  213    HA   ALA 579           HA       ALA 579  34.701  46.371  22.671
  214    HB1  ALA 579           HB1      ALA 579  37.397  45.461  23.796
  215    HB2  ALA 579           HB2      ALA 579  37.032  45.456  22.054
  216    HB3  ALA 579           HB3      ALA 579  37.028  46.987  22.977
  217    H    LEU 580           H        LEU 580  33.176  44.920  22.228
  218    HA   LEU 580           HA       LEU 580  33.439  42.067  23.083
  219    HB2  LEU 580           HB2      LEU 580  30.971  43.625  22.270
  220    HB3  LEU 580           HB3      LEU 580  31.016  41.985  22.837
  221    HG   LEU 580           HG       LEU 580  30.994  44.505  24.222
  222   HD11  LEU 580          HD11      LEU 580  29.869  41.912  24.550
  223   HD12  LEU 580          HD12      LEU 580  30.827  42.165  26.008
  224   HD13  LEU 580          HD13      LEU 580  29.559  43.320  25.570
  225   HD21  LEU 580          HD21      LEU 580  33.240  42.731  25.251
  226   HD22  LEU 580          HD22      LEU 580  33.173  44.508  24.988
  227   HD23  LEU 580          HD23      LEU 580  32.351  43.778  26.328
  228    H    HIS 581           H        HIS 581  34.989  42.635  21.127
  229    HA   HIS 581           HA       HIS 581  34.076  41.394  18.556
  230    HB2  HIS 581           HB2      HIS 581  34.613  43.262  17.300
  231    HB3  HIS 581           HB3      HIS 581  33.240  43.560  18.359
  232    HD2  HIS 581           HD2      HIS 581  36.815  44.588  17.655
  233    HE1  HIS 581           HE1      HIS 581  35.526  47.368  20.591
  234    HE2  HIS 581           HE2      HIS 581  37.360  46.794  18.948
  235    H    SER 582           H        SER 582  36.210  40.964  20.811
  236    HA   SER 582           HA       SER 582  38.722  41.591  19.545
  237    HB2  SER 582           HB2      SER 582  39.643  40.170  21.435
  238    HB3  SER 582           HB3      SER 582  38.708  41.566  21.951
  239    HG   SER 582           HG       SER 582  38.286  39.193  22.755
  240    H    SER 583           H        SER 583  36.573  39.119  18.739
  241    HA   SER 583           HA       SER 583  38.649  37.556  17.407
  242    HB2  SER 583           HB2      SER 583  38.472  35.509  18.544
  243    HB3  SER 583           HB3      SER 583  38.923  36.732  19.725
  244    HG   SER 583           HG       SER 583  37.232  36.294  20.756
  245    H    GLY 584           H        GLY 584  35.170  37.807  18.248
  246    HA2  GLY 584           HA2      GLY 584  33.511  37.471  16.518
  247    HA3  GLY 584           HA3      GLY 584  34.312  35.969  16.028
  248    H    MET 585           H        MET 585  34.782  35.508  19.052
  249    HA   MET 585           HA       MET 585  31.990  34.938  19.947
  250    HB2  MET 585           HB2      MET 585  32.525  32.754  20.751
  251    HB3  MET 585           HB3      MET 585  32.937  32.836  19.045
  252    HG2  MET 585           HG2      MET 585  34.950  33.213  21.289
  253    HG3  MET 585           HG3      MET 585  34.508  31.631  20.676
  254    HE1  MET 585           HE1      MET 585  37.596  33.402  20.748
  255    HE2  MET 585           HE2      MET 585  37.013  31.740  21.011
  256    HE3  MET 585           HE3      MET 585  38.166  32.070  19.718
  257    H    THR 586           H        THR 586  35.272  35.862  21.024
  258    HA   THR 586           HA       THR 586  34.067  36.209  23.734
  259    HB   THR 586           HB       THR 586  36.323  36.652  24.548
  260    HG1  THR 586           HG1      THR 586  37.940  36.420  23.273
  261   HG21  THR 586          HG21      THR 586  37.158  34.337  24.437
  262   HG22  THR 586          HG22      THR 586  35.422  34.354  24.722
  263   HG23  THR 586          HG23      THR 586  36.062  33.971  23.104
  264    H    ALA 587           H        ALA 587  34.896  37.991  24.977
  265    HA   ALA 587           HA       ALA 587  34.640  40.624  23.682
  266    HB1  ALA 587           HB1      ALA 587  32.904  40.716  25.824
  267    HB2  ALA 587           HB2      ALA 587  32.334  40.385  24.150
  268    HB3  ALA 587           HB3      ALA 587  32.601  39.073  25.319
  269    H    VAL 588           H        VAL 588  35.363  42.245  24.911
  270    HA   VAL 588           HA       VAL 588  36.965  41.434  27.280
  271    HB   VAL 588           HB       VAL 588  37.320  43.960  25.682
  272   HG11  VAL 588          HG11      VAL 588  39.508  43.960  26.836
  273   HG12  VAL 588          HG12      VAL 588  38.143  44.034  27.943
  274   HG13  VAL 588          HG13      VAL 588  39.000  42.497  27.734
  275   HG21  VAL 588          HG21      VAL 588  38.873  41.293  25.406
  276   HG22  VAL 588          HG22      VAL 588  37.815  41.949  24.171
  277   HG23  VAL 588          HG23      VAL 588  39.293  42.819  24.590
  278    H    VAL 589           H        VAL 589  36.200  42.155  29.136
  279    HA   VAL 589           HA       VAL 589  34.381  44.490  29.226
  280    HB   VAL 589           HB       VAL 589  32.890  43.319  30.741
  281   HG11  VAL 589          HG11      VAL 589  32.310  43.418  28.488
  282   HG12  VAL 589          HG12      VAL 589  33.250  41.934  28.077
  283   HG13  VAL 589          HG13      VAL 589  31.822  41.825  29.116
  284   HG21  VAL 589          HG21      VAL 589  32.907  40.815  30.765
  285   HG22  VAL 589          HG22      VAL 589  34.542  40.833  30.048
  286   HG23  VAL 589          HG23      VAL 589  34.297  41.463  31.671
  287    H    LYS 590           H        LYS 590  34.542  45.740  31.185
  288    HA   LYS 590           HA       LYS 590  36.819  45.102  32.989
  289    HB2  LYS 590           HB2      LYS 590  37.139  47.221  31.721
  290    HB3  LYS 590           HB3      LYS 590  35.591  47.822  32.235
  291    HG2  LYS 590           HG2      LYS 590  36.210  48.175  34.429
  292    HG3  LYS 590           HG3      LYS 590  37.611  47.107  34.363
  293    HD2  LYS 590           HD2      LYS 590  38.854  48.793  33.024
  294    HD3  LYS 590           HD3      LYS 590  37.343  49.655  32.724
  295    HE2  LYS 590           HE2      LYS 590  37.655  49.602  35.543
  296    HE3  LYS 590           HE3      LYS 590  39.289  49.826  34.888
  297    HZ1  LYS 590           HZ1      LYS 590  36.980  51.420  34.040
  298    HZ2  LYS 590           HZ2      LYS 590  37.973  51.901  35.254
  299    HZ3  LYS 590           HZ3      LYS 590  38.570  51.764  33.763
  300    H    PHE 591           H        PHE 591  36.319  44.226  34.823
  301    HA   PHE 591           HA       PHE 591  33.780  44.215  36.107
  302    HB2  PHE 591           HB2      PHE 591  36.588  43.630  37.030
  303    HB3  PHE 591           HB3      PHE 591  35.244  43.394  38.077
  304    HD1  PHE 591           HD2      PHE 591  33.090  42.039  36.682
  305    HD2  PHE 591           HD1      PHE 591  37.327  41.642  35.955
  306    HE1  PHE 591           HE2      PHE 591  32.694  39.904  35.543
  307    HE2  PHE 591           HE1      PHE 591  36.902  39.434  34.869
  308    HZ   PHE 591           HZ       PHE 591  34.619  38.628  34.549
  309    H    ILE 592           H        ILE 592  32.704  45.851  37.001
  310    HA   ILE 592           HA       ILE 592  33.939  48.377  37.271
  311    HB   ILE 592           HB       ILE 592  31.347  47.872  38.656
  312   HG12  ILE 592          HG12      ILE 592  31.856  47.697  35.651
  313   HG13  ILE 592          HG13      ILE 592  30.949  46.613  36.692
  314   HG21  ILE 592          HG21      ILE 592  32.308  50.094  36.816
  315   HG22  ILE 592          HG22      ILE 592  30.807  50.103  37.750
  316   HG23  ILE 592          HG23      ILE 592  32.330  50.178  38.610
  317   HD11  ILE 592          HD11      ILE 592  30.023  49.361  35.736
  318   HD12  ILE 592          HD12      ILE 592  29.430  47.790  35.252
  319   HD13  ILE 592          HD13      ILE 592  29.187  48.356  36.942
  320    H    ASP 593           H        ASP 593  33.572  45.829  39.691
  321    HA   ASP 593           HA       ASP 593  34.134  47.744  41.885
  322    HB2  ASP 593           HB2      ASP 593  32.010  46.243  41.765
  323    HB3  ASP 593           HB3      ASP 593  33.100  44.916  42.135
  324    H    TYR 594           H        TYR 594  35.970  46.523  40.004
  325    HA   TYR 594           HA       TYR 594  38.101  45.723  41.902
  326    HB2  TYR 594           HB2      TYR 594  37.831  44.215  39.267
  327    HB3  TYR 594           HB3      TYR 594  39.005  44.026  40.523
  328    HD1  TYR 594           HD1      TYR 594  35.259  43.881  40.255
  329    HD2  TYR 594           HD2      TYR 594  38.838  42.187  41.940
  330    HE1  TYR 594           HE1      TYR 594  33.909  42.007  41.277
  331    HE2  TYR 594           HE2      TYR 594  37.517  40.300  42.840
  332    HH   TYR 594           HH       TYR 594  34.071  40.214  42.866
  333    H    GLY 595           H        GLY 595  37.285  46.704  38.559
  334    HA2  GLY 595           HA2      GLY 595  37.923  48.751  37.551
  335    HA3  GLY 595           HA3      GLY 595  39.371  48.827  38.566
  336    H    ASN 596           H        ASN 596  38.556  45.887  36.769
  337    HA   ASN 596           HA       ASN 596  40.649  46.487  34.760
  338    HB2  ASN 596           HB2      ASN 596  41.909  44.376  35.466
  339    HB3  ASN 596           HB3      ASN 596  42.118  45.826  36.417
  340   HD21  ASN 596          HD22      ASN 596  40.813  42.515  36.561
  341   HD22  ASN 596          HD21      ASN 596  40.675  42.572  38.296
  342    H    TYR 597           H        TYR 597  40.923  44.796  33.028
  343    HA   TYR 597           HA       TYR 597  38.344  43.452  32.662
  344    HB2  TYR 597           HB2      TYR 597  38.771  44.147  30.135
  345    HB3  TYR 597           HB3      TYR 597  37.909  45.206  31.200
  346    HD1  TYR 597           HD2      TYR 597  39.703  46.855  32.639
  347    HD2  TYR 597           HD1      TYR 597  40.006  45.362  28.590
  348    HE1  TYR 597           HE2      TYR 597  41.245  48.675  32.075
  349    HE2  TYR 597           HE1      TYR 597  41.297  47.367  27.959
  350    HH   TYR 597           HH       TYR 597  42.246  49.329  28.762
  351    H    GLU 598           H        GLU 598  38.293  41.969  30.918
  352    HA   GLU 598           HA       GLU 598  40.549  40.331  30.182
  353    HB2  GLU 598           HB2      GLU 598  39.927  38.303  31.473
  354    HB3  GLU 598           HB3      GLU 598  40.716  39.590  32.404
  355    HG2  GLU 598           HG2      GLU 598  38.593  40.153  33.400
  356    HG3  GLU 598           HG3      GLU 598  37.815  38.820  32.496
  357    H    GLU 599           H        GLU 599  39.811  38.240  29.153
  358    HA   GLU 599           HA       GLU 599  37.465  38.770  27.462
  359    HB2  GLU 599           HB2      GLU 599  39.639  36.702  27.357
  360    HB3  GLU 599           HB3      GLU 599  38.131  36.632  26.407
  361    HG2  GLU 599           HG2      GLU 599  38.552  38.917  25.560
  362    HG3  GLU 599           HG3      GLU 599  40.137  38.936  26.359
  363    H    VAL 600           H        VAL 600  35.565  37.960  27.549
  364    HA   VAL 600           HA       VAL 600  34.784  35.613  29.155
  365    HB   VAL 600           HB       VAL 600  33.074  38.170  29.115
  366   HG11  VAL 600          HG11      VAL 600  33.039  35.580  30.717
  367   HG12  VAL 600          HG12      VAL 600  31.797  36.838  30.859
  368   HG13  VAL 600          HG13      VAL 600  31.934  35.942  29.371
  369   HG21  VAL 600          HG21      VAL 600  35.141  38.638  30.358
  370   HG22  VAL 600          HG22      VAL 600  33.808  38.402  31.508
  371   HG23  VAL 600          HG23      VAL 600  35.007  37.101  31.197
  372    H    LEU 601           H        LEU 601  33.527  34.314  27.935
  373    HA   LEU 601           HA       LEU 601  33.115  34.667  25.189
  374    HB2  LEU 601           HB2      LEU 601  32.852  32.511  26.651
  375    HB3  LEU 601           HB3      LEU 601  31.192  33.074  26.914
  376    HG   LEU 601           HG       LEU 601  30.814  33.095  24.444
  377   HD11  LEU 601          HD11      LEU 601  32.288  31.897  22.986
  378   HD12  LEU 601          HD12      LEU 601  33.344  33.090  23.767
  379   HD13  LEU 601          HD13      LEU 601  33.357  31.420  24.333
  380   HD21  LEU 601          HD21      LEU 601  30.451  30.754  24.337
  381   HD22  LEU 601          HD22      LEU 601  31.676  30.447  25.604
  382   HD23  LEU 601          HD23      LEU 601  30.157  31.294  26.003
  383    H    LEU 602           H        LEU 602  31.362  35.346  23.862
  384    HA   LEU 602           HA       LEU 602  29.926  37.599  24.887
  385    HB2  LEU 602           HB2      LEU 602  29.472  35.937  22.356
  386    HB3  LEU 602           HB3      LEU 602  28.513  37.343  22.769
  387    HG   LEU 602           HG       LEU 602  31.540  37.464  22.582
  388   HD11  LEU 602          HD11      LEU 602  29.739  38.077  20.176
  389   HD12  LEU 602          HD12      LEU 602  31.507  38.121  20.272
  390   HD13  LEU 602          HD13      LEU 602  30.637  36.573  20.397
  391   HD21  LEU 602          HD21      LEU 602  30.420  39.373  23.573
  392   HD22  LEU 602          HD22      LEU 602  31.365  39.792  22.118
  393   HD23  LEU 602          HD23      LEU 602  29.637  39.748  21.981
  394    H    SER 603           H        SER 603  28.804  34.270  24.344
  395    HA   SER 603           HA       SER 603  26.222  34.685  25.439
  396    HB2  SER 603           HB2      SER 603  27.844  32.114  25.347
  397    HB3  SER 603           HB3      SER 603  26.060  32.274  25.295
  398    HG   SER 603           HG       SER 603  26.954  31.932  23.330
  399    H    ASN 604           H        ASN 604  28.986  35.063  27.183
  400    HA   ASN 604           HA       ASN 604  28.049  33.801  29.760
  401    HB2  ASN 604           HB2      ASN 604  30.863  34.206  28.710
  402    HB3  ASN 604           HB3      ASN 604  30.429  33.986  30.379
  403   HD21  ASN 604          HD22      ASN 604  28.146  31.973  28.678
  404   HD22  ASN 604          HD21      ASN 604  29.189  30.575  28.725
  405    H    ILE 605           H        ILE 605  28.010  36.639  28.149
  406    HA   ILE 605           HA       ILE 605  28.018  38.205  30.714
  407    HB   ILE 605           HB       ILE 605  27.941  39.278  27.895
  408   HG12  ILE 605          HG12      ILE 605  30.569  39.033  29.479
  409   HG13  ILE 605          HG13      ILE 605  30.096  37.877  28.226
  410   HG21  ILE 605          HG21      ILE 605  27.348  40.811  29.877
  411   HG22  ILE 605          HG22      ILE 605  29.072  40.650  30.325
  412   HG23  ILE 605          HG23      ILE 605  28.569  41.346  28.747
  413   HD11  ILE 605          HD11      ILE 605  31.623  39.560  27.430
  414   HD12  ILE 605          HD12      ILE 605  30.072  39.526  26.558
  415   HD13  ILE 605          HD13      ILE 605  30.417  40.823  27.766
  416    H    LYS 606           H        LYS 606  26.143  38.485  31.568
  417    HA   LYS 606           HA       LYS 606  23.586  38.438  30.130
  418    HB2  LYS 606           HB2      LYS 606  24.504  38.656  32.997
  419    HB3  LYS 606           HB3      LYS 606  22.894  39.192  32.643
  420    HG2  LYS 606           HG2      LYS 606  22.262  36.927  31.749
  421    HG3  LYS 606           HG3      LYS 606  23.909  36.385  32.053
  422    HD2  LYS 606           HD2      LYS 606  22.705  35.693  33.998
  423    HD3  LYS 606           HD3      LYS 606  23.393  37.244  34.498
  424    HE2  LYS 606           HE2      LYS 606  21.216  38.368  33.715
  425    HE3  LYS 606           HE3      LYS 606  20.552  36.758  33.386
  426    HZ1  LYS 606           HZ1      LYS 606  19.902  37.848  35.502
  427    HZ2  LYS 606           HZ2      LYS 606  20.504  36.342  35.665
  428    HZ3  LYS 606           HZ3      LYS 606  21.432  37.606  36.041
  429    HA   PRO 607           HA       PRO 607  23.454  43.162  30.263
  430    HB2  PRO 607           HB2      PRO 607  20.748  43.423  30.837
  431    HB3  PRO 607           HB3      PRO 607  21.419  43.277  29.177
  432    HG2  PRO 607           HG2      PRO 607  20.036  41.213  30.811
  433    HG3  PRO 607           HG3      PRO 607  20.143  41.412  29.021
  434    HD2  PRO 607           HD2      PRO 607  21.559  39.581  30.573
  435    HD3  PRO 607           HD3      PRO 607  22.077  40.151  28.932
  436    H    ILE 608           H        ILE 608  22.897  44.806  31.812
  437    HA   ILE 608           HA       ILE 608  23.591  44.071  34.468
  438    HB   ILE 608           HB       ILE 608  23.494  46.467  32.937
  439   HG12  ILE 608          HG12      ILE 608  25.420  45.357  34.013
  440   HG13  ILE 608          HG13      ILE 608  25.303  47.115  34.207
  441   HG21  ILE 608          HG21      ILE 608  22.617  46.949  35.817
  442   HG22  ILE 608          HG22      ILE 608  22.949  48.170  34.578
  443   HG23  ILE 608          HG23      ILE 608  21.521  47.129  34.444
  444   HD11  ILE 608          HD11      ILE 608  26.164  45.927  36.150
  445   HD12  ILE 608          HD12      ILE 608  24.644  46.735  36.583
  446   HD13  ILE 608          HD13      ILE 608  24.650  44.976  36.258
  447    H    LEU 609           H        LEU 609  20.360  44.532  33.093
  448    HA   LEU 609           HA       LEU 609  19.173  43.710  35.670
  449    HB2  LEU 609           HB2      LEU 609  19.249  46.285  35.674
  450    HB3  LEU 609           HB3      LEU 609  18.176  46.253  34.298
  451    HG   LEU 609           HG       LEU 609  16.446  45.091  35.664
  452   HD11  LEU 609          HD11      LEU 609  18.570  45.329  37.790
  453   HD12  LEU 609          HD12      LEU 609  16.860  45.215  38.250
  454   HD13  LEU 609          HD13      LEU 609  17.591  43.904  37.318
  455   HD21  LEU 609          HD21      LEU 609  16.761  47.706  35.546
  456   HD22  LEU 609          HD22      LEU 609  15.669  47.039  36.762
  457   HD23  LEU 609          HD23      LEU 609  17.295  47.571  37.217
  458    H    GLU 610           H        GLU 610  18.567  44.414  32.240
  459    HA   GLU 610           HA       GLU 610  16.195  43.042  31.778
  460    HB2  GLU 610           HB2      GLU 610  18.544  43.111  29.882
  461    HB3  GLU 610           HB3      GLU 610  16.818  42.951  29.551
  462    HG2  GLU 610           HG2      GLU 610  16.788  45.168  29.266
  463    HG3  GLU 610           HG3      GLU 610  16.702  45.223  30.998
  464    H1   TYR 611           H1       TYR 611  48.454  53.739  33.408
  465    H2   TYR 611           H2       TYR 611  49.948  53.987  34.035
  466    H3   TYR 611           H3       TYR 611  48.630  53.944  35.014
  467    HA   TYR 611           HA       TYR 611  49.793  51.733  33.508
  468    HB2  TYR 611           HB2      TYR 611  49.513  52.111  36.530
  469    HB3  TYR 611           HB3      TYR 611  50.025  50.663  35.782
  470    HD1  TYR 611           HD2      TYR 611  52.290  50.491  34.640
  471    HD2  TYR 611           HD1      TYR 611  51.091  54.158  36.607
  472    HE1  TYR 611           HE2      TYR 611  54.690  51.229  34.850
  473    HE2  TYR 611           HE1      TYR 611  53.417  54.981  36.435
  474    HH   TYR 611           HH       TYR 611  55.649  54.387  35.744
  475    H    SER 612           H        SER 612  48.741  49.705  33.634
  476    HA   SER 612           HA       SER 612  45.858  49.601  34.371
  477    HB2  SER 612           HB2      SER 612  46.884  49.086  31.544
  478    HB3  SER 612           HB3      SER 612  45.289  48.622  32.160
  479    HG   SER 612           HG       SER 612  45.214  50.614  31.155
  480    HA   PRO 613           HA       PRO 613  48.426  45.756  35.172
  481    HB2  PRO 613           HB2      PRO 613  48.139  45.469  37.883
  482    HB3  PRO 613           HB3      PRO 613  49.356  46.530  37.184
  483    HG2  PRO 613           HG2      PRO 613  46.558  47.336  38.151
  484    HG3  PRO 613           HG3      PRO 613  48.086  48.117  38.567
  485    HD2  PRO 613           HD2      PRO 613  46.487  49.065  36.586
  486    HD3  PRO 613           HD3      PRO 613  48.252  49.097  36.395
  487    H    SER 614           H        SER 614  47.760  43.601  35.630
  488    HA   SER 614           HA       SER 614  44.930  43.119  35.124
  489    HB2  SER 614           HB2      SER 614  47.394  41.291  35.134
  490    HB3  SER 614           HB3      SER 614  45.753  40.784  34.706
  491    HG   SER 614           HG       SER 614  46.463  42.953  33.308
  492    H    SER 615           H        SER 615  45.652  43.982  37.781
  493    HA   SER 615           HA       SER 615  45.786  43.236  39.998
  494    HB2  SER 615           HB2      SER 615  42.933  43.483  39.077
  495    HB3  SER 615           HB3      SER 615  43.461  43.435  40.776
  496    HG   SER 615           HG       SER 615  44.663  45.282  40.399
  497    HA   PRO 616           HA       PRO 616  44.876  38.605  39.863
  498    HB2  PRO 616           HB2      PRO 616  47.121  37.794  41.232
  499    HB3  PRO 616           HB3      PRO 616  46.976  37.953  39.455
  500    HG2  PRO 616           HG2      PRO 616  48.228  39.803  41.465
  501    HG3  PRO 616           HG3      PRO 616  48.765  39.479  39.783
  502    HD2  PRO 616           HD2      PRO 616  47.371  41.723  40.575
  503    HD3  PRO 616           HD3      PRO 616  47.350  41.062  38.908
  504   HC11  DA2 617          HC11      DA2 617  38.377  40.549  38.948
  505   HC12  DA2 617          HC12      DA2 617  37.254  39.892  37.738
  506   HC13  DA2 617          HC13      DA2 617  36.745  41.218  38.833
  507   HC21  DA2 617          HC21      DA2 617  35.087  39.381  38.460
  508   HC22  DA2 617          HC22      DA2 617  34.761  39.455  40.220
  509   HC23  DA2 617          HC23      DA2 617  35.207  37.926  39.469
  510    H2   DA2 617           H        DA2 617  44.031  37.382  41.578
  511    HA   DA2 617           HA       DA2 617  43.095  39.152  43.764
  512   HCB1  DA2 617          HCB1      DA2 617  41.139  37.547  43.748
  513   HCB2  DA2 617          HCB2      DA2 617  41.885  36.673  42.434
  514   HCG1  DA2 617          HCG1      DA2 617  41.009  39.593  42.182
  515   HCG2  DA2 617          HCG2      DA2 617  41.515  38.478  40.873
  516   HCD1  DA2 617          HCD1      DA2 617  39.577  37.045  41.430
  517   HCD2  DA2 617          HCD2      DA2 617  39.158  38.199  42.741
  518    HNE  DA2 617           HNE      DA2 617  39.319  39.629  40.297
  519   HNH2  DA2 617          HNH2      DA2 617  37.443  37.169  41.974
  520   HNH1  DA2 617          HNH1      DA2 617  35.902  37.662  41.330
  521    H    TYR 618           H        TYR 618  45.086  36.345  43.409
  522    HA   TYR 618           HA       TYR 618  44.802  35.655  46.283
  523    HB2  TYR 618           HB2      TYR 618  44.840  33.584  44.050
  524    HB3  TYR 618           HB3      TYR 618  44.774  33.307  45.776
  525    HD1  TYR 618           HD2      TYR 618  42.816  34.641  42.948
  526    HD2  TYR 618           HD1      TYR 618  42.930  33.657  47.104
  527    HE1  TYR 618           HE2      TYR 618  40.306  34.520  42.971
  528    HE2  TYR 618           HE1      TYR 618  40.456  33.751  47.236
  529    HH   TYR 618           HH       TYR 618  38.526  34.224  46.013
  530    H    THR 619           H        THR 619  47.036  36.285  43.604
  531    HA   THR 619           HA       THR 619  49.111  35.894  45.608
  532    HB   THR 619           HB       THR 619  48.955  33.661  44.572
  533    HG1  THR 619           HG1      THR 619  50.962  33.665  44.929
  534   HG21  THR 619          HG21      THR 619  49.716  35.070  42.005
  535   HG22  THR 619          HG22      THR 619  50.149  33.393  42.339
  536   HG23  THR 619          HG23      THR 619  48.434  33.838  42.295
  537    HA   PRO 620           HA       PRO 620  51.112  39.409  43.722
  538    HB2  PRO 620           HB2      PRO 620  53.600  37.998  44.665
  539    HB3  PRO 620           HB3      PRO 620  53.167  39.711  44.844
  540    HG2  PRO 620           HG2      PRO 620  52.888  38.004  46.951
  541    HG3  PRO 620           HG3      PRO 620  51.522  39.113  46.599
  542    HD2  PRO 620           HD2      PRO 620  51.773  36.231  45.817
  543    HD3  PRO 620           HD3      PRO 620  50.395  37.143  46.523
  544    H    GLN 621           H        GLN 621  52.733  36.217  43.241
  545    HA   GLN 621           HA       GLN 621  52.747  36.605  40.351
  546    HB2  GLN 621           HB2      GLN 621  54.733  37.871  41.130
  547    HB3  GLN 621           HB3      GLN 621  55.338  36.438  41.953
  548    HG2  GLN 621           HG2      GLN 621  55.583  35.388  39.617
  549    HG3  GLN 621           HG3      GLN 621  55.236  37.013  38.982
  550   HE21  GLN 621          HE22      GLN 621  57.789  35.070  40.598
  551   HE22  GLN 621          HE21      GLN 621  58.923  36.385  40.555
  552    H    SER 622           H        SER 622  52.614  34.851  39.284
  553    HA   SER 622           HA       SER 622  53.342  32.206  40.435
  554    HB2  SER 622           HB2      SER 622  50.840  32.882  40.478
  555    HB3  SER 622           HB3      SER 622  50.901  32.575  38.738
  556    HG   SER 622           HG       SER 622  50.423  30.732  39.914
  557    HA   PRO 623           HA       PRO 623  55.655  32.237  36.445
  558    HB2  PRO 623           HB2      PRO 623  56.208  29.389  37.342
  559    HB3  PRO 623           HB3      PRO 623  57.354  30.605  36.723
  560    HG2  PRO 623           HG2      PRO 623  57.121  30.016  39.355
  561    HG3  PRO 623           HG3      PRO 623  57.372  31.718  38.824
  562    HD2  PRO 623           HD2      PRO 623  54.836  30.330  39.694
  563    HD3  PRO 623           HD3      PRO 623  55.435  31.948  40.105
  Start of MODEL   19
    1    H1   MET 553           H1       MET 553  25.396  39.520  15.614
    2    H2   MET 553           H2       MET 553  24.706  38.130  15.090
    3    H3   MET 553           H3       MET 553  25.770  38.138  16.344
    4    HA   MET 553           HA       MET 553  23.088  39.267  16.203
    5    HB2  MET 553           HB2      MET 553  23.328  36.792  16.534
    6    HB3  MET 553           HB3      MET 553  24.069  37.044  18.081
    7    HG2  MET 553           HG2      MET 553  21.697  36.640  18.437
    8    HG3  MET 553           HG3      MET 553  21.936  38.348  18.770
    9    HE1  MET 553           HE1      MET 553  20.518  35.604  16.742
   10    HE2  MET 553           HE2      MET 553  19.577  36.357  15.442
   11    HE3  MET 553           HE3      MET 553  21.349  36.211  15.291
   12    H    LYS 554           H        LYS 554  22.720  41.046  17.347
   13    HA   LYS 554           HA       LYS 554  23.065  42.933  18.782
   14    HB2  LYS 554           HB2      LYS 554  23.265  40.678  20.791
   15    HB3  LYS 554           HB3      LYS 554  22.871  42.362  21.107
   16    HG2  LYS 554           HG2      LYS 554  21.119  40.359  19.687
   17    HG3  LYS 554           HG3      LYS 554  20.897  41.184  21.249
   18    HD2  LYS 554           HD2      LYS 554  20.800  43.389  19.934
   19    HD3  LYS 554           HD3      LYS 554  20.786  42.377  18.459
   20    HE2  LYS 554           HE2      LYS 554  18.738  41.258  19.356
   21    HE3  LYS 554           HE3      LYS 554  18.846  42.262  20.792
   22    HZ1  LYS 554           HZ1      LYS 554  18.685  43.387  18.050
   23    HZ2  LYS 554           HZ2      LYS 554  17.375  43.057  18.917
   24    HZ3  LYS 554           HZ3      LYS 554  18.389  44.216  19.433
   25    H    MET 555           H        MET 555  25.379  42.764  17.479
   26    HA   MET 555           HA       MET 555  27.534  41.740  18.983
   27    HB2  MET 555           HB2      MET 555  27.861  41.962  16.637
   28    HB3  MET 555           HB3      MET 555  27.665  43.741  16.717
   29    HG2  MET 555           HG2      MET 555  29.970  42.995  16.358
   30    HG3  MET 555           HG3      MET 555  29.815  43.980  17.791
   31    HE1  MET 555           HE1      MET 555  32.173  41.841  16.658
   32    HE2  MET 555           HE2      MET 555  32.357  43.162  17.807
   33    HE3  MET 555           HE3      MET 555  32.826  41.516  18.298
   34    H    TRP 556           H        TRP 556  28.969  42.635  20.252
   35    HA   TRP 556           HA       TRP 556  28.174  44.858  21.926
   36    HB2  TRP 556           HB2      TRP 556  30.282  42.690  21.884
   37    HB3  TRP 556           HB3      TRP 556  30.485  44.108  22.904
   38    HD1  TRP 556           HD1      TRP 556  29.446  40.672  23.465
   39    HE1  TRP 556           HE1      TRP 556  27.947  40.440  25.450
   40    HE3  TRP 556           HE3      TRP 556  28.148  45.603  24.093
   41    HZ2  TRP 556           HZ2      TRP 556  26.614  42.186  27.377
   42    HZ3  TRP 556           HZ3      TRP 556  26.646  46.240  25.940
   43    HH2  TRP 556           HH2      TRP 556  25.907  44.545  27.611
   44    H    LYS 557           H        LYS 557  29.964  46.496  22.707
   45    HA   LYS 557           HA       LYS 557  32.001  47.373  20.736
   46    HB2  LYS 557           HB2      LYS 557  29.665  49.168  21.537
   47    HB3  LYS 557           HB3      LYS 557  31.102  49.684  20.676
   48    HG2  LYS 557           HG2      LYS 557  30.379  48.105  18.759
   49    HG3  LYS 557           HG3      LYS 557  28.923  47.809  19.670
   50    HD2  LYS 557           HD2      LYS 557  28.129  49.369  18.273
   51    HD3  LYS 557           HD3      LYS 557  28.520  50.367  19.655
   52    HE2  LYS 557           HE2      LYS 557  30.595  51.126  18.432
   53    HE3  LYS 557           HE3      LYS 557  30.121  50.054  17.089
   54    HZ1  LYS 557           HZ1      LYS 557  28.008  51.354  17.016
   55    HZ2  LYS 557           HZ2      LYS 557  28.617  52.377  18.122
   56    HZ3  LYS 557           HZ3      LYS 557  29.300  52.306  16.683
   57    HA   PRO 558           HA       PRO 558  34.263  48.499  24.449
   58    HB2  PRO 558           HB2      PRO 558  35.968  50.374  23.585
   59    HB3  PRO 558           HB3      PRO 558  35.973  48.696  22.939
   60    HG2  PRO 558           HG2      PRO 558  34.502  51.063  21.759
   61    HG3  PRO 558           HG3      PRO 558  35.771  50.096  20.936
   62    HD2  PRO 558           HD2      PRO 558  33.250  49.403  20.557
   63    HD3  PRO 558           HD3      PRO 558  34.368  48.096  21.039
   64    H    GLY 559           H        GLY 559  34.620  49.946  26.116
   65    HA2  GLY 559           HA2      GLY 559  34.107  51.506  27.657
   66    HA3  GLY 559           HA3      GLY 559  33.609  52.597  26.371
   67    H    ASP 560           H        ASP 560  32.433  49.584  28.069
   68    HA   ASP 560           HA       ASP 560  29.906  50.977  28.738
   69    HB2  ASP 560           HB2      ASP 560  30.187  49.183  26.479
   70    HB3  ASP 560           HB3      ASP 560  29.067  48.470  27.638
   71    H    GLU 561           H        GLU 561  30.005  50.852  30.861
   72    HA   GLU 561           HA       GLU 561  30.547  48.466  32.287
   73    HB2  GLU 561           HB2      GLU 561  29.045  49.368  34.127
   74    HB3  GLU 561           HB3      GLU 561  30.365  50.379  33.672
   75    HG2  GLU 561           HG2      GLU 561  28.934  51.930  32.511
   76    HG3  GLU 561           HG3      GLU 561  27.537  50.855  32.611
   77    H    CYS 562           H        CYS 562  29.830  46.603  32.083
   78    HA   CYS 562           HA       CYS 562  26.990  45.812  31.691
   79    HB2  CYS 562           HB2      CYS 562  29.312  44.511  30.187
   80    HB3  CYS 562           HB3      CYS 562  27.589  44.176  30.017
   81    HG   CYS 562           HG       CYS 562  29.016  47.051  29.472
   82    H    PHE 563           H        PHE 563  27.120  43.143  31.851
   83    HA   PHE 563           HA       PHE 563  28.381  42.466  34.492
   84    HB2  PHE 563           HB2      PHE 563  25.558  42.088  33.519
   85    HB3  PHE 563           HB3      PHE 563  26.364  40.759  34.372
   86    HD1  PHE 563           HD1      PHE 563  27.665  41.467  36.556
   87    HD2  PHE 563           HD2      PHE 563  24.167  43.383  34.955
   88    HE1  PHE 563           HE1      PHE 563  27.230  42.550  38.765
   89    HE2  PHE 563           HE2      PHE 563  23.875  44.640  37.090
   90    HZ   PHE 563           HZ       PHE 563  25.330  44.132  39.016
   91    H    ALA 564           H        ALA 564  30.017  41.181  34.103
   92    HA   ALA 564           HA       ALA 564  29.948  39.376  31.767
   93    HB1  ALA 564           HB1      ALA 564  32.462  39.607  31.989
   94    HB2  ALA 564           HB2      ALA 564  31.685  41.207  31.938
   95    HB3  ALA 564           HB3      ALA 564  32.204  40.549  33.474
   96    H    LEU 565           H        LEU 565  30.057  37.299  31.914
   97    HA   LEU 565           HA       LEU 565  29.758  35.884  34.417
   98    HB2  LEU 565           HB2      LEU 565  28.767  35.423  32.035
   99    HB3  LEU 565           HB3      LEU 565  30.358  34.853  31.592
  100    HG   LEU 565           HG       LEU 565  30.086  32.873  32.922
  101   HD11  LEU 565          HD11      LEU 565  27.930  34.539  34.304
  102   HD12  LEU 565          HD12      LEU 565  27.950  32.763  34.428
  103   HD13  LEU 565          HD13      LEU 565  29.328  33.747  35.018
  104   HD21  LEU 565          HD21      LEU 565  27.910  31.986  32.145
  105   HD22  LEU 565          HD22      LEU 565  27.391  33.642  31.762
  106   HD23  LEU 565          HD23      LEU 565  28.770  32.892  30.897
  107    H    TYR 566           H        TYR 566  31.402  35.616  35.781
  108    HA   TYR 566           HA       TYR 566  34.138  35.350  35.012
  109    HB2  TYR 566           HB2      TYR 566  32.942  36.097  37.220
  110    HB3  TYR 566           HB3      TYR 566  32.900  34.381  37.594
  111    HD1  TYR 566           HD1      TYR 566  35.639  36.492  35.991
  112    HD2  TYR 566           HD2      TYR 566  34.396  34.116  39.399
  113    HE1  TYR 566           HE1      TYR 566  37.916  36.638  36.942
  114    HE2  TYR 566           HE2      TYR 566  36.678  34.302  40.331
  115    HH   TYR 566           HH       TYR 566  39.219  36.098  38.815
  116    H    TRP 567           H        TRP 567  35.108  33.249  36.378
  117    HA   TRP 567           HA       TRP 567  34.155  30.975  34.676
  118    HB2  TRP 567           HB2      TRP 567  36.491  30.455  34.129
  119    HB3  TRP 567           HB3      TRP 567  36.052  32.017  33.555
  120    HD1  TRP 567           HD1      TRP 567  37.153  34.195  34.533
  121    HE1  TRP 567           HE1      TRP 567  39.267  34.600  35.897
  122    HE3  TRP 567           HE3      TRP 567  38.067  29.441  36.019
  123    HZ2  TRP 567           HZ2      TRP 567  40.835  33.136  37.893
  124    HZ3  TRP 567           HZ3      TRP 567  39.742  28.971  37.797
  125    HH2  TRP 567           HH2      TRP 567  41.029  30.856  38.835
  126    H    GLU 568           H        GLU 568  36.419  31.586  37.399
  127    HA   GLU 568           HA       GLU 568  36.605  29.424  38.886
  128    HB2  GLU 568           HB2      GLU 568  37.565  31.387  39.704
  129    HB3  GLU 568           HB3      GLU 568  36.043  32.284  39.576
  130    HG2  GLU 568           HG2      GLU 568  35.131  31.440  41.494
  131    HG3  GLU 568           HG3      GLU 568  36.432  30.296  41.826
  132    H    ASP 569           H        ASP 569  33.620  31.327  38.829
  133    HA   ASP 569           HA       ASP 569  32.221  29.172  40.285
  134    HB2  ASP 569           HB2      ASP 569  30.803  30.990  41.373
  135    HB3  ASP 569           HB3      ASP 569  32.448  30.976  41.944
  136    H    ASN 570           H        ASN 570  32.232  31.303  37.700
  137    HA   ASN 570           HA       ASN 570  30.931  31.829  35.994
  138    HB2  ASN 570           HB2      ASN 570  30.995  29.246  36.024
  139    HB3  ASN 570           HB3      ASN 570  29.291  29.340  36.463
  140   HD21  ASN 570          HD22      ASN 570  31.565  31.023  34.153
  141   HD22  ASN 570          HD21      ASN 570  30.634  30.471  32.769
  142    H    LYS 571           H        LYS 571  30.356  33.266  38.060
  143    HA   LYS 571           HA       LYS 571  27.452  34.014  37.762
  144    HB2  LYS 571           HB2      LYS 571  29.515  34.255  39.969
  145    HB3  LYS 571           HB3      LYS 571  28.302  35.510  39.811
  146    HG2  LYS 571           HG2      LYS 571  27.549  32.571  40.042
  147    HG3  LYS 571           HG3      LYS 571  27.805  33.668  41.416
  148    HD2  LYS 571           HD2      LYS 571  26.135  35.246  40.102
  149    HD3  LYS 571           HD3      LYS 571  25.653  33.787  39.283
  150    HE2  LYS 571           HE2      LYS 571  24.157  33.942  41.093
  151    HE3  LYS 571           HE3      LYS 571  25.339  32.802  41.741
  152    HZ1  LYS 571           HZ1      LYS 571  24.964  35.613  42.479
  153    HZ2  LYS 571           HZ2      LYS 571  25.125  34.364  43.442
  154    HZ3  LYS 571           HZ3      LYS 571  26.419  34.949  42.736
  155    H    PHE 572           H        PHE 572  26.986  36.284  37.892
  156    HA   PHE 572           HA       PHE 572  28.674  37.582  35.889
  157    HB2  PHE 572           HB2      PHE 572  25.858  38.333  36.816
  158    HB3  PHE 572           HB3      PHE 572  26.720  39.021  35.464
  159    HD1  PHE 572           HD2      PHE 572  27.210  37.623  33.377
  160    HD2  PHE 572           HD1      PHE 572  24.533  36.377  36.505
  161    HE1  PHE 572           HE2      PHE 572  26.178  35.975  31.839
  162    HE2  PHE 572           HE1      PHE 572  23.675  34.536  35.003
  163    HZ   PHE 572           HZ       PHE 572  24.506  34.396  32.648
  164    H    TYR 573           H        TYR 573  29.954  39.181  36.479
  165    HA   TYR 573           HA       TYR 573  29.462  40.900  38.865
  166    HB2  TYR 573           HB2      TYR 573  32.069  39.889  37.680
  167    HB3  TYR 573           HB3      TYR 573  31.926  41.023  39.021
  168    HD1  TYR 573           HD2      TYR 573  31.485  37.513  37.954
  169    HD2  TYR 573           HD1      TYR 573  31.342  40.254  41.278
  170    HE1  TYR 573           HE2      TYR 573  31.666  35.612  39.518
  171    HE2  TYR 573           HE1      TYR 573  31.066  38.333  42.831
  172    HH   TYR 573           HH       TYR 573  31.504  35.069  41.896
  173    H    ARG 574           H        ARG 574  29.858  43.041  38.572
  174    HA   ARG 574           HA       ARG 574  29.440  44.244  36.021
  175    HB2  ARG 574           HB2      ARG 574  30.505  45.312  38.658
  176    HB3  ARG 574           HB3      ARG 574  30.156  46.356  37.278
  177    HG2  ARG 574           HG2      ARG 574  27.759  45.471  37.329
  178    HG3  ARG 574           HG3      ARG 574  28.196  44.725  38.895
  179    HD2  ARG 574           HD2      ARG 574  28.761  47.068  39.688
  180    HD3  ARG 574           HD3      ARG 574  28.276  47.646  38.079
  181    HE   ARG 574           HE       ARG 574  26.366  46.120  39.827
  182   HH11  ARG 574          HH11      ARG 574  27.155  49.071  38.126
  183   HH12  ARG 574          HH12      ARG 574  25.527  49.588  37.972
  184   HH21  ARG 574          HH21      ARG 574  24.324  46.784  39.665
  185   HH22  ARG 574          HH22      ARG 574  23.916  48.376  39.078
  186    H    ALA 575           H        ALA 575  30.712  44.998  34.537
  187    HA   ALA 575           HA       ALA 575  33.543  45.520  35.038
  188    HB1  ALA 575           HB1      ALA 575  32.408  43.460  33.113
  189    HB2  ALA 575           HB2      ALA 575  34.123  44.009  33.073
  190    HB3  ALA 575           HB3      ALA 575  33.513  43.046  34.427
  191    H    GLU 576           H        GLU 576  34.217  47.153  33.846
  192    HA   GLU 576           HA       GLU 576  32.514  48.434  31.829
  193    HB2  GLU 576           HB2      GLU 576  35.066  49.104  33.289
  194    HB3  GLU 576           HB3      GLU 576  34.680  49.962  31.791
  195    HG2  GLU 576           HG2      GLU 576  32.568  50.732  32.710
  196    HG3  GLU 576           HG3      GLU 576  32.871  49.827  34.223
  197    H    VAL 577           H        VAL 577  32.374  47.442  30.039
  198    HA   VAL 577           HA       VAL 577  34.161  45.819  28.607
  199    HB   VAL 577           HB       VAL 577  31.917  47.701  27.921
  200   HG11  VAL 577          HG11      VAL 577  33.890  46.739  25.904
  201   HG12  VAL 577          HG12      VAL 577  32.141  46.516  25.552
  202   HG13  VAL 577          HG13      VAL 577  32.778  48.116  25.922
  203   HG21  VAL 577          HG21      VAL 577  31.308  45.606  28.812
  204   HG22  VAL 577          HG22      VAL 577  30.827  45.694  27.094
  205   HG23  VAL 577          HG23      VAL 577  32.210  44.702  27.543
  206    H    GLU 578           H        GLU 578  36.045  46.162  27.708
  207    HA   GLU 578           HA       GLU 578  36.976  48.953  27.189
  208    HB2  GLU 578           HB2      GLU 578  38.083  47.767  29.061
  209    HB3  GLU 578           HB3      GLU 578  38.525  46.455  28.028
  210    HG2  GLU 578           HG2      GLU 578  40.424  47.834  28.349
  211    HG3  GLU 578           HG3      GLU 578  39.932  47.891  26.662
  212    H    ALA 579           H        ALA 579  37.009  45.600  25.821
  213    HA   ALA 579           HA       ALA 579  37.017  46.830  23.190
  214    HB1  ALA 579           HB1      ALA 579  39.403  45.314  24.346
  215    HB2  ALA 579           HB2      ALA 579  39.205  45.503  22.596
  216    HB3  ALA 579           HB3      ALA 579  39.362  46.945  23.657
  217    H    LEU 580           H        LEU 580  35.450  45.810  22.241
  218    HA   LEU 580           HA       LEU 580  35.200  42.866  22.627
  219    HB2  LEU 580           HB2      LEU 580  32.857  44.637  22.108
  220    HB3  LEU 580           HB3      LEU 580  32.869  42.953  22.574
  221    HG   LEU 580           HG       LEU 580  33.020  45.396  24.141
  222   HD11  LEU 580          HD11      LEU 580  31.676  42.691  24.511
  223   HD12  LEU 580          HD12      LEU 580  32.089  43.440  25.979
  224   HD13  LEU 580          HD13      LEU 580  31.093  44.357  24.869
  225   HD21  LEU 580          HD21      LEU 580  34.840  43.213  24.998
  226   HD22  LEU 580          HD22      LEU 580  35.011  44.993  25.092
  227   HD23  LEU 580          HD23      LEU 580  33.994  44.222  26.230
  228    H    HIS 581           H        HIS 581  36.861  43.302  20.698
  229    HA   HIS 581           HA       HIS 581  35.413  42.704  18.164
  230    HB2  HIS 581           HB2      HIS 581  36.569  44.291  16.890
  231    HB3  HIS 581           HB3      HIS 581  35.548  45.073  18.106
  232    HD2  HIS 581           HD2      HIS 581  38.133  46.303  16.436
  233    HE1  HIS 581           HE1      HIS 581  40.127  46.351  20.169
  234    HE2  HIS 581           HE2      HIS 581  40.221  47.063  17.785
  235    H    SER 582           H        SER 582  37.466  41.216  20.104
  236    HA   SER 582           HA       SER 582  39.774  40.818  18.494
  237    HB2  SER 582           HB2      SER 582  38.441  38.852  20.361
  238    HB3  SER 582           HB3      SER 582  40.188  38.970  19.914
  239    HG   SER 582           HG       SER 582  39.414  39.759  21.965
  240    H    SER 583           H        SER 583  40.039  38.072  18.047
  241    HA   SER 583           HA       SER 583  39.382  38.202  15.353
  242    HB2  SER 583           HB2      SER 583  40.546  36.026  15.280
  243    HB3  SER 583           HB3      SER 583  41.337  37.206  16.326
  244    HG   SER 583           HG       SER 583  40.972  35.081  17.225
  245    H    GLY 584           H        GLY 584  37.219  36.725  17.773
  246    HA2  GLY 584           HA2      GLY 584  35.340  36.223  15.610
  247    HA3  GLY 584           HA3      GLY 584  36.036  34.708  16.131
  248    H    MET 585           H        MET 585  35.965  35.922  19.060
  249    HA   MET 585           HA       MET 585  33.139  35.699  19.535
  250    HB2  MET 585           HB2      MET 585  32.916  33.498  20.385
  251    HB3  MET 585           HB3      MET 585  33.548  33.393  18.770
  252    HG2  MET 585           HG2      MET 585  35.130  33.073  21.370
  253    HG3  MET 585           HG3      MET 585  34.498  31.769  20.362
  254    HE1  MET 585           HE1      MET 585  37.661  32.883  21.567
  255    HE2  MET 585           HE2      MET 585  37.167  31.217  21.257
  256    HE3  MET 585           HE3      MET 585  38.553  31.910  20.380
  257    H    THR 586           H        THR 586  35.870  36.912  20.701
  258    HA   THR 586           HA       THR 586  34.773  36.782  23.462
  259    HB   THR 586           HB       THR 586  37.137  36.969  24.310
  260    HG1  THR 586           HG1      THR 586  38.455  37.227  22.753
  261   HG21  THR 586          HG21      THR 586  37.531  34.607  24.294
  262   HG22  THR 586          HG22      THR 586  35.787  34.877  24.431
  263   HG23  THR 586          HG23      THR 586  36.468  34.377  22.876
  264    H    ALA 587           H        ALA 587  35.439  38.475  24.861
  265    HA   ALA 587           HA       ALA 587  36.116  41.034  23.654
  266    HB1  ALA 587           HB1      ALA 587  33.764  41.492  25.170
  267    HB2  ALA 587           HB2      ALA 587  33.852  41.273  23.361
  268    HB3  ALA 587           HB3      ALA 587  33.440  39.950  24.458
  269    H    VAL 588           H        VAL 588  36.805  42.473  25.044
  270    HA   VAL 588           HA       VAL 588  38.023  41.451  27.538
  271    HB   VAL 588           HB       VAL 588  38.702  44.048  26.080
  272   HG11  VAL 588          HG11      VAL 588  40.125  42.463  28.167
  273   HG12  VAL 588          HG12      VAL 588  40.795  43.848  27.239
  274   HG13  VAL 588          HG13      VAL 588  39.397  44.098  28.271
  275   HG21  VAL 588          HG21      VAL 588  40.627  42.862  25.069
  276   HG22  VAL 588          HG22      VAL 588  40.165  41.351  25.879
  277   HG23  VAL 588          HG23      VAL 588  39.190  41.988  24.546
  278    H    VAL 589           H        VAL 589  37.208  42.127  29.425
  279    HA   VAL 589           HA       VAL 589  35.789  44.734  29.608
  280    HB   VAL 589           HB       VAL 589  34.041  43.663  30.946
  281   HG11  VAL 589          HG11      VAL 589  33.998  43.980  28.372
  282   HG12  VAL 589          HG12      VAL 589  34.224  42.241  28.271
  283   HG13  VAL 589          HG13      VAL 589  32.774  42.916  29.056
  284   HG21  VAL 589          HG21      VAL 589  35.664  41.142  30.497
  285   HG22  VAL 589          HG22      VAL 589  34.687  41.661  31.876
  286   HG23  VAL 589          HG23      VAL 589  33.942  40.965  30.402
  287    H    LYS 590           H        LYS 590  36.465  45.935  31.466
  288    HA   LYS 590           HA       LYS 590  38.267  44.610  33.419
  289    HB2  LYS 590           HB2      LYS 590  39.289  46.582  32.373
  290    HB3  LYS 590           HB3      LYS 590  37.870  47.534  32.660
  291    HG2  LYS 590           HG2      LYS 590  38.314  47.758  35.013
  292    HG3  LYS 590           HG3      LYS 590  39.377  46.381  35.057
  293    HD2  LYS 590           HD2      LYS 590  41.200  47.653  34.177
  294    HD3  LYS 590           HD3      LYS 590  40.119  48.699  33.260
  295    HE2  LYS 590           HE2      LYS 590  39.840  48.833  36.238
  296    HE3  LYS 590           HE3      LYS 590  41.392  49.291  35.588
  297    HZ1  LYS 590           HZ1      LYS 590  40.189  51.240  35.501
  298    HZ2  LYS 590           HZ2      LYS 590  40.109  50.699  33.972
  299    HZ3  LYS 590           HZ3      LYS 590  38.802  50.564  34.964
  300    H    PHE 591           H        PHE 591  37.281  43.836  35.056
  301    HA   PHE 591           HA       PHE 591  34.755  44.345  36.136
  302    HB2  PHE 591           HB2      PHE 591  37.240  43.361  37.479
  303    HB3  PHE 591           HB3      PHE 591  35.639  43.226  38.205
  304    HD1  PHE 591           HD2      PHE 591  33.746  42.013  36.893
  305    HD2  PHE 591           HD1      PHE 591  37.919  41.884  35.879
  306    HE1  PHE 591           HE2      PHE 591  33.375  39.873  35.712
  307    HE2  PHE 591           HE1      PHE 591  37.559  39.770  34.620
  308    HZ   PHE 591           HZ       PHE 591  35.294  38.747  34.544
  309    H    ILE 592           H        ILE 592  33.900  46.061  37.012
  310    HA   ILE 592           HA       ILE 592  35.512  48.271  37.891
  311    HB   ILE 592           HB       ILE 592  32.647  48.288  38.623
  312   HG12  ILE 592          HG12      ILE 592  33.497  48.200  35.693
  313   HG13  ILE 592          HG13      ILE 592  32.468  47.026  36.529
  314   HG21  ILE 592          HG21      ILE 592  34.407  50.167  36.999
  315   HG22  ILE 592          HG22      ILE 592  32.862  50.525  37.813
  316   HG23  ILE 592          HG23      ILE 592  34.315  50.150  38.774
  317   HD11  ILE 592          HD11      ILE 592  31.769  49.943  36.059
  318   HD12  ILE 592          HD12      ILE 592  31.160  48.550  35.164
  319   HD13  ILE 592          HD13      ILE 592  30.752  48.741  36.900
  320    H    ASP 593           H        ASP 593  34.235  45.459  39.506
  321    HA   ASP 593           HA       ASP 593  34.497  46.733  42.159
  322    HB2  ASP 593           HB2      ASP 593  32.594  45.220  41.654
  323    HB3  ASP 593           HB3      ASP 593  33.757  43.855  41.667
  324    H    TYR 594           H        TYR 594  36.767  45.557  40.172
  325    HA   TYR 594           HA       TYR 594  38.580  44.742  42.387
  326    HB2  TYR 594           HB2      TYR 594  38.203  43.129  39.830
  327    HB3  TYR 594           HB3      TYR 594  39.423  42.830  41.029
  328    HD1  TYR 594           HD1      TYR 594  35.757  42.628  40.261
  329    HD2  TYR 594           HD2      TYR 594  38.838  41.565  43.117
  330    HE1  TYR 594           HE1      TYR 594  34.228  41.178  41.307
  331    HE2  TYR 594           HE2      TYR 594  37.244  39.990  44.202
  332    HH   TYR 594           HH       TYR 594  33.892  39.871  43.250
  333    H    GLY 595           H        GLY 595  38.438  45.579  38.844
  334    HA2  GLY 595           HA2      GLY 595  39.460  47.683  38.290
  335    HA3  GLY 595           HA3      GLY 595  40.787  47.340  39.366
  336    H    ASN 596           H        ASN 596  39.952  44.574  37.290
  337    HA   ASN 596           HA       ASN 596  42.085  45.331  35.401
  338    HB2  ASN 596           HB2      ASN 596  42.593  42.643  35.903
  339    HB3  ASN 596           HB3      ASN 596  43.596  43.950  36.417
  340   HD21  ASN 596          HD22      ASN 596  44.017  43.989  38.679
  341   HD22  ASN 596          HD21      ASN 596  43.106  43.131  39.882
  342    H    TYR 597           H        TYR 597  42.248  43.860  33.558
  343    HA   TYR 597           HA       TYR 597  39.527  42.946  32.761
  344    HB2  TYR 597           HB2      TYR 597  40.343  43.444  30.355
  345    HB3  TYR 597           HB3      TYR 597  39.537  44.620  31.360
  346    HD1  TYR 597           HD2      TYR 597  41.398  46.002  32.885
  347    HD2  TYR 597           HD1      TYR 597  42.027  44.308  28.948
  348    HE1  TYR 597           HE2      TYR 597  43.246  47.532  32.541
  349    HE2  TYR 597           HE1      TYR 597  43.791  45.967  28.532
  350    HH   TYR 597           HH       TYR 597  45.144  47.538  29.535
  351    H    GLU 598           H        GLU 598  39.072  41.356  31.595
  352    HA   GLU 598           HA       GLU 598  41.096  39.830  30.165
  353    HB2  GLU 598           HB2      GLU 598  40.585  37.708  31.165
  354    HB3  GLU 598           HB3      GLU 598  41.170  38.859  32.399
  355    HG2  GLU 598           HG2      GLU 598  39.098  39.117  33.364
  356    HG3  GLU 598           HG3      GLU 598  38.226  38.309  32.061
  357    H    GLU 599           H        GLU 599  40.388  38.338  28.691
  358    HA   GLU 599           HA       GLU 599  37.977  38.951  27.270
  359    HB2  GLU 599           HB2      GLU 599  40.203  36.900  26.878
  360    HB3  GLU 599           HB3      GLU 599  38.794  37.036  25.788
  361    HG2  GLU 599           HG2      GLU 599  39.184  39.451  25.661
  362    HG3  GLU 599           HG3      GLU 599  40.777  39.234  26.387
  363    H    VAL 600           H        VAL 600  36.098  38.096  27.251
  364    HA   VAL 600           HA       VAL 600  35.314  35.483  28.487
  365    HB   VAL 600           HB       VAL 600  34.063  38.226  28.528
  366   HG11  VAL 600          HG11      VAL 600  32.860  35.712  29.728
  367   HG12  VAL 600          HG12      VAL 600  32.243  37.378  29.884
  368   HG13  VAL 600          HG13      VAL 600  32.263  36.583  28.304
  369   HG21  VAL 600          HG21      VAL 600  35.866  37.612  30.416
  370   HG22  VAL 600          HG22      VAL 600  34.348  38.516  30.747
  371   HG23  VAL 600          HG23      VAL 600  34.521  36.832  31.192
  372    H    LEU 601           H        LEU 601  33.722  34.421  27.059
  373    HA   LEU 601           HA       LEU 601  33.504  35.196  24.376
  374    HB2  LEU 601           HB2      LEU 601  33.004  32.920  25.556
  375    HB3  LEU 601           HB3      LEU 601  31.441  33.535  25.928
  376    HG   LEU 601           HG       LEU 601  31.746  33.816  23.041
  377   HD11  LEU 601          HD11      LEU 601  32.133  30.996  24.111
  378   HD12  LEU 601          HD12      LEU 601  32.102  31.498  22.405
  379   HD13  LEU 601          HD13      LEU 601  33.501  31.892  23.416
  380   HD21  LEU 601          HD21      LEU 601  29.626  33.582  23.883
  381   HD22  LEU 601          HD22      LEU 601  29.938  31.998  23.146
  382   HD23  LEU 601          HD23      LEU 601  30.054  32.159  24.895
  383    H    LEU 602           H        LEU 602  31.947  36.388  23.153
  384    HA   LEU 602           HA       LEU 602  30.843  38.700  24.277
  385    HB2  LEU 602           HB2      LEU 602  30.006  37.109  21.848
  386    HB3  LEU 602           HB3      LEU 602  29.622  38.781  22.049
  387    HG   LEU 602           HG       LEU 602  32.573  37.850  22.087
  388   HD11  LEU 602          HD11      LEU 602  30.836  38.552  19.719
  389   HD12  LEU 602          HD12      LEU 602  32.605  38.465  19.677
  390   HD13  LEU 602          HD13      LEU 602  31.635  37.005  20.046
  391   HD21  LEU 602          HD21      LEU 602  31.987  40.256  22.785
  392   HD22  LEU 602          HD22      LEU 602  33.179  39.997  21.490
  393   HD23  LEU 602          HD23      LEU 602  31.531  40.493  21.076
  394    H    SER 603           H        SER 603  29.096  35.655  23.598
  395    HA   SER 603           HA       SER 603  26.516  36.638  24.469
  396    HB2  SER 603           HB2      SER 603  27.417  33.734  24.074
  397    HB3  SER 603           HB3      SER 603  25.765  34.340  24.287
  398    HG   SER 603           HG       SER 603  25.940  34.481  22.321
  399    H    ASN 604           H        ASN 604  29.159  35.834  26.273
  400    HA   ASN 604           HA       ASN 604  27.777  34.843  28.706
  401    HB2  ASN 604           HB2      ASN 604  30.735  35.046  27.939
  402    HB3  ASN 604           HB3      ASN 604  30.092  34.579  29.505
  403   HD21  ASN 604          HD22      ASN 604  31.392  32.744  29.065
  404   HD22  ASN 604          HD21      ASN 604  30.624  31.370  28.265
  405    H    ILE 605           H        ILE 605  29.005  37.818  27.319
  406    HA   ILE 605           HA       ILE 605  28.859  39.307  29.886
  407    HB   ILE 605           HB       ILE 605  29.334  40.654  27.225
  408   HG12  ILE 605          HG12      ILE 605  31.628  39.459  28.846
  409   HG13  ILE 605          HG13      ILE 605  30.987  38.667  27.404
  410   HG21  ILE 605          HG21      ILE 605  30.198  41.090  30.092
  411   HG22  ILE 605          HG22      ILE 605  30.494  42.206  28.729
  412   HG23  ILE 605          HG23      ILE 605  28.832  41.871  29.241
  413   HD11  ILE 605          HD11      ILE 605  32.201  41.427  27.249
  414   HD12  ILE 605          HD12      ILE 605  32.866  39.842  26.738
  415   HD13  ILE 605          HD13      ILE 605  31.406  40.485  25.976
  416    H    LYS 606           H        LYS 606  26.920  39.931  30.508
  417    HA   LYS 606           HA       LYS 606  24.686  40.327  28.569
  418    HB2  LYS 606           HB2      LYS 606  24.387  40.206  31.616
  419    HB3  LYS 606           HB3      LYS 606  23.172  39.960  30.409
  420    HG2  LYS 606           HG2      LYS 606  25.487  38.004  30.854
  421    HG3  LYS 606           HG3      LYS 606  23.901  37.842  31.591
  422    HD2  LYS 606           HD2      LYS 606  22.822  37.840  29.413
  423    HD3  LYS 606           HD3      LYS 606  24.400  37.976  28.594
  424    HE2  LYS 606           HE2      LYS 606  25.059  35.818  29.882
  425    HE3  LYS 606           HE3      LYS 606  23.361  35.739  30.370
  426    HZ1  LYS 606           HZ1      LYS 606  23.970  34.426  28.372
  427    HZ2  LYS 606           HZ2      LYS 606  22.768  35.527  28.097
  428    HZ3  LYS 606           HZ3      LYS 606  24.280  35.819  27.567
  429    HA   PRO 607           HA       PRO 607  24.883  44.702  29.544
  430    HB2  PRO 607           HB2      PRO 607  22.356  45.495  29.727
  431    HB3  PRO 607           HB3      PRO 607  23.224  45.195  28.156
  432    HG2  PRO 607           HG2      PRO 607  21.395  43.305  29.648
  433    HG3  PRO 607           HG3      PRO 607  21.311  43.748  27.896
  434    HD2  PRO 607           HD2      PRO 607  22.459  41.496  28.691
  435    HD3  PRO 607           HD3      PRO 607  23.291  42.474  27.455
  436    H    ILE 608           H        ILE 608  24.309  46.201  31.241
  437    HA   ILE 608           HA       ILE 608  24.489  44.892  33.811
  438    HB   ILE 608           HB       ILE 608  25.627  47.165  32.696
  439   HG12  ILE 608          HG12      ILE 608  25.488  46.326  35.605
  440   HG13  ILE 608          HG13      ILE 608  26.499  45.596  34.357
  441   HG21  ILE 608          HG21      ILE 608  24.144  48.211  35.053
  442   HG22  ILE 608          HG22      ILE 608  25.078  49.063  33.787
  443   HG23  ILE 608          HG23      ILE 608  23.494  48.363  33.375
  444   HD11  ILE 608          HD11      ILE 608  27.979  47.080  35.561
  445   HD12  ILE 608          HD12      ILE 608  27.598  47.883  34.018
  446   HD13  ILE 608          HD13      ILE 608  26.866  48.440  35.507
  447    H    LEU 609           H        LEU 609  21.813  46.356  32.113
  448    HA   LEU 609           HA       LEU 609  20.200  45.715  34.466
  449    HB2  LEU 609           HB2      LEU 609  18.839  47.639  34.230
  450    HB3  LEU 609           HB3      LEU 609  20.492  48.034  34.567
  451    HG   LEU 609           HG       LEU 609  20.897  49.052  32.444
  452   HD11  LEU 609          HD11      LEU 609  20.048  47.679  30.808
  453   HD12  LEU 609          HD12      LEU 609  18.377  47.728  31.447
  454   HD13  LEU 609          HD13      LEU 609  19.121  49.151  30.654
  455   HD21  LEU 609          HD21      LEU 609  18.151  49.843  33.415
  456   HD22  LEU 609          HD22      LEU 609  19.721  50.525  33.915
  457   HD23  LEU 609          HD23      LEU 609  19.168  50.791  32.288
  458    H    GLU 610           H        GLU 610  17.842  45.640  33.748
  459    HA   GLU 610           HA       GLU 610  17.325  44.372  31.117
  460    HB2  GLU 610           HB2      GLU 610  16.800  43.182  33.869
  461    HB3  GLU 610           HB3      GLU 610  16.245  42.486  32.328
  462    HG2  GLU 610           HG2      GLU 610  18.585  42.020  31.727
  463    HG3  GLU 610           HG3      GLU 610  19.121  42.709  33.259
  464    H1   TYR 611           H1       TYR 611  46.649  39.529  30.337
  465    H2   TYR 611           H2       TYR 611  46.027  39.739  31.842
  466    H3   TYR 611           H3       TYR 611  47.116  38.543  31.558
  467    HA   TYR 611           HA       TYR 611  48.777  40.208  30.971
  468    HB2  TYR 611           HB2      TYR 611  47.491  42.070  30.469
  469    HB3  TYR 611           HB3      TYR 611  46.573  42.004  31.967
  470    HD1  TYR 611           HD1      TYR 611  50.117  42.328  30.733
  471    HD2  TYR 611           HD2      TYR 611  47.178  43.551  33.652
  472    HE1  TYR 611           HE1      TYR 611  51.642  44.119  31.526
  473    HE2  TYR 611           HE2      TYR 611  48.789  45.207  34.566
  474    HH   TYR 611           HH       TYR 611  51.843  45.833  32.932
  475    H    SER 612           H        SER 612  50.389  40.269  32.515
  476    HA   SER 612           HA       SER 612  51.540  39.723  34.386
  477    HB2  SER 612           HB2      SER 612  49.485  41.507  35.650
  478    HB3  SER 612           HB3      SER 612  51.052  41.016  36.330
  479    HG   SER 612           HG       SER 612  50.597  42.522  33.994
  480    HA   PRO 613           HA       PRO 613  48.358  36.323  35.616
  481    HB2  PRO 613           HB2      PRO 613  50.847  34.647  35.635
  482    HB3  PRO 613           HB3      PRO 613  49.249  34.191  35.015
  483    HG2  PRO 613           HG2      PRO 613  51.029  34.871  33.196
  484    HG3  PRO 613           HG3      PRO 613  49.373  35.513  33.158
  485    HD2  PRO 613           HD2      PRO 613  51.864  36.996  34.187
  486    HD3  PRO 613           HD3      PRO 613  50.649  37.565  33.056
  487    H    SER 614           H        SER 614  51.208  37.285  37.415
  488    HA   SER 614           HA       SER 614  50.143  35.846  39.813
  489    HB2  SER 614           HB2      SER 614  52.978  36.924  39.617
  490    HB3  SER 614           HB3      SER 614  52.263  35.885  40.827
  491    HG   SER 614           HG       SER 614  52.678  34.265  39.570
  492    H    SER 615           H        SER 615  49.787  38.788  38.547
  493    HA   SER 615           HA       SER 615  49.950  40.239  41.108
  494    HB2  SER 615           HB2      SER 615  48.974  41.224  38.399
  495    HB3  SER 615           HB3      SER 615  49.135  42.208  39.852
  496    HG   SER 615           HG       SER 615  51.095  42.270  38.732
  497    HA   PRO 616           HA       PRO 616  45.818  38.710  42.284
  498    HB2  PRO 616           HB2      PRO 616  45.570  39.984  44.638
  499    HB3  PRO 616           HB3      PRO 616  46.762  38.670  44.331
  500    HG2  PRO 616           HG2      PRO 616  47.200  41.638  44.213
  501    HG3  PRO 616           HG3      PRO 616  48.169  40.420  45.152
  502    HD2  PRO 616           HD2      PRO 616  48.930  41.351  42.753
  503    HD3  PRO 616           HD3      PRO 616  49.221  39.662  43.201
  504   HC11  DA2 617          HC11      DA2 617  37.508  39.071  38.077
  505   HC12  DA2 617          HC12      DA2 617  36.022  39.967  38.362
  506   HC13  DA2 617          HC13      DA2 617  37.478  40.496  39.162
  507   HC21  DA2 617          HC21      DA2 617  34.879  38.237  38.952
  508   HC22  DA2 617          HC22      DA2 617  34.575  38.949  40.535
  509   HC23  DA2 617          HC23      DA2 617  35.106  37.267  40.392
  510    H2   DA2 617           H        DA2 617  43.628  39.296  42.167
  511    HA   DA2 617           HA       DA2 617  42.921  41.799  40.934
  512   HCB1  DA2 617          HCB1      DA2 617  41.971  39.527  40.419
  513   HCB2  DA2 617          HCB2      DA2 617  40.760  40.749  40.717
  514   HCG1  DA2 617          HCG1      DA2 617  41.680  38.726  42.844
  515   HCG2  DA2 617          HCG2      DA2 617  40.370  39.868  42.983
  516   HCD1  DA2 617          HCD1      DA2 617  40.451  37.370  41.234
  517   HCD2  DA2 617          HCD2      DA2 617  39.501  37.729  42.664
  518    HNE  DA2 617           HNE      DA2 617  39.204  39.374  40.165
  519   HNH2  DA2 617          HNH2      DA2 617  37.933  36.973  42.372
  520   HNH1  DA2 617          HNH1      DA2 617  36.265  37.329  42.162
  521    H    TYR 618           H        TYR 618  43.185  40.805  44.194
  522    HA   TYR 618           HA       TYR 618  42.128  43.337  45.283
  523    HB2  TYR 618           HB2      TYR 618  40.666  42.263  46.883
  524    HB3  TYR 618           HB3      TYR 618  40.116  42.214  45.250
  525    HD1  TYR 618           HD2      TYR 618  42.608  39.580  46.028
  526    HD2  TYR 618           HD1      TYR 618  38.456  40.700  46.114
  527    HE1  TYR 618           HE2      TYR 618  41.952  37.182  46.118
  528    HE2  TYR 618           HE1      TYR 618  37.814  38.250  46.313
  529    HH   TYR 618           HH       TYR 618  38.684  36.036  46.246
  530    H    THR 619           H        THR 619  42.497  43.414  47.653
  531    HA   THR 619           HA       THR 619  45.012  42.067  48.551
  532    HB   THR 619           HB       THR 619  45.673  44.252  47.729
  533    HG1  THR 619           HG1      THR 619  46.376  45.040  49.688
  534   HG21  THR 619          HG21      THR 619  43.530  45.499  47.741
  535   HG22  THR 619          HG22      THR 619  43.487  45.464  49.513
  536   HG23  THR 619          HG23      THR 619  44.738  46.379  48.669
  537    HA   PRO 620           HA       PRO 620  42.377  41.579  52.030
  538    HB2  PRO 620           HB2      PRO 620  43.924  40.262  53.751
  539    HB3  PRO 620           HB3      PRO 620  43.692  39.625  52.085
  540    HG2  PRO 620           HG2      PRO 620  45.937  41.389  53.134
  541    HG3  PRO 620           HG3      PRO 620  46.149  39.812  52.302
  542    HD2  PRO 620           HD2      PRO 620  46.273  42.187  50.985
  543    HD3  PRO 620           HD3      PRO 620  45.614  40.716  50.222
  544    H    GLN 621           H        GLN 621  44.891  43.847  52.126
  545    HA   GLN 621           HA       GLN 621  45.920  45.198  53.658
  546    HB2  GLN 621           HB2      GLN 621  43.056  45.810  54.450
  547    HB3  GLN 621           HB3      GLN 621  44.458  46.859  54.564
  548    HG2  GLN 621           HG2      GLN 621  44.802  46.644  52.087
  549    HG3  GLN 621           HG3      GLN 621  43.289  45.745  51.943
  550   HE21  GLN 621          HE22      GLN 621  41.345  47.072  53.182
  551   HE22  GLN 621          HE21      GLN 621  41.298  48.777  52.788
  552    H    SER 622           H        SER 622  45.882  42.579  54.672
  553    HA   SER 622           HA       SER 622  46.490  43.120  57.500
  554    HB2  SER 622           HB2      SER 622  44.485  41.057  56.521
  555    HB3  SER 622           HB3      SER 622  45.410  40.852  58.031
  556    HG   SER 622           HG       SER 622  44.081  43.235  57.572
  557    HA   PRO 623           HA       PRO 623  49.743  40.195  56.049
  558    HB2  PRO 623           HB2      PRO 623  49.627  39.555  59.004
  559    HB3  PRO 623           HB3      PRO 623  51.117  39.701  58.011
  560    HG2  PRO 623           HG2      PRO 623  50.446  41.741  59.621
  561    HG3  PRO 623           HG3      PRO 623  50.829  42.106  57.900
  562    HD2  PRO 623           HD2      PRO 623  48.130  41.733  59.226
  563    HD3  PRO 623           HD3      PRO 623  48.642  43.063  58.180
  Start of MODEL   20
    1    H1   MET 553           H1       MET 553  20.096  35.114  20.019
    2    H2   MET 553           H2       MET 553  21.337  35.651  20.981
    3    H3   MET 553           H3       MET 553  21.387  35.921  19.388
    4    HA   MET 553           HA       MET 553  19.464  37.376  19.498
    5    HB2  MET 553           HB2      MET 553  18.485  36.079  21.380
    6    HB3  MET 553           HB3      MET 553  19.574  36.866  22.510
    7    HG2  MET 553           HG2      MET 553  17.627  38.263  20.643
    8    HG3  MET 553           HG3      MET 553  17.296  37.828  22.328
    9    HE1  MET 553           HE1      MET 553  16.423  40.223  22.827
   10    HE2  MET 553           HE2      MET 553  17.260  41.749  22.434
   11    HE3  MET 553           HE3      MET 553  16.650  40.745  21.136
   12    H    LYS 554           H        LYS 554  21.647  37.678  22.339
   13    HA   LYS 554           HA       LYS 554  21.805  40.470  21.854
   14    HB2  LYS 554           HB2      LYS 554  21.888  39.570  24.029
   15    HB3  LYS 554           HB3      LYS 554  23.312  38.614  23.704
   16    HG2  LYS 554           HG2      LYS 554  24.095  40.477  24.974
   17    HG3  LYS 554           HG3      LYS 554  24.504  40.975  23.348
   18    HD2  LYS 554           HD2      LYS 554  22.399  42.346  23.262
   19    HD3  LYS 554           HD3      LYS 554  21.970  41.741  24.862
   20    HE2  LYS 554           HE2      LYS 554  23.666  42.900  25.949
   21    HE3  LYS 554           HE3      LYS 554  24.741  42.877  24.560
   22    HZ1  LYS 554           HZ1      LYS 554  22.300  44.451  24.906
   23    HZ2  LYS 554           HZ2      LYS 554  23.729  45.088  25.150
   24    HZ3  LYS 554           HZ3      LYS 554  23.235  44.632  23.602
   25    H    MET 555           H        MET 555  23.249  41.762  20.979
   26    HA   MET 555           HA       MET 555  25.833  40.835  19.786
   27    HB2  MET 555           HB2      MET 555  23.792  42.908  18.879
   28    HB3  MET 555           HB3      MET 555  25.392  42.808  18.182
   29    HG2  MET 555           HG2      MET 555  23.286  40.591  18.190
   30    HG3  MET 555           HG3      MET 555  23.664  41.638  16.828
   31    HE1  MET 555           HE1      MET 555  23.601  39.398  15.431
   32    HE2  MET 555           HE2      MET 555  24.771  38.090  15.647
   33    HE3  MET 555           HE3      MET 555  23.465  38.335  16.834
   34    H    TRP 556           H        TRP 556  27.627  42.168  20.276
   35    HA   TRP 556           HA       TRP 556  27.223  44.282  22.343
   36    HB2  TRP 556           HB2      TRP 556  29.317  42.093  22.134
   37    HB3  TRP 556           HB3      TRP 556  29.589  43.506  23.116
   38    HD1  TRP 556           HD1      TRP 556  28.890  40.163  23.707
   39    HE1  TRP 556           HE1      TRP 556  27.582  39.721  25.823
   40    HE3  TRP 556           HE3      TRP 556  27.300  44.903  24.614
   41    HZ2  TRP 556           HZ2      TRP 556  25.968  41.252  27.745
   42    HZ3  TRP 556           HZ3      TRP 556  25.866  45.391  26.580
   43    HH2  TRP 556           HH2      TRP 556  25.131  43.542  28.092
   44    H    LYS 557           H        LYS 557  29.289  45.636  22.639
   45    HA   LYS 557           HA       LYS 557  31.120  46.308  20.505
   46    HB2  LYS 557           HB2      LYS 557  28.566  47.886  21.133
   47    HB3  LYS 557           HB3      LYS 557  29.972  48.780  20.638
   48    HG2  LYS 557           HG2      LYS 557  28.441  46.717  19.020
   49    HG3  LYS 557           HG3      LYS 557  28.449  48.468  18.781
   50    HD2  LYS 557           HD2      LYS 557  30.971  48.223  18.191
   51    HD3  LYS 557           HD3      LYS 557  30.695  46.476  18.424
   52    HE2  LYS 557           HE2      LYS 557  30.791  46.982  16.106
   53    HE3  LYS 557           HE3      LYS 557  29.195  46.409  16.553
   54    HZ1  LYS 557           HZ1      LYS 557  29.719  48.712  15.155
   55    HZ2  LYS 557           HZ2      LYS 557  28.294  48.264  15.843
   56    HZ3  LYS 557           HZ3      LYS 557  29.330  49.250  16.633
   57    HA   PRO 558           HA       PRO 558  33.143  48.005  24.255
   58    HB2  PRO 558           HB2      PRO 558  34.361  50.306  23.429
   59    HB3  PRO 558           HB3      PRO 558  34.926  48.661  23.192
   60    HG2  PRO 558           HG2      PRO 558  33.471  50.438  21.208
   61    HG3  PRO 558           HG3      PRO 558  34.857  49.355  20.938
   62    HD2  PRO 558           HD2      PRO 558  32.210  48.673  20.342
   63    HD3  PRO 558           HD3      PRO 558  33.454  47.468  20.787
   64    H    GLY 559           H        GLY 559  32.940  49.683  25.967
   65    HA2  GLY 559           HA2      GLY 559  32.061  51.604  27.006
   66    HA3  GLY 559           HA3      GLY 559  31.308  52.061  25.499
   67    H    ASP 560           H        ASP 560  30.869  49.151  27.653
   68    HA   ASP 560           HA       ASP 560  28.213  50.203  28.396
   69    HB2  ASP 560           HB2      ASP 560  28.085  48.710  26.239
   70    HB3  ASP 560           HB3      ASP 560  28.199  47.379  27.336
   71    H    GLU 561           H        GLU 561  28.415  50.220  30.617
   72    HA   GLU 561           HA       GLU 561  29.567  48.126  32.137
   73    HB2  GLU 561           HB2      GLU 561  28.116  48.916  34.064
   74    HB3  GLU 561           HB3      GLU 561  29.147  50.106  33.353
   75    HG2  GLU 561           HG2      GLU 561  26.224  49.932  32.462
   76    HG3  GLU 561           HG3      GLU 561  26.665  50.770  33.915
   77    H    CYS 562           H        CYS 562  29.022  46.007  32.315
   78    HA   CYS 562           HA       CYS 562  26.215  45.131  32.155
   79    HB2  CYS 562           HB2      CYS 562  28.393  44.409  30.138
   80    HB3  CYS 562           HB3      CYS 562  27.058  43.351  30.491
   81    HG   CYS 562           HG       CYS 562  26.964  46.590  29.606
   82    H    PHE 563           H        PHE 563  26.543  42.453  32.164
   83    HA   PHE 563           HA       PHE 563  27.822  41.989  34.819
   84    HB2  PHE 563           HB2      PHE 563  25.135  41.306  33.711
   85    HB3  PHE 563           HB3      PHE 563  26.017  40.048  34.607
   86    HD1  PHE 563           HD1      PHE 563  27.113  40.773  36.834
   87    HD2  PHE 563           HD2      PHE 563  23.730  42.719  35.024
   88    HE1  PHE 563           HE1      PHE 563  26.590  41.923  39.015
   89    HE2  PHE 563           HE2      PHE 563  23.191  43.798  37.177
   90    HZ   PHE 563           HZ       PHE 563  24.640  43.476  39.136
   91    H    ALA 564           H        ALA 564  29.720  40.986  34.328
   92    HA   ALA 564           HA       ALA 564  29.806  39.155  32.024
   93    HB1  ALA 564           HB1      ALA 564  32.063  40.302  33.690
   94    HB2  ALA 564           HB2      ALA 564  32.129  39.296  32.217
   95    HB3  ALA 564           HB3      ALA 564  31.446  40.972  32.165
   96    H    LEU 565           H        LEU 565  29.831  37.047  32.332
   97    HA   LEU 565           HA       LEU 565  29.755  35.782  34.908
   98    HB2  LEU 565           HB2      LEU 565  28.627  35.179  32.707
   99    HB3  LEU 565           HB3      LEU 565  30.241  34.623  32.166
  100    HG   LEU 565           HG       LEU 565  30.247  32.805  33.634
  101   HD11  LEU 565          HD11      LEU 565  29.467  33.615  35.690
  102   HD12  LEU 565          HD12      LEU 565  27.910  34.172  34.994
  103   HD13  LEU 565          HD13      LEU 565  28.237  32.435  35.178
  104   HD21  LEU 565          HD21      LEU 565  27.355  33.040  32.673
  105   HD22  LEU 565          HD22      LEU 565  28.731  32.596  31.635
  106   HD23  LEU 565          HD23      LEU 565  28.267  31.564  33.009
  107    H    TYR 566           H        TYR 566  31.512  35.412  36.137
  108    HA   TYR 566           HA       TYR 566  34.238  35.139  35.173
  109    HB2  TYR 566           HB2      TYR 566  33.257  36.118  37.323
  110    HB3  TYR 566           HB3      TYR 566  33.198  34.459  37.913
  111    HD1  TYR 566           HD1      TYR 566  35.721  36.771  36.150
  112    HD2  TYR 566           HD2      TYR 566  34.910  34.013  39.362
  113    HE1  TYR 566           HE1      TYR 566  37.981  37.131  37.010
  114    HE2  TYR 566           HE2      TYR 566  37.215  34.388  40.246
  115    HH   TYR 566           HH       TYR 566  39.491  36.575  38.606
  116    H    TRP 567           H        TRP 567  35.362  33.273  36.546
  117    HA   TRP 567           HA       TRP 567  34.626  30.795  35.040
  118    HB2  TRP 567           HB2      TRP 567  37.078  30.384  34.937
  119    HB3  TRP 567           HB3      TRP 567  36.594  31.801  34.054
  120    HD1  TRP 567           HD1      TRP 567  37.386  34.218  35.100
  121    HE1  TRP 567           HE1      TRP 567  39.333  34.790  36.633
  122    HE3  TRP 567           HE3      TRP 567  38.397  29.596  36.999
  123    HZ2  TRP 567           HZ2      TRP 567  40.957  33.540  38.612
  124    HZ3  TRP 567           HZ3      TRP 567  40.057  29.338  38.869
  125    HH2  TRP 567           HH2      TRP 567  41.336  31.277  39.665
  126    H    GLU 568           H        GLU 568  35.926  32.084  38.061
  127    HA   GLU 568           HA       GLU 568  36.932  29.649  39.282
  128    HB2  GLU 568           HB2      GLU 568  37.931  31.507  40.088
  129    HB3  GLU 568           HB3      GLU 568  36.441  32.515  39.956
  130    HG2  GLU 568           HG2      GLU 568  35.546  31.478  41.968
  131    HG3  GLU 568           HG3      GLU 568  37.089  30.553  42.155
  132    H    ASP 569           H        ASP 569  33.939  31.463  39.578
  133    HA   ASP 569           HA       ASP 569  32.739  29.124  40.878
  134    HB2  ASP 569           HB2      ASP 569  31.529  30.752  42.320
  135    HB3  ASP 569           HB3      ASP 569  33.279  30.995  42.497
  136    H    ASN 570           H        ASN 570  32.741  30.968  38.115
  137    HA   ASN 570           HA       ASN 570  31.223  31.621  36.554
  138    HB2  ASN 570           HB2      ASN 570  31.291  28.974  36.722
  139    HB3  ASN 570           HB3      ASN 570  29.738  29.126  37.476
  140   HD21  ASN 570          HD22      ASN 570  31.302  30.599  34.461
  141   HD22  ASN 570          HD21      ASN 570  29.982  30.001  33.477
  142    H    LYS 571           H        LYS 571  30.623  32.947  38.992
  143    HA   LYS 571           HA       LYS 571  27.740  33.516  38.704
  144    HB2  LYS 571           HB2      LYS 571  29.833  33.739  40.698
  145    HB3  LYS 571           HB3      LYS 571  29.260  35.357  40.377
  146    HG2  LYS 571           HG2      LYS 571  27.607  32.917  41.144
  147    HG3  LYS 571           HG3      LYS 571  28.051  34.291  42.197
  148    HD2  LYS 571           HD2      LYS 571  26.778  35.775  40.555
  149    HD3  LYS 571           HD3      LYS 571  26.057  34.302  39.898
  150    HE2  LYS 571           HE2      LYS 571  25.017  33.700  41.931
  151    HE3  LYS 571           HE3      LYS 571  25.989  34.821  42.892
  152    HZ1  LYS 571           HZ1      LYS 571  24.011  35.864  42.614
  153    HZ2  LYS 571           HZ2      LYS 571  24.905  36.575  41.447
  154    HZ3  LYS 571           HZ3      LYS 571  23.802  35.413  41.056
  155    H    PHE 572           H        PHE 572  26.973  35.610  37.841
  156    HA   PHE 572           HA       PHE 572  28.752  37.102  36.064
  157    HB2  PHE 572           HB2      PHE 572  25.982  37.735  37.070
  158    HB3  PHE 572           HB3      PHE 572  26.810  38.371  35.647
  159    HD1  PHE 572           HD2      PHE 572  27.280  36.933  33.703
  160    HD2  PHE 572           HD1      PHE 572  24.835  35.467  36.930
  161    HE1  PHE 572           HE2      PHE 572  26.364  35.179  32.218
  162    HE2  PHE 572           HE1      PHE 572  23.799  33.812  35.375
  163    HZ   PHE 572           HZ       PHE 572  24.492  33.678  33.063
  164    H    TYR 573           H        TYR 573  29.532  39.159  36.407
  165    HA   TYR 573           HA       TYR 573  29.245  40.519  39.063
  166    HB2  TYR 573           HB2      TYR 573  31.850  39.796  37.694
  167    HB3  TYR 573           HB3      TYR 573  31.617  40.893  39.093
  168    HD1  TYR 573           HD1      TYR 573  31.159  40.081  41.261
  169    HD2  TYR 573           HD2      TYR 573  31.630  37.321  37.979
  170    HE1  TYR 573           HE1      TYR 573  31.600  38.182  42.867
  171    HE2  TYR 573           HE2      TYR 573  31.864  35.453  39.560
  172    HH   TYR 573           HH       TYR 573  31.829  34.912  41.975
  173    H    ARG 574           H        ARG 574  29.380  42.856  38.859
  174    HA   ARG 574           HA       ARG 574  28.690  43.935  36.309
  175    HB2  ARG 574           HB2      ARG 574  29.744  45.427  38.721
  176    HB3  ARG 574           HB3      ARG 574  28.936  46.134  37.301
  177    HG2  ARG 574           HG2      ARG 574  26.834  44.963  37.928
  178    HG3  ARG 574           HG3      ARG 574  27.658  44.216  39.281
  179    HD2  ARG 574           HD2      ARG 574  26.534  45.919  40.308
  180    HD3  ARG 574           HD3      ARG 574  28.184  46.535  40.212
  181    HE   ARG 574           HE       ARG 574  25.794  47.520  38.742
  182   HH11  ARG 574          HH11      ARG 574  29.205  48.188  39.679
  183   HH12  ARG 574          HH12      ARG 574  29.097  49.692  38.803
  184   HH21  ARG 574          HH21      ARG 574  25.950  49.419  37.722
  185   HH22  ARG 574          HH22      ARG 574  27.434  50.387  37.877
  186    H    ALA 575           H        ALA 575  29.980  44.801  34.634
  187    HA   ALA 575           HA       ALA 575  32.811  45.456  35.051
  188    HB1  ALA 575           HB1      ALA 575  31.748  43.460  33.014
  189    HB2  ALA 575           HB2      ALA 575  33.473  43.862  33.224
  190    HB3  ALA 575           HB3      ALA 575  32.623  42.969  34.486
  191    H    GLU 576           H        GLU 576  33.348  47.283  33.762
  192    HA   GLU 576           HA       GLU 576  31.475  48.292  31.736
  193    HB2  GLU 576           HB2      GLU 576  34.226  49.192  32.666
  194    HB3  GLU 576           HB3      GLU 576  33.177  50.068  31.519
  195    HG2  GLU 576           HG2      GLU 576  31.456  50.161  33.417
  196    HG3  GLU 576           HG3      GLU 576  32.815  49.706  34.471
  197    H    VAL 577           H        VAL 577  31.413  47.360  29.922
  198    HA   VAL 577           HA       VAL 577  33.289  45.701  28.642
  199    HB   VAL 577           HB       VAL 577  30.841  47.279  27.816
  200   HG11  VAL 577          HG11      VAL 577  32.844  46.111  25.928
  201   HG12  VAL 577          HG12      VAL 577  31.084  46.208  25.574
  202   HG13  VAL 577          HG13      VAL 577  31.999  47.697  25.925
  203   HG21  VAL 577          HG21      VAL 577  30.415  45.081  28.762
  204   HG22  VAL 577          HG22      VAL 577  30.072  45.005  27.048
  205   HG23  VAL 577          HG23      VAL 577  31.593  44.330  27.606
  206    H    GLU 578           H        GLU 578  35.251  46.106  27.975
  207    HA   GLU 578           HA       GLU 578  36.062  48.894  27.361
  208    HB2  GLU 578           HB2      GLU 578  37.313  47.543  29.066
  209    HB3  GLU 578           HB3      GLU 578  37.544  46.273  27.867
  210    HG2  GLU 578           HG2      GLU 578  39.548  47.511  28.282
  211    HG3  GLU 578           HG3      GLU 578  39.043  47.653  26.584
  212    H    ALA 579           H        ALA 579  36.049  45.675  25.920
  213    HA   ALA 579           HA       ALA 579  36.004  46.791  23.254
  214    HB1  ALA 579           HB1      ALA 579  38.464  45.130  24.090
  215    HB2  ALA 579           HB2      ALA 579  38.172  45.848  22.503
  216    HB3  ALA 579           HB3      ALA 579  38.502  46.882  23.947
  217    H    LEU 580           H        LEU 580  34.437  45.570  22.347
  218    HA   LEU 580           HA       LEU 580  34.761  42.598  22.414
  219    HB2  LEU 580           HB2      LEU 580  32.112  44.041  22.242
  220    HB3  LEU 580           HB3      LEU 580  32.425  42.342  22.564
  221    HG   LEU 580           HG       LEU 580  32.318  44.762  24.240
  222   HD11  LEU 580          HD11      LEU 580  31.110  42.108  24.292
  223   HD12  LEU 580          HD12      LEU 580  31.725  42.553  25.894
  224   HD13  LEU 580          HD13      LEU 580  30.587  43.601  25.077
  225   HD21  LEU 580          HD21      LEU 580  34.326  44.552  25.270
  226   HD22  LEU 580          HD22      LEU 580  33.643  43.235  26.173
  227   HD23  LEU 580          HD23      LEU 580  34.532  42.878  24.691
  228    H    HIS 581           H        HIS 581  35.986  42.564  20.580
  229    HA   HIS 581           HA       HIS 581  34.618  43.016  17.994
  230    HB2  HIS 581           HB2      HIS 581  35.893  45.139  18.733
  231    HB3  HIS 581           HB3      HIS 581  37.366  44.233  18.383
  232    HD2  HIS 581           HD2      HIS 581  34.199  43.938  16.154
  233    HE1  HIS 581           HE1      HIS 581  37.094  45.939  13.816
  234    HE2  HIS 581           HE2      HIS 581  34.747  45.026  13.876
  235    H    SER 582           H        SER 582  36.664  40.945  19.727
  236    HA   SER 582           HA       SER 582  38.267  40.113  17.454
  237    HB2  SER 582           HB2      SER 582  38.890  39.881  19.878
  238    HB3  SER 582           HB3      SER 582  37.787  38.519  20.009
  239    HG   SER 582           HG       SER 582  40.095  38.170  19.295
  240    H    SER 583           H        SER 583  37.832  38.563  15.955
  241    HA   SER 583           HA       SER 583  35.082  38.040  15.398
  242    HB2  SER 583           HB2      SER 583  35.887  37.125  13.318
  243    HB3  SER 583           HB3      SER 583  36.882  38.550  13.711
  244    HG   SER 583           HG       SER 583  37.695  36.266  13.182
  245    H    GLY 584           H        GLY 584  37.170  36.151  17.316
  246    HA2  GLY 584           HA2      GLY 584  35.834  33.576  16.900
  247    HA3  GLY 584           HA3      GLY 584  36.939  33.979  18.210
  248    H    MET 585           H        MET 585  36.085  34.118  20.207
  249    HA   MET 585           HA       MET 585  33.123  34.256  20.457
  250    HB2  MET 585           HB2      MET 585  32.974  32.370  21.780
  251    HB3  MET 585           HB3      MET 585  33.855  31.915  20.324
  252    HG2  MET 585           HG2      MET 585  35.059  32.312  23.101
  253    HG3  MET 585           HG3      MET 585  34.775  30.781  22.298
  254    HE1  MET 585           HE1      MET 585  38.744  31.216  22.330
  255    HE2  MET 585           HE2      MET 585  37.553  31.627  23.585
  256    HE3  MET 585           HE3      MET 585  37.486  30.057  22.724
  257    H    THR 586           H        THR 586  35.988  35.511  21.731
  258    HA   THR 586           HA       THR 586  34.716  36.088  24.385
  259    HB   THR 586           HB       THR 586  36.918  36.783  25.202
  260    HG1  THR 586           HG1      THR 586  37.828  35.727  22.808
  261   HG21  THR 586          HG21      THR 586  36.545  33.915  24.346
  262   HG22  THR 586          HG22      THR 586  37.810  34.540  25.451
  263   HG23  THR 586          HG23      THR 586  36.069  34.755  25.826
  264    H    ALA 587           H        ALA 587  35.206  38.032  25.457
  265    HA   ALA 587           HA       ALA 587  35.714  40.447  23.898
  266    HB1  ALA 587           HB1      ALA 587  33.502  41.019  25.617
  267    HB2  ALA 587           HB2      ALA 587  33.447  40.823  23.837
  268    HB3  ALA 587           HB3      ALA 587  33.117  39.464  24.944
  269    H    VAL 588           H        VAL 588  36.242  42.241  25.258
  270    HA   VAL 588           HA       VAL 588  37.634  41.415  27.770
  271    HB   VAL 588           HB       VAL 588  38.064  43.979  26.160
  272   HG11  VAL 588          HG11      VAL 588  39.607  42.590  28.346
  273   HG12  VAL 588          HG12      VAL 588  40.188  43.989  27.378
  274   HG13  VAL 588          HG13      VAL 588  38.789  44.175  28.435
  275   HG21  VAL 588          HG21      VAL 588  38.649  42.011  24.776
  276   HG22  VAL 588          HG22      VAL 588  40.152  42.771  25.322
  277   HG23  VAL 588          HG23      VAL 588  39.564  41.324  26.162
  278    H    VAL 589           H        VAL 589  36.933  42.172  29.750
  279    HA   VAL 589           HA       VAL 589  35.205  44.589  29.731
  280    HB   VAL 589           HB       VAL 589  33.627  43.471  31.204
  281   HG11  VAL 589          HG11      VAL 589  33.387  43.739  28.582
  282   HG12  VAL 589          HG12      VAL 589  33.554  41.985  28.559
  283   HG13  VAL 589          HG13      VAL 589  32.239  42.717  29.460
  284   HG21  VAL 589          HG21      VAL 589  35.063  41.428  31.770
  285   HG22  VAL 589          HG22      VAL 589  33.449  40.972  31.175
  286   HG23  VAL 589          HG23      VAL 589  34.843  40.864  30.111
  287    H    LYS 590           H        LYS 590  35.700  45.985  31.340
  288    HA   LYS 590           HA       LYS 590  37.607  45.224  33.461
  289    HB2  LYS 590           HB2      LYS 590  38.128  47.189  32.157
  290    HB3  LYS 590           HB3      LYS 590  36.597  47.959  32.546
  291    HG2  LYS 590           HG2      LYS 590  37.206  48.070  34.891
  292    HG3  LYS 590           HG3      LYS 590  38.567  46.964  34.630
  293    HD2  LYS 590           HD2      LYS 590  39.953  48.548  33.660
  294    HD3  LYS 590           HD3      LYS 590  38.637  49.518  33.064
  295    HE2  LYS 590           HE2      LYS 590  38.858  49.427  36.046
  296    HE3  LYS 590           HE3      LYS 590  40.266  50.061  35.234
  297    HZ1  LYS 590           HZ1      LYS 590  37.510  51.000  34.773
  298    HZ2  LYS 590           HZ2      LYS 590  38.595  51.832  35.626
  299    HZ3  LYS 590           HZ3      LYS 590  38.790  51.587  34.000
  300    H    PHE 591           H        PHE 591  36.658  44.070  34.939
  301    HA   PHE 591           HA       PHE 591  34.265  44.264  36.341
  302    HB2  PHE 591           HB2      PHE 591  37.078  43.465  37.068
  303    HB3  PHE 591           HB3      PHE 591  35.635  43.160  38.066
  304    HD1  PHE 591           HD2      PHE 591  33.647  42.037  37.035
  305    HD2  PHE 591           HD1      PHE 591  37.563  41.743  35.218
  306    HE1  PHE 591           HE2      PHE 591  32.867  40.162  35.637
  307    HE2  PHE 591           HE1      PHE 591  36.765  39.819  33.880
  308    HZ   PHE 591           HZ       PHE 591  34.425  39.029  34.083
  309    H    ILE 592           H        ILE 592  33.556  46.365  36.684
  310    HA   ILE 592           HA       ILE 592  34.864  48.636  37.275
  311    HB   ILE 592           HB       ILE 592  32.157  48.406  38.526
  312   HG12  ILE 592          HG12      ILE 592  32.687  47.811  35.610
  313   HG13  ILE 592          HG13      ILE 592  31.745  46.877  36.768
  314   HG21  ILE 592          HG21      ILE 592  33.373  50.282  36.461
  315   HG22  ILE 592          HG22      ILE 592  31.874  50.511  37.451
  316   HG23  ILE 592          HG23      ILE 592  33.476  50.597  38.171
  317   HD11  ILE 592          HD11      ILE 592  30.961  49.568  35.600
  318   HD12  ILE 592          HD12      ILE 592  30.415  47.983  35.050
  319   HD13  ILE 592          HD13      ILE 592  29.946  48.582  36.670
  320    H    ASP 593           H        ASP 593  33.853  46.369  39.884
  321    HA   ASP 593           HA       ASP 593  34.666  48.239  41.964
  322    HB2  ASP 593           HB2      ASP 593  32.813  46.282  41.982
  323    HB3  ASP 593           HB3      ASP 593  34.216  45.267  42.325
  324    H    TYR 594           H        TYR 594  36.210  45.714  40.219
  325    HA   TYR 594           HA       TYR 594  38.449  45.169  42.080
  326    HB2  TYR 594           HB2      TYR 594  37.477  44.066  39.404
  327    HB3  TYR 594           HB3      TYR 594  38.854  43.401  40.274
  328    HD1  TYR 594           HD2      TYR 594  38.492  42.036  42.318
  329    HD2  TYR 594           HD1      TYR 594  35.183  43.616  40.031
  330    HE1  TYR 594           HE2      TYR 594  36.948  40.439  43.420
  331    HE2  TYR 594           HE1      TYR 594  33.666  41.986  41.070
  332    HH   TYR 594           HH       TYR 594  33.498  40.233  42.661
  333    H    GLY 595           H        GLY 595  37.940  46.222  38.702
  334    HA2  GLY 595           HA2      GLY 595  38.671  48.036  37.655
  335    HA3  GLY 595           HA3      GLY 595  39.864  48.417  38.905
  336    H    ASN 596           H        ASN 596  39.821  45.244  37.294
  337    HA   ASN 596           HA       ASN 596  41.640  46.213  35.173
  338    HB2  ASN 596           HB2      ASN 596  41.980  43.706  36.855
  339    HB3  ASN 596           HB3      ASN 596  42.990  44.155  35.464
  340   HD21  ASN 596          HD22      ASN 596  44.497  46.105  35.860
  341   HD22  ASN 596          HD21      ASN 596  44.903  46.425  37.540
  342    H    TYR 597           H        TYR 597  41.797  44.292  33.360
  343    HA   TYR 597           HA       TYR 597  39.037  43.268  33.025
  344    HB2  TYR 597           HB2      TYR 597  39.390  43.931  30.567
  345    HB3  TYR 597           HB3      TYR 597  38.808  45.094  31.749
  346    HD1  TYR 597           HD2      TYR 597  40.542  46.661  32.849
  347    HD2  TYR 597           HD1      TYR 597  41.136  44.612  29.111
  348    HE1  TYR 597           HE2      TYR 597  42.323  48.202  32.338
  349    HE2  TYR 597           HE1      TYR 597  42.898  46.284  28.485
  350    HH   TYR 597           HH       TYR 597  43.956  48.208  29.143
  351    H    GLU 598           H        GLU 598  38.758  41.748  31.330
  352    HA   GLU 598           HA       GLU 598  40.900  40.144  30.228
  353    HB2  GLU 598           HB2      GLU 598  40.257  38.042  31.423
  354    HB3  GLU 598           HB3      GLU 598  41.190  39.145  32.421
  355    HG2  GLU 598           HG2      GLU 598  38.959  39.880  33.437
  356    HG3  GLU 598           HG3      GLU 598  38.194  38.644  32.418
  357    H    GLU 599           H        GLU 599  40.172  38.218  29.347
  358    HA   GLU 599           HA       GLU 599  37.953  38.628  27.648
  359    HB2  GLU 599           HB2      GLU 599  38.697  36.843  26.409
  360    HB3  GLU 599           HB3      GLU 599  40.075  37.698  27.006
  361    HG2  GLU 599           HG2      GLU 599  39.046  35.009  28.060
  362    HG3  GLU 599           HG3      GLU 599  40.367  35.278  26.940
  363    H    VAL 600           H        VAL 600  35.981  37.737  27.552
  364    HA   VAL 600           HA       VAL 600  34.911  35.522  29.245
  365    HB   VAL 600           HB       VAL 600  33.443  38.149  28.889
  366   HG11  VAL 600          HG11      VAL 600  32.829  35.718  30.617
  367   HG12  VAL 600          HG12      VAL 600  31.960  37.284  30.617
  368   HG13  VAL 600          HG13      VAL 600  31.930  36.256  29.200
  369   HG21  VAL 600          HG21      VAL 600  35.363  38.545  30.404
  370   HG22  VAL 600          HG22      VAL 600  33.857  38.547  31.328
  371   HG23  VAL 600          HG23      VAL 600  34.900  37.115  31.365
  372    H    LEU 601           H        LEU 601  33.421  34.366  28.040
  373    HA   LEU 601           HA       LEU 601  33.039  34.646  25.262
  374    HB2  LEU 601           HB2      LEU 601  32.428  32.719  27.159
  375    HB3  LEU 601           HB3      LEU 601  30.820  33.384  26.850
  376    HG   LEU 601           HG       LEU 601  31.359  33.095  24.381
  377   HD11  LEU 601          HD11      LEU 601  33.307  31.080  25.617
  378   HD12  LEU 601          HD12      LEU 601  33.008  31.286  23.884
  379   HD13  LEU 601          HD13      LEU 601  33.843  32.556  24.807
  380   HD21  LEU 601          HD21      LEU 601  29.727  31.767  25.723
  381   HD22  LEU 601          HD22      LEU 601  30.539  30.811  24.455
  382   HD23  LEU 601          HD23      LEU 601  30.989  30.638  26.175
  383    H    LEU 602           H        LEU 602  31.692  35.759  23.963
  384    HA   LEU 602           HA       LEU 602  30.423  38.151  24.852
  385    HB2  LEU 602           HB2      LEU 602  29.940  36.469  22.394
  386    HB3  LEU 602           HB3      LEU 602  29.315  38.125  22.685
  387    HG   LEU 602           HG       LEU 602  32.289  37.631  22.801
  388   HD11  LEU 602          HD11      LEU 602  31.590  36.474  20.777
  389   HD12  LEU 602          HD12      LEU 602  30.636  37.873  20.264
  390   HD13  LEU 602          HD13      LEU 602  32.422  37.987  20.369
  391   HD21  LEU 602          HD21      LEU 602  31.255  39.886  23.317
  392   HD22  LEU 602          HD22      LEU 602  32.366  39.893  21.918
  393   HD23  LEU 602          HD23      LEU 602  30.616  39.916  21.653
  394    H    SER 603           H        SER 603  28.834  34.964  24.219
  395    HA   SER 603           HA       SER 603  26.298  35.976  25.204
  396    HB2  SER 603           HB2      SER 603  27.345  33.146  24.750
  397    HB3  SER 603           HB3      SER 603  25.617  33.576  24.975
  398    HG   SER 603           HG       SER 603  26.417  35.126  23.151
  399    H    ASN 604           H        ASN 604  28.976  35.397  26.920
  400    HA   ASN 604           HA       ASN 604  27.554  34.439  29.392
  401    HB2  ASN 604           HB2      ASN 604  30.497  34.506  28.608
  402    HB3  ASN 604           HB3      ASN 604  29.961  34.260  30.240
  403   HD21  ASN 604          HD22      ASN 604  31.520  32.337  29.336
  404   HD22  ASN 604          HD21      ASN 604  30.542  30.877  29.175
  405    H    ILE 605           H        ILE 605  29.139  37.260  27.892
  406    HA   ILE 605           HA       ILE 605  28.607  38.769  30.383
  407    HB   ILE 605           HB       ILE 605  28.932  39.961  27.658
  408   HG12  ILE 605          HG12      ILE 605  31.324  39.790  29.496
  409   HG13  ILE 605          HG13      ILE 605  30.964  38.342  28.530
  410   HG21  ILE 605          HG21      ILE 605  29.703  41.044  30.423
  411   HG22  ILE 605          HG22      ILE 605  29.855  41.885  28.882
  412   HG23  ILE 605          HG23      ILE 605  28.242  41.500  29.516
  413   HD11  ILE 605          HD11      ILE 605  31.357  41.125  27.437
  414   HD12  ILE 605          HD12      ILE 605  32.510  39.761  27.334
  415   HD13  ILE 605          HD13      ILE 605  30.951  39.668  26.486
  416    H    LYS 606           H        LYS 606  26.778  39.439  30.906
  417    HA   LYS 606           HA       LYS 606  24.384  39.231  29.180
  418    HB2  LYS 606           HB2      LYS 606  24.842  39.190  32.205
  419    HB3  LYS 606           HB3      LYS 606  23.262  39.024  31.428
  420    HG2  LYS 606           HG2      LYS 606  25.627  37.108  31.223
  421    HG3  LYS 606           HG3      LYS 606  24.147  36.898  32.167
  422    HD2  LYS 606           HD2      LYS 606  22.795  36.923  30.149
  423    HD3  LYS 606           HD3      LYS 606  24.236  37.121  29.120
  424    HE2  LYS 606           HE2      LYS 606  24.951  35.012  29.276
  425    HE3  LYS 606           HE3      LYS 606  24.364  34.774  30.929
  426    HZ1  LYS 606           HZ1      LYS 606  23.245  33.469  29.182
  427    HZ2  LYS 606           HZ2      LYS 606  22.271  34.263  30.142
  428    HZ3  LYS 606           HZ3      LYS 606  22.522  34.796  28.607
  429    HA   PRO 607           HA       PRO 607  23.741  43.713  29.867
  430    HB2  PRO 607           HB2      PRO 607  21.066  43.938  30.312
  431    HB3  PRO 607           HB3      PRO 607  21.802  43.594  28.707
  432    HG2  PRO 607           HG2      PRO 607  20.697  41.573  30.698
  433    HG3  PRO 607           HG3      PRO 607  20.248  41.777  28.978
  434    HD2  PRO 607           HD2      PRO 607  22.143  39.949  29.652
  435    HD3  PRO 607           HD3      PRO 607  22.481  41.033  28.279
  436    H    ILE 608           H        ILE 608  23.436  45.252  31.446
  437    HA   ILE 608           HA       ILE 608  22.948  44.432  34.246
  438    HB   ILE 608           HB       ILE 608  24.385  46.534  32.932
  439   HG12  ILE 608          HG12      ILE 608  24.208  45.629  35.805
  440   HG13  ILE 608          HG13      ILE 608  25.255  45.020  34.532
  441   HG21  ILE 608          HG21      ILE 608  22.449  47.635  34.984
  442   HG22  ILE 608          HG22      ILE 608  23.810  48.477  34.182
  443   HG23  ILE 608          HG23      ILE 608  22.404  47.958  33.244
  444   HD11  ILE 608          HD11      ILE 608  26.572  46.497  35.855
  445   HD12  ILE 608          HD12      ILE 608  26.289  47.281  34.287
  446   HD13  ILE 608          HD13      ILE 608  25.381  47.818  35.710
  447    H    LEU 609           H        LEU 609  20.998  45.657  31.619
  448    HA   LEU 609           HA       LEU 609  18.678  45.304  33.370
  449    HB2  LEU 609           HB2      LEU 609  19.249  47.817  33.275
  450    HB3  LEU 609           HB3      LEU 609  18.875  47.781  31.581
  451    HG   LEU 609           HG       LEU 609  17.048  48.690  32.991
  452   HD11  LEU 609          HD11      LEU 609  16.454  47.639  30.880
  453   HD12  LEU 609          HD12      LEU 609  16.125  46.110  31.743
  454   HD13  LEU 609          HD13      LEU 609  15.184  47.576  32.129
  455   HD21  LEU 609          HD21      LEU 609  17.485  47.313  34.978
  456   HD22  LEU 609          HD22      LEU 609  15.774  47.345  34.519
  457   HD23  LEU 609          HD23      LEU 609  16.740  45.906  34.156
  458    H    GLU 610           H        GLU 610  18.199  43.460  32.457
  459    HA   GLU 610           HA       GLU 610  17.945  42.880  29.625
  460    HB2  GLU 610           HB2      GLU 610  18.355  41.191  31.561
  461    HB3  GLU 610           HB3      GLU 610  16.648  41.435  31.975
  462    HG2  GLU 610           HG2      GLU 610  15.976  40.604  29.787
  463    HG3  GLU 610           HG3      GLU 610  17.655  40.291  29.370
  464    H1   TYR 611           H1       TYR 611  51.302  32.148  34.286
  465    H2   TYR 611           H2       TYR 611  50.017  31.606  35.059
  466    H3   TYR 611           H3       TYR 611  51.333  30.656  35.000
  467    HA   TYR 611           HA       TYR 611  51.413  31.554  37.174
  468    HB2  TYR 611           HB2      TYR 611  52.931  33.572  35.469
  469    HB3  TYR 611           HB3      TYR 611  53.065  33.394  37.189
  470    HD1  TYR 611           HD2      TYR 611  53.713  30.766  37.935
  471    HD2  TYR 611           HD1      TYR 611  54.849  32.825  34.328
  472    HE1  TYR 611           HE2      TYR 611  55.705  29.260  37.671
  473    HE2  TYR 611           HE1      TYR 611  56.942  31.502  34.229
  474    HH   TYR 611           HH       TYR 611  58.020  29.577  35.025
  475    H    SER 612           H        SER 612  50.773  33.043  38.656
  476    HA   SER 612           HA       SER 612  48.237  34.046  38.379
  477    HB2  SER 612           HB2      SER 612  50.394  34.945  40.361
  478    HB3  SER 612           HB3      SER 612  48.650  35.107  40.589
  479    HG   SER 612           HG       SER 612  48.501  33.043  40.918
  480    HA   PRO 613           HA       PRO 613  48.949  37.961  36.278
  481    HB2  PRO 613           HB2      PRO 613  46.511  39.103  36.288
  482    HB3  PRO 613           HB3      PRO 613  46.968  37.678  35.299
  483    HG2  PRO 613           HG2      PRO 613  45.531  37.662  37.934
  484    HG3  PRO 613           HG3      PRO 613  45.061  36.851  36.401
  485    HD2  PRO 613           HD2      PRO 613  46.432  35.427  38.312
  486    HD3  PRO 613           HD3      PRO 613  46.768  35.208  36.613
  487    H    SER 614           H        SER 614  48.899  40.301  36.557
  488    HA   SER 614           HA       SER 614  50.077  41.050  39.039
  489    HB2  SER 614           HB2      SER 614  49.379  42.749  36.647
  490    HB3  SER 614           HB3      SER 614  50.524  43.166  37.900
  491    HG   SER 614           HG       SER 614  51.603  42.092  36.146
  492    H    SER 615           H        SER 615  46.956  40.501  38.770
  493    HA   SER 615           HA       SER 615  45.650  42.954  39.586
  494    HB2  SER 615           HB2      SER 615  43.660  41.644  39.902
  495    HB3  SER 615           HB3      SER 615  44.374  41.254  38.354
  496    HG   SER 615           HG       SER 615  43.941  39.354  39.274
  497    HA   PRO 616           HA       PRO 616  46.018  42.758  44.146
  498    HB2  PRO 616           HB2      PRO 616  43.146  43.690  44.070
  499    HB3  PRO 616           HB3      PRO 616  44.462  44.270  45.068
  500    HG2  PRO 616           HG2      PRO 616  43.735  45.592  42.762
  501    HG3  PRO 616           HG3      PRO 616  45.450  45.474  43.281
  502    HD2  PRO 616           HD2      PRO 616  44.018  43.986  41.109
  503    HD3  PRO 616           HD3      PRO 616  45.717  44.573  41.226
  504   HC11  DA2 617          HC11      DA2 617  37.067  39.811  38.030
  505   HC12  DA2 617          HC12      DA2 617  35.960  40.754  39.070
  506   HC13  DA2 617          HC13      DA2 617  37.685  40.816  39.373
  507   HC21  DA2 617          HC21      DA2 617  34.989  38.553  40.981
  508   HC22  DA2 617          HC22      DA2 617  35.459  37.337  39.795
  509   HC23  DA2 617          HC23      DA2 617  34.719  38.818  39.231
  510    H2   DA2 617           H        DA2 617  43.644  40.891  42.308
  511    HA   DA2 617           HA       DA2 617  42.654  39.205  44.354
  512   HCB1  DA2 617          HCB1      DA2 617  42.195  37.581  42.799
  513   HCB2  DA2 617          HCB2      DA2 617  43.193  38.277  41.534
  514   HCG1  DA2 617          HCG1      DA2 617  41.033  40.014  42.650
  515   HCG2  DA2 617          HCG2      DA2 617  41.620  39.884  40.985
  516   HCD1  DA2 617          HCD1      DA2 617  40.448  37.467  41.114
  517   HCD2  DA2 617          HCD2      DA2 617  39.653  38.172  42.523
  518    HNE  DA2 617           HNE      DA2 617  39.306  39.700  40.011
  519   HNH2  DA2 617          HNH2      DA2 617  38.220  36.952  41.970
  520   HNH1  DA2 617          HNH1      DA2 617  36.580  37.061  41.512
  521    H    TYR 618           H        TYR 618  45.995  39.262  43.051
  522    HA   TYR 618           HA       TYR 618  46.597  36.782  44.600
  523    HB2  TYR 618           HB2      TYR 618  47.681  37.208  41.792
  524    HB3  TYR 618           HB3      TYR 618  47.810  35.769  42.783
  525    HD1  TYR 618           HD1      TYR 618  45.469  34.649  43.450
  526    HD2  TYR 618           HD2      TYR 618  46.059  37.436  40.228
  527    HE1  TYR 618           HE1      TYR 618  43.288  33.951  42.440
  528    HE2  TYR 618           HE2      TYR 618  43.987  36.572  39.107
  529    HH   TYR 618           HH       TYR 618  41.856  34.298  40.668
  530    H    THR 619           H        THR 619  47.103  39.521  45.191
  531    HA   THR 619           HA       THR 619  50.007  40.034  45.106
  532    HB   THR 619           HB       THR 619  49.229  42.099  46.513
  533    HG1  THR 619           HG1      THR 619  47.173  42.541  46.389
  534   HG21  THR 619          HG21      THR 619  48.555  41.600  43.622
  535   HG22  THR 619          HG22      THR 619  48.304  43.193  44.358
  536   HG23  THR 619          HG23      THR 619  49.920  42.490  44.364
  537    HA   PRO 620           HA       PRO 620  51.163  38.519  49.031
  538    HB2  PRO 620           HB2      PRO 620  53.136  40.320  49.731
  539    HB3  PRO 620           HB3      PRO 620  53.348  39.098  48.436
  540    HG2  PRO 620           HG2      PRO 620  52.646  42.028  48.194
  541    HG3  PRO 620           HG3      PRO 620  53.810  41.070  47.239
  542    HD2  PRO 620           HD2      PRO 620  51.256  41.702  46.473
  543    HD3  PRO 620           HD3      PRO 620  52.018  40.187  45.929
  544    H    GLN 621           H        GLN 621  50.128  38.650  50.946
  545    HA   GLN 621           HA       GLN 621  48.598  41.010  51.638
  546    HB2  GLN 621           HB2      GLN 621  48.825  38.184  52.736
  547    HB3  GLN 621           HB3      GLN 621  47.618  39.329  53.319
  548    HG2  GLN 621           HG2      GLN 621  46.600  39.474  51.101
  549    HG3  GLN 621           HG3      GLN 621  47.808  38.397  50.407
  550   HE21  GLN 621          HE22      GLN 621  45.005  37.870  50.279
  551   HE22  GLN 621          HE21      GLN 621  44.802  36.372  51.187
  552    H    SER 622           H        SER 622  51.088  41.864  51.922
  553    HA   SER 622           HA       SER 622  52.186  41.966  54.508
  554    HB2  SER 622           HB2      SER 622  53.265  44.015  53.765
  555    HB3  SER 622           HB3      SER 622  53.238  42.840  52.435
  556    HG   SER 622           HG       SER 622  51.836  45.180  52.696
  557    HA   PRO 623           HA       PRO 623  49.108  44.175  56.787
  558    HB2  PRO 623           HB2      PRO 623  50.409  44.905  59.003
  559    HB3  PRO 623           HB3      PRO 623  50.179  43.174  58.557
  560    HG2  PRO 623           HG2      PRO 623  52.657  44.880  58.084
  561    HG3  PRO 623           HG3      PRO 623  52.600  43.236  58.794
  562    HD2  PRO 623           HD2      PRO 623  53.114  43.751  56.186
  563    HD3  PRO 623           HD3      PRO 623  52.265  42.255  56.701