*HEADER    SPLICING/RNA                            22-JUL-13   2MB0              
*TITLE     SOLUTION STRUCTURE OF HNRNP G RRM IN COMPLEX WITH THE RNA 5'-AUCAAA-3'
*COMPND    MOL_ID: 1;                                                            
*COMPND   2 MOLECULE: RNA-BINDING MOTIF PROTEIN, X CHROMOSOME;                   
*COMPND   3 CHAIN: B;                                                            
*COMPND   4 SYNONYM: GLYCOPROTEIN P43, HETEROGENEOUS NUCLEAR RIBONUCLEOPROTEIN G,
*COMPND   5 HNRNP G, RNA-BINDING MOTIF PROTEIN, X CHROMOSOME, N-TERMINALLY       
*COMPND   6 PROCESSED;                                                           
*COMPND   7 ENGINEERED: YES;                                                     
*COMPND   8 MOL_ID: 2;                                                           
*COMPND   9 MOLECULE: RNA_(5'-R(*AP*UP*CP*AP*AP*A)-3');                          
*COMPND  10 CHAIN: A;                                                            
*COMPND  11 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: RBMX, HNRPG, RBMXP1;                                           
*SOURCE   6 EXPRESSION_SYSTEM: ESCHERICHIA COLI;                                 
*SOURCE   7 EXPRESSION_SYSTEM_TAXID: 562;                                        
*SOURCE   8 EXPRESSION_SYSTEM_VECTOR: PET28;                                     
*SOURCE   9 MOL_ID: 2;                                                           
*SOURCE  10 SYNTHETIC: YES                                                       
*KEYWDS    HNRNP G, SPLICING, RRM, SMN, SMA, SPLICING-RNA COMPLEX                
*EXPDTA    SOLUTION NMR                                                          
*NUMMDL    20                                                                    
*AUTHOR    A.MOURSY, F.H.-T.ALLAIN, A.CLERY                                      
*REVDAT   1   09-APR-14 2MB0    0                                                


#
# 37 VAL H 38 LEU H 4.99 
 &rst
  ixpk= 0, nxpk= 0, iat= 561, 577, r1= 1.30, r2= 1.80, r3= 4.99, r4= 5.49, 
      rk2=50, rk3=50, ir6=1, ialtd=0,
 &end
#
# 38 LEU H 54 VAL HA 4.19 
 &rst
  ixpk= 0, nxpk= 0, iat= 577, 849, r1= 1.30, r2= 1.80, r3= 4.19, r4= 4.69,  &end
#
# 37 VAL HA 38 LEU H 3.04 
 &rst
  ixpk= 0, nxpk= 0, iat= 563, 577, r1= 1.30, r2= 1.80, r3= 3.04, r4= 3.54,  &end
#
# 38 LEU H 53 PHE HB2 4.74 
 &rst
  ixpk= 0, nxpk= 0, iat= 577, 831, r1= 1.30, r2= 1.80, r3= 4.74, r4= 5.24,  &end
#
# 37 VAL HB 38 LEU H 4.55 
 &rst
  ixpk= 0, nxpk= 0, iat= 565, 577, r1= 1.30, r2= 1.80, r3= 4.55, r4= 5.05,  &end
#
# 37 VAL QG2 38 LEU H 4.26 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 577, r1= 1.30, r2= 1.80, r3= 5.12, r4= 5.62,
 igr1= 571, 572, 573,
 &end
#
# 75 ASP H 76 GLY HA2 5.50 
 &rst
  ixpk= 0, nxpk= 0, iat=1149,1163, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
# 74 LEU HB3 75 ASP H 5.36 
 &rst
  ixpk= 0, nxpk= 0, iat=1135,1149, r1= 1.30, r2= 1.80, r3= 5.36, r4= 5.86,  &end
#
# 74 LEU HG 75 ASP H 5.25 
 &rst
  ixpk= 0, nxpk= 0, iat=1137,1149, r1= 1.30, r2= 1.80, r3= 5.25, r4= 5.75,  &end
#
# 74 LEU HB2 75 ASP H 4.94 
 &rst
  ixpk= 0, nxpk= 0, iat=1134,1149, r1= 1.30, r2= 1.80, r3= 4.94, r4= 5.44,  &end
#
# 39 LEU H 39 LEU HB2 3.58 
 &rst
  ixpk= 0, nxpk= 0, iat= 596, 600, r1= 1.30, r2= 1.80, r3= 3.58, r4= 4.08,  &end
#
# 39 LEU H 40 MET H 5.11 
 &rst
  ixpk= 0, nxpk= 0, iat= 596, 615, r1= 1.30, r2= 1.80, r3= 5.11, r4= 5.61,  &end
#
# 38 LEU HB2 39 LEU H 4.40 
 &rst
  ixpk= 0, nxpk= 0, iat= 581, 596, r1= 1.30, r2= 1.80, r3= 4.40, r4= 4.90,  &end
#
# 33 ARG H 34 ILE H 4.53 
 &rst
  ixpk= 0, nxpk= 0, iat= 487, 511, r1= 1.30, r2= 1.80, r3= 4.53, r4= 5.03,  &end
#
# 34 ILE H 56 PHE QR 5.50 
 &rst
  ixpk= 0, nxpk= 0, iat= 511,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr2= 885, 893, 887, 891,
 &end
#
# 34 ILE H 56 PHE HA 5.50 
 &rst
  ixpk= 0, nxpk= 0, iat= 511, 879, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
# 29 GLY HA3 34 ILE H 5.50 
 &rst
  ixpk= 0, nxpk= 0, iat= 433, 511, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
# 33 ARG QB 34 ILE H 3.79 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 511, r1= 1.30, r2= 1.80, r3= 4.25, r4= 4.75,
 igr1= 491, 492,
 &end
#
# 33 ARG HG3 34 ILE H 4.15 
 &rst
  ixpk= 0, nxpk= 0, iat= 495, 511, r1= 1.30, r2= 1.80, r3= 4.15, r4= 4.65,  &end
#
# 34 ILE H 34 ILE HB 3.17 
 &rst
  ixpk= 0, nxpk= 0, iat= 511, 515, r1= 1.30, r2= 1.80, r3= 3.17, r4= 3.67,  &end
#
# 34 ILE H 34 ILE HG13 3.72 
 &rst
  ixpk= 0, nxpk= 0, iat= 511, 522, r1= 1.30, r2= 1.80, r3= 3.72, r4= 4.22,  &end
#
# 34 ILE H 34 ILE QG2 4.43 
 &rst
  ixpk= 0, nxpk= 0, iat= 511,  -1, r1= 1.30, r2= 1.80, r3= 5.32, r4= 5.82,
 igr2= 517, 518, 519,
 &end
#
# 34 ILE H 34 ILE QD1 4.64 
 &rst
  ixpk= 0, nxpk= 0, iat= 511,  -1, r1= 1.30, r2= 1.80, r3= 5.57, r4= 6.07,
 igr2= 524, 525, 526,
 &end
#
# 34 ILE H 34 ILE HG12 4.36 
 &rst
  ixpk= 0, nxpk= 0, iat= 511, 521, r1= 1.30, r2= 1.80, r3= 4.36, r4= 4.86,  &end
#
# 56 PHE H 57 GLU H 5.07 
 &rst
  ixpk= 0, nxpk= 0, iat= 877, 897, r1= 1.30, r2= 1.80, r3= 5.07, r4= 5.57,  &end
#
# 8 GLY HA3 56 PHE H 4.94 
 &rst
  ixpk= 0, nxpk= 0, iat= 115, 877, r1= 1.30, r2= 1.80, r3= 4.94, r4= 5.44,  &end
#
# 34 ILE HA 56 PHE H 5.33 
 &rst
  ixpk= 0, nxpk= 0, iat= 513, 877, r1= 1.30, r2= 1.80, r3= 5.33, r4= 5.83,  &end
#
# 8 GLY HA2 56 PHE H 4.77 
 &rst
  ixpk= 0, nxpk= 0, iat= 114, 877, r1= 1.30, r2= 1.80, r3= 4.77, r4= 5.27,  &end
#
# 56 PHE H 56 PHE HB3 3.98 
 &rst
  ixpk= 0, nxpk= 0, iat= 877, 882, r1= 1.30, r2= 1.80, r3= 3.98, r4= 4.48,  &end
#
# 56 PHE H 62 ALA HA 5.50 
 &rst
  ixpk= 0, nxpk= 0, iat= 877, 961, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
# 56 PHE H 56 PHE HB2 3.68 
 &rst
  ixpk= 0, nxpk= 0, iat= 877, 881, r1= 1.30, r2= 1.80, r3= 3.68, r4= 4.18,  &end
#
# 10 LEU HG 56 PHE H 5.50 
 &rst
  ixpk= 0, nxpk= 0, iat= 148, 877, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
# 35 VAL QG2 56 PHE H 5.50 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 877, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr1= 540, 541, 542,
 &end
#
# 54 VAL QG2 56 PHE H 5.50 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 877, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr1= 857, 858, 859,
 &end
#
# 74 LEU H 77 LYS HA 5.48 
 &rst
  ixpk= 0, nxpk= 0, iat=1130,1170, r1= 1.30, r2= 1.80, r3= 5.48, r4= 5.98,  &end
#
# 74 LEU H 77 LYS HB3 5.27 
 &rst
  ixpk= 0, nxpk= 0, iat=1130,1173, r1= 1.30, r2= 1.80, r3= 5.27, r4= 5.77,  &end
#
# 74 LEU H 74 LEU HB3 3.83 
 &rst
  ixpk= 0, nxpk= 0, iat=1130,1135, r1= 1.30, r2= 1.80, r3= 3.83, r4= 4.33,  &end
#
# 74 LEU H 77 LYS HG2 5.50 
 &rst
  ixpk= 0, nxpk= 0, iat=1130,1175, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
# 74 LEU H 74 LEU HB2 3.92 
 &rst
  ixpk= 0, nxpk= 0, iat=1130,1134, r1= 1.30, r2= 1.80, r3= 3.92, r4= 4.42,  &end
#
# 74 LEU H 75 ASP H 5.15 
 &rst
  ixpk= 0, nxpk= 0, iat=1130,1149, r1= 1.30, r2= 1.80, r3= 5.15, r4= 5.65,  &end
#
# 12 ILE H 51 PHE HB2 5.50 
 &rst
  ixpk= 0, nxpk= 0, iat= 180, 801, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
# 12 ILE H 81 VAL HA 5.50 
 &rst
  ixpk= 0, nxpk= 0, iat= 180,1243, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
# 10 LEU H 84 ALA H 5.46 
 &rst
  ixpk= 0, nxpk= 0, iat= 141,1289, r1= 1.30, r2= 1.80, r3= 5.46, r4= 5.96,  &end
#
# 10 LEU H 56 PHE H 4.74 
 &rst
  ixpk= 0, nxpk= 0, iat= 141, 877, r1= 1.30, r2= 1.80, r3= 4.74, r4= 5.24,  &end
#
# 10 LEU H 54 VAL H 4.21 
 &rst
  ixpk= 0, nxpk= 0, iat= 141, 847, r1= 1.30, r2= 1.80, r3= 4.21, r4= 4.71,  &end
#
# 10 LEU H 56 PHE QR 5.50 
 &rst
  ixpk= 0, nxpk= 0, iat= 141,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr2= 885, 893, 887, 891,
 &end
#
# 9 LYS HA 10 LEU H 3.24 
 &rst
  ixpk= 0, nxpk= 0, iat= 121, 141, r1= 1.30, r2= 1.80, r3= 3.24, r4= 3.74,  &end
#
# 10 LEU H 53 PHE HB3 5.50 
 &rst
  ixpk= 0, nxpk= 0, iat= 141, 832, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
# 9 LYS HE2 10 LEU H 5.50 
 &rst
  ixpk= 0, nxpk= 0, iat= 132, 141, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
# 10 LEU H 10 LEU HG 4.10 
 &rst
  ixpk= 0, nxpk= 0, iat= 141, 148, r1= 1.30, r2= 1.80, r3= 4.10, r4= 4.60,  &end
#
# 10 LEU H 10 LEU HB3 3.89 
 &rst
  ixpk= 0, nxpk= 0, iat= 141, 146, r1= 1.30, r2= 1.80, r3= 3.89, r4= 4.39,  &end
#
# 9 LYS QD 10 LEU H 4.43 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 141, r1= 1.30, r2= 1.80, r3= 4.97, r4= 5.47,
 igr1= 129, 130,
 &end
#
# 9 LYS HG2 10 LEU H 4.04 
 &rst
  ixpk= 0, nxpk= 0, iat= 126, 141, r1= 1.30, r2= 1.80, r3= 4.04, r4= 4.54,  &end
#
# 43 ARG H 43 ARG QG 4.11 
 &rst
  ixpk= 0, nxpk= 0, iat= 666,  -1, r1= 1.30, r2= 1.80, r3= 4.61, r4= 5.11,
 igr2= 673, 674,
 &end
#
# 42 ASP H 43 ARG H 4.69 
 &rst
  ixpk= 0, nxpk= 0, iat= 654, 666, r1= 1.30, r2= 1.80, r3= 4.69, r4= 5.19,  &end
#
# 43 ARG H 45 THR H 5.44 
 &rst
  ixpk= 0, nxpk= 0, iat= 666, 705, r1= 1.30, r2= 1.80, r3= 5.44, r4= 5.94,  &end
#
# 42 ASP HA 43 ARG H 3.17 
 &rst
  ixpk= 0, nxpk= 0, iat= 656, 666, r1= 1.30, r2= 1.80, r3= 3.17, r4= 3.67,  &end
#
# 43 ARG H 43 ARG QD 5.22 
 &rst
  ixpk= 0, nxpk= 0, iat= 666,  -1, r1= 1.30, r2= 1.80, r3= 5.86, r4= 6.36,
 igr2= 676, 677,
 &end
#
# 43 ARG H 43 ARG QB 3.31 
 &rst
  ixpk= 0, nxpk= 0, iat= 666,  -1, r1= 1.30, r2= 1.80, r3= 3.72, r4= 4.22,
 igr2= 670, 671,
 &end
#
# 20 ASN H 20 ASN HD21 5.49 
 &rst
  ixpk= 0, nxpk= 0, iat= 289, 299, r1= 1.30, r2= 1.80, r3= 5.49, r4= 5.99,  &end
#
# 20 ASN H 21 GLU H 4.79 
 &rst
  ixpk= 0, nxpk= 0, iat= 289, 303, r1= 1.30, r2= 1.80, r3= 4.79, r4= 5.29,  &end
#
# 20 ASN H 20 ASN HD22 4.83 
 &rst
  ixpk= 0, nxpk= 0, iat= 289, 298, r1= 1.30, r2= 1.80, r3= 4.83, r4= 5.33,  &end
#
# 19 THR H 20 ASN H 4.61 
 &rst
  ixpk= 0, nxpk= 0, iat= 275, 289, r1= 1.30, r2= 1.80, r3= 4.61, r4= 5.11,  &end
#
# 20 ASN H 23 ALA HA 5.21 
 &rst
  ixpk= 0, nxpk= 0, iat= 289, 342, r1= 1.30, r2= 1.80, r3= 5.21, r4= 5.71,  &end
#
# 19 THR HA 20 ASN H 2.96 
 &rst
  ixpk= 0, nxpk= 0, iat= 277, 289, r1= 1.30, r2= 1.80, r3= 2.96, r4= 3.46,  &end
#
# 19 THR HB 20 ASN H 3.98 
 &rst
  ixpk= 0, nxpk= 0, iat= 279, 289, r1= 1.30, r2= 1.80, r3= 3.98, r4= 4.48,  &end
#
# 20 ASN H 20 ASN HB3 4.17 
 &rst
  ixpk= 0, nxpk= 0, iat= 289, 294, r1= 1.30, r2= 1.80, r3= 4.17, r4= 4.67,  &end
#
# 20 ASN H 20 ASN HB2 3.92 
 &rst
  ixpk= 0, nxpk= 0, iat= 289, 293, r1= 1.30, r2= 1.80, r3= 3.92, r4= 4.42,  &end
#
# 19 THR QG2 20 ASN H 3.77 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 289, r1= 1.30, r2= 1.80, r3= 4.53, r4= 5.03,
 igr1= 281, 282, 283,
 &end
#
# 20 ASN H 39 LEU QD1 5.26 
 &rst
  ixpk= 0, nxpk= 0, iat= 289,  -1, r1= 1.30, r2= 1.80, r3= 6.32, r4= 6.82,
 igr2= 605, 606, 607,
 &end
#
# 20 ASN H 39 LEU QD2 5.50 
 &rst
  ixpk= 0, nxpk= 0, iat= 289,  -1, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr2= 609, 610, 611,
 &end
#
# 37 VAL H 54 VAL HA 4.85 
 &rst
  ixpk= 0, nxpk= 0, iat= 561, 849, r1= 1.30, r2= 1.80, r3= 4.85, r4= 5.35,  &end
#
# 36 GLU HG3 37 VAL H 3.96 
 &rst
  ixpk= 0, nxpk= 0, iat= 554, 561, r1= 1.30, r2= 1.80, r3= 3.96, r4= 4.46,  &end
#
# 37 VAL H 37 VAL HB 3.37 
 &rst
  ixpk= 0, nxpk= 0, iat= 561, 565, r1= 1.30, r2= 1.80, r3= 3.37, r4= 3.87,  &end
#
# 37 VAL H 38 LEU HA 5.28 
 &rst
  ixpk= 0, nxpk= 0, iat= 561, 579, r1= 1.30, r2= 1.80, r3= 5.28, r4= 5.78,  &end
#
# 40 MET H 53 PHE QD 5.37 
 &rst
  ixpk= 0, nxpk= 0, iat= 615,  -1, r1= 1.30, r2= 1.80, r3= 6.03, r4= 6.53,
 igr2= 835, 843,
 &end
#
# 39 LEU HB3 40 MET H 5.44 
 &rst
  ixpk= 0, nxpk= 0, iat= 601, 615, r1= 1.30, r2= 1.80, r3= 5.44, r4= 5.94,  &end
#
# 40 MET H 40 MET HB3 4.13 
 &rst
  ixpk= 0, nxpk= 0, iat= 615, 620, r1= 1.30, r2= 1.80, r3= 4.13, r4= 4.63,  &end
#
# 40 MET H 40 MET HB2 4.03 
 &rst
  ixpk= 0, nxpk= 0, iat= 615, 619, r1= 1.30, r2= 1.80, r3= 4.03, r4= 4.53,  &end
#
# 74 LEU H 78 ALA H 5.25 
 &rst
  ixpk= 0, nxpk= 0, iat=1130,1190, r1= 1.30, r2= 1.80, r3= 5.25, r4= 5.75,  &end
#
# 73 SER HA 78 ALA H 4.68 
 &rst
  ixpk= 0, nxpk= 0, iat=1121,1190, r1= 1.30, r2= 1.80, r3= 4.68, r4= 5.18,  &end
#
# 77 LYS HA 78 ALA H 2.85 
 &rst
  ixpk= 0, nxpk= 0, iat=1170,1190, r1= 1.30, r2= 1.80, r3= 2.85, r4= 3.35,  &end
#
# 77 LYS HB3 78 ALA H 3.75 
 &rst
  ixpk= 0, nxpk= 0, iat=1173,1190, r1= 1.30, r2= 1.80, r3= 3.75, r4= 4.25,  &end
#
# 78 ALA H 79 ILE QG2 5.50 
 &rst
  ixpk= 0, nxpk= 0, iat=1190,  -1, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr2=1206,1207,1208,
 &end
#
# 38 LEU H 54 VAL H 5.50 
 &rst
  ixpk= 0, nxpk= 0, iat= 577, 847, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
# 54 VAL H 55 THR H 4.95 
 &rst
  ixpk= 0, nxpk= 0, iat= 847, 863, r1= 1.30, r2= 1.80, r3= 4.95, r4= 5.45,  &end
#
# 12 ILE H 54 VAL H 5.50 
 &rst
  ixpk= 0, nxpk= 0, iat= 180, 847, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
# 9 LYS HA 54 VAL H 5.03 
 &rst
  ixpk= 0, nxpk= 0, iat= 121, 847, r1= 1.30, r2= 1.80, r3= 5.03, r4= 5.53,  &end
#
# 11 PHE HA 54 VAL H 5.09 
 &rst
  ixpk= 0, nxpk= 0, iat= 162, 847, r1= 1.30, r2= 1.80, r3= 5.09, r4= 5.59,  &end
#
# 53 PHE HB3 54 VAL H 4.21 
 &rst
  ixpk= 0, nxpk= 0, iat= 832, 847, r1= 1.30, r2= 1.80, r3= 4.21, r4= 4.71,  &end
#
# 53 PHE HB2 54 VAL H 4.35 
 &rst
  ixpk= 0, nxpk= 0, iat= 831, 847, r1= 1.30, r2= 1.80, r3= 4.35, r4= 4.85,  &end
#
# 10 LEU HG 54 VAL H 5.50 
 &rst
  ixpk= 0, nxpk= 0, iat= 148, 847, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
# 10 LEU HB3 54 VAL H 4.61 
 &rst
  ixpk= 0, nxpk= 0, iat= 146, 847, r1= 1.30, r2= 1.80, r3= 4.61, r4= 5.11,  &end
#
# 9 LYS HG2 54 VAL H 4.73 
 &rst
  ixpk= 0, nxpk= 0, iat= 126, 847, r1= 1.30, r2= 1.80, r3= 4.73, r4= 5.23,  &end
#
# 12 ILE HG12 54 VAL H 4.76 
 &rst
  ixpk= 0, nxpk= 0, iat= 190, 847, r1= 1.30, r2= 1.80, r3= 4.76, r4= 5.26,  &end
#
# 11 PHE H 54 VAL H 5.50 
 &rst
  ixpk= 0, nxpk= 0, iat= 160, 847, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
# 3 GLU H 4 ALA H 4.60 
 &rst
  ixpk= 0, nxpk= 0, iat=  37,  52, r1= 1.30, r2= 1.80, r3= 4.60, r4= 5.10,  &end
#
# 3 GLU HB3 4 ALA H 4.21 
 &rst
  ixpk= 0, nxpk= 0, iat=  42,  52, r1= 1.30, r2= 1.80, r3= 4.21, r4= 4.71,  &end
#
# 4 ALA H 86 LYS HG3 5.50 
 &rst
  ixpk= 0, nxpk= 0, iat=  52,1321, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
# 2 VAL QQG 4 ALA H 5.50 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  52, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1=  27,  28,  29,  31,  32,  33,
 &end
#
# 1 MET HA 3 GLU H 5.37 
 &rst
  ixpk= 0, nxpk= 0, iat=   6,  37, r1= 1.30, r2= 1.80, r3= 5.37, r4= 5.87,  &end
#
# 3 GLU H 3 GLU HB3 3.66 
 &rst
  ixpk= 0, nxpk= 0, iat=  37,  42, r1= 1.30, r2= 1.80, r3= 3.66, r4= 4.16,  &end
#
# 2 VAL QQG 3 GLU H 4.17 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  37, r1= 1.30, r2= 1.80, r3= 5.62, r4= 6.12,
 igr1=  27,  28,  29,  31,  32,  33,
 &end
#
# 3 GLU H 3 GLU HB2 3.76 
 &rst
  ixpk= 0, nxpk= 0, iat=  37,  41, r1= 1.30, r2= 1.80, r3= 3.76, r4= 4.26,  &end
#
# 49 ARG H 50 GLY H 3.55 
 &rst
  ixpk= 0, nxpk= 0, iat= 766, 790, r1= 1.30, r2= 1.80, r3= 3.55, r4= 4.05,  &end
#
# 49 ARG H 51 PHE QE 5.50 
 &rst
  ixpk= 0, nxpk= 0, iat= 766,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2= 807, 811,
 &end
#
# 41 LYS HA 49 ARG H 3.66 
 &rst
  ixpk= 0, nxpk= 0, iat= 634, 766, r1= 1.30, r2= 1.80, r3= 3.66, r4= 4.16,  &end
#
# 48 SER HA 49 ARG H 3.12 
 &rst
  ixpk= 0, nxpk= 0, iat= 757, 766, r1= 1.30, r2= 1.80, r3= 3.12, r4= 3.62,  &end
#
# 48 SER HB3 49 ARG H 4.35 
 &rst
  ixpk= 0, nxpk= 0, iat= 760, 766, r1= 1.30, r2= 1.80, r3= 4.35, r4= 4.85,  &end
#
# 49 ARG H 49 ARG HD3 5.35 
 &rst
  ixpk= 0, nxpk= 0, iat= 766, 777, r1= 1.30, r2= 1.80, r3= 5.35, r4= 5.85,  &end
#
# 49 ARG H 49 ARG HD2 5.07 
 &rst
  ixpk= 0, nxpk= 0, iat= 766, 776, r1= 1.30, r2= 1.80, r3= 5.07, r4= 5.57,  &end
#
# 49 ARG H 49 ARG HB3 3.96 
 &rst
  ixpk= 0, nxpk= 0, iat= 766, 771, r1= 1.30, r2= 1.80, r3= 3.96, r4= 4.46,  &end
#
# 49 ARG H 49 ARG HG3 4.37 
 &rst
  ixpk= 0, nxpk= 0, iat= 766, 774, r1= 1.30, r2= 1.80, r3= 4.37, r4= 4.87,  &end
#
# 41 LYS HB3 49 ARG H 3.81 
 &rst
  ixpk= 0, nxpk= 0, iat= 637, 766, r1= 1.30, r2= 1.80, r3= 3.81, r4= 4.31,  &end
#
# 40 MET HB3 49 ARG H 4.60 
 &rst
  ixpk= 0, nxpk= 0, iat= 620, 766, r1= 1.30, r2= 1.80, r3= 4.60, r4= 5.10,  &end
#
# 49 ARG H 49 ARG HB2 3.53 
 &rst
  ixpk= 0, nxpk= 0, iat= 766, 770, r1= 1.30, r2= 1.80, r3= 3.53, r4= 4.03,  &end
#
# 39 LEU QD1 49 ARG H 5.50 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 766, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr1= 605, 606, 607,
 &end
#
# 39 LEU QD2 49 ARG H 5.50 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 766, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr1= 609, 610, 611,
 &end
#
# 42 ASP H 45 THR QG2 5.50 
 &rst
  ixpk= 0, nxpk= 0, iat= 654,  -1, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr2= 711, 712, 713,
 &end
#
# 42 ASP H 49 ARG H 4.64 
 &rst
  ixpk= 0, nxpk= 0, iat= 654, 766, r1= 1.30, r2= 1.80, r3= 4.64, r4= 5.14,  &end
#
# 42 ASP H 46 ASN H 5.02 
 &rst
  ixpk= 0, nxpk= 0, iat= 654, 719, r1= 1.30, r2= 1.80, r3= 5.02, r4= 5.52,  &end
#
# 42 ASP H 48 SER HA 4.36 
 &rst
  ixpk= 0, nxpk= 0, iat= 654, 757, r1= 1.30, r2= 1.80, r3= 4.36, r4= 4.86,  &end
#
# 42 ASP H 49 ARG HG3 4.80 
 &rst
  ixpk= 0, nxpk= 0, iat= 654, 774, r1= 1.30, r2= 1.80, r3= 4.80, r4= 5.30,  &end
#
# 41 LYS HB3 42 ASP H 3.79 
 &rst
  ixpk= 0, nxpk= 0, iat= 637, 654, r1= 1.30, r2= 1.80, r3= 3.79, r4= 4.29,  &end
#
# 42 ASP H 49 ARG HB2 5.40 
 &rst
  ixpk= 0, nxpk= 0, iat= 654, 770, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,  &end
#
# 80 LYS H 81 VAL H 5.47 
 &rst
  ixpk= 0, nxpk= 0, iat=1219,1241, r1= 1.30, r2= 1.80, r3= 5.47, r4= 5.97,  &end
#
# 70 ASN H 81 VAL H 4.93 
 &rst
  ixpk= 0, nxpk= 0, iat=1076,1241, r1= 1.30, r2= 1.80, r3= 4.93, r4= 5.43,  &end
#
# 66 ALA HA 81 VAL H 5.50 
 &rst
  ixpk= 0, nxpk= 0, iat=1015,1241, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
# 70 ASN HB3 81 VAL H 4.30 
 &rst
  ixpk= 0, nxpk= 0, iat=1081,1241, r1= 1.30, r2= 1.80, r3= 4.30, r4= 4.80,  &end
#
# 81 VAL H 82 GLU HB3 5.34 
 &rst
  ixpk= 0, nxpk= 0, iat=1241,1262, r1= 1.30, r2= 1.80, r3= 5.34, r4= 5.84,  &end
#
# 81 VAL H 81 VAL HB 3.84 
 &rst
  ixpk= 0, nxpk= 0, iat=1241,1245, r1= 1.30, r2= 1.80, r3= 3.84, r4= 4.34,  &end
#
# 80 LYS QD 81 VAL H 5.33 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1241, r1= 1.30, r2= 1.80, r3= 5.98, r4= 6.48,
 igr1=1229,1230,
 &end
#
# 80 LYS HB3 81 VAL H 4.50 
 &rst
  ixpk= 0, nxpk= 0, iat=1224,1241, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
# 80 LYS HB2 81 VAL H 4.61 
 &rst
  ixpk= 0, nxpk= 0, iat=1223,1241, r1= 1.30, r2= 1.80, r3= 4.61, r4= 5.11,  &end
#
# 80 LYS HG3 81 VAL H 4.38 
 &rst
  ixpk= 0, nxpk= 0, iat=1227,1241, r1= 1.30, r2= 1.80, r3= 4.38, r4= 4.88,  &end
#
# 80 LYS HG2 81 VAL H 4.69 
 &rst
  ixpk= 0, nxpk= 0, iat=1226,1241, r1= 1.30, r2= 1.80, r3= 4.69, r4= 5.19,  &end
#
# 13 GLY H 80 LYS H 4.13 
 &rst
  ixpk= 0, nxpk= 0, iat= 199,1219, r1= 1.30, r2= 1.80, r3= 4.13, r4= 4.63,  &end
#
# 70 ASN HA 80 LYS H 5.50 
 &rst
  ixpk= 0, nxpk= 0, iat=1078,1219, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
# 14 GLY HA3 80 LYS H 4.93 
 &rst
  ixpk= 0, nxpk= 0, iat= 209,1219, r1= 1.30, r2= 1.80, r3= 4.93, r4= 5.43,  &end
#
# 14 GLY HA2 80 LYS H 5.50 
 &rst
  ixpk= 0, nxpk= 0, iat= 208,1219, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
# 13 GLY HA2 80 LYS H 5.30 
 &rst
  ixpk= 0, nxpk= 0, iat= 201,1219, r1= 1.30, r2= 1.80, r3= 5.30, r4= 5.80,  &end
#
# 79 ILE HB 80 LYS H 3.41 
 &rst
  ixpk= 0, nxpk= 0, iat=1204,1219, r1= 1.30, r2= 1.80, r3= 3.41, r4= 3.91,  &end
#
# 80 LYS H 80 LYS HB2 3.63 
 &rst
  ixpk= 0, nxpk= 0, iat=1219,1223, r1= 1.30, r2= 1.80, r3= 3.63, r4= 4.13,  &end
#
# 79 ILE QG1 80 LYS H 4.56 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1219, r1= 1.30, r2= 1.80, r3= 5.12, r4= 5.62,
 igr1=1210,1211,
 &end
#
# 80 LYS H 80 LYS HG2 5.35 
 &rst
  ixpk= 0, nxpk= 0, iat=1219,1226, r1= 1.30, r2= 1.80, r3= 5.35, r4= 5.85,  &end
#
# 80 LYS H 81 VAL QG2 5.50 
 &rst
  ixpk= 0, nxpk= 0, iat=1219,  -1, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr2=1251,1252,1253,
 &end
#
# 79 ILE QD1 80 LYS H 4.79 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1219, r1= 1.30, r2= 1.80, r3= 5.75, r4= 6.25,
 igr1=1213,1214,1215,
 &end
#
# 15 LEU HG 80 LYS H 5.50 
 &rst
  ixpk= 0, nxpk= 0, iat= 220,1219, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
# 42 ASP H 47 LYS HB2 5.16 
 &rst
  ixpk= 0, nxpk= 0, iat= 654, 737, r1= 1.30, r2= 1.80, r3= 5.16, r4= 5.66,  &end
#
# 13 GLY H 82 GLU H 5.13 
 &rst
  ixpk= 0, nxpk= 0, iat= 199,1257, r1= 1.30, r2= 1.80, r3= 5.13, r4= 5.63,  &end
#
# 81 VAL H 82 GLU H 5.10 
 &rst
  ixpk= 0, nxpk= 0, iat=1241,1257, r1= 1.30, r2= 1.80, r3= 5.10, r4= 5.60,  &end
#
# 10 LEU HA 82 GLU H 4.91 
 &rst
  ixpk= 0, nxpk= 0, iat= 143,1257, r1= 1.30, r2= 1.80, r3= 4.91, r4= 5.41,  &end
#
# 11 PHE QB 82 GLU H 4.43 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1257, r1= 1.30, r2= 1.80, r3= 4.97, r4= 5.47,
 igr1= 164, 165,
 &end
#
# 82 GLU H 82 GLU QG 4.66 
 &rst
  ixpk= 0, nxpk= 0, iat=1257,  -1, r1= 1.30, r2= 1.80, r3= 5.23, r4= 5.73,
 igr2=1264,1265,
 &end
#
# 82 GLU H 82 GLU HB3 4.08 
 &rst
  ixpk= 0, nxpk= 0, iat=1257,1262, r1= 1.30, r2= 1.80, r3= 4.08, r4= 4.58,  &end
#
# 10 LEU HB2 82 GLU H 5.01 
 &rst
  ixpk= 0, nxpk= 0, iat= 145,1257, r1= 1.30, r2= 1.80, r3= 5.01, r4= 5.51,  &end
#
# 81 VAL QG2 82 GLU H 4.80 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1257, r1= 1.30, r2= 1.80, r3= 5.76, r4= 6.26,
 igr1=1251,1252,1253,
 &end
#
# 21 GLU H 23 ALA H 4.87 
 &rst
  ixpk= 0, nxpk= 0, iat= 303, 340, r1= 1.30, r2= 1.80, r3= 4.87, r4= 5.37,  &end
#
# 23 ALA H 25 GLU H 4.60 
 &rst
  ixpk= 0, nxpk= 0, iat= 340, 369, r1= 1.30, r2= 1.80, r3= 4.60, r4= 5.10,  &end
#
# 20 ASN H 23 ALA H 4.06 
 &rst
  ixpk= 0, nxpk= 0, iat= 289, 340, r1= 1.30, r2= 1.80, r3= 4.06, r4= 4.56,  &end
#
# 20 ASN HD21 23 ALA H 5.50 
 &rst
  ixpk= 0, nxpk= 0, iat= 299, 340, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
# 21 GLU HA 23 ALA H 4.85 
 &rst
  ixpk= 0, nxpk= 0, iat= 305, 340, r1= 1.30, r2= 1.80, r3= 4.85, r4= 5.35,  &end
#
# 20 ASN HB2 23 ALA H 5.50 
 &rst
  ixpk= 0, nxpk= 0, iat= 293, 340, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
# 22 LYS HB3 23 ALA H 3.64 
 &rst
  ixpk= 0, nxpk= 0, iat= 323, 340, r1= 1.30, r2= 1.80, r3= 3.64, r4= 4.14,  &end
#
# 11 PHE H 53 PHE QD 5.50 
 &rst
  ixpk= 0, nxpk= 0, iat= 160,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2= 835, 843,
 &end
#
# 11 PHE H 82 GLU HB3 5.50 
 &rst
  ixpk= 0, nxpk= 0, iat= 160,1262, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
# 11 PHE H 84 ALA QB 4.53 
 &rst
  ixpk= 0, nxpk= 0, iat= 160,  -1, r1= 1.30, r2= 1.80, r3= 5.44, r4= 5.94,
 igr2=1293,1294,1295,
 &end
#
# 11 PHE H 82 GLU H 3.98 
 &rst
  ixpk= 0, nxpk= 0, iat= 160,1257, r1= 1.30, r2= 1.80, r3= 3.98, r4= 4.48,  &end
#
# 11 PHE H 12 ILE H 5.50 
 &rst
  ixpk= 0, nxpk= 0, iat= 160, 180, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
# 11 PHE H 81 VAL HA 5.09 
 &rst
  ixpk= 0, nxpk= 0, iat= 160,1243, r1= 1.30, r2= 1.80, r3= 5.09, r4= 5.59,  &end
#
# 10 LEU HA 11 PHE H 3.27 
 &rst
  ixpk= 0, nxpk= 0, iat= 143, 160, r1= 1.30, r2= 1.80, r3= 3.27, r4= 3.77,  &end
#
# 11 PHE H 83 GLN HA 4.28 
 &rst
  ixpk= 0, nxpk= 0, iat= 160,1274, r1= 1.30, r2= 1.80, r3= 4.28, r4= 4.78,  &end
#
# 11 PHE H 11 PHE QB 3.41 
 &rst
  ixpk= 0, nxpk= 0, iat= 160,  -1, r1= 1.30, r2= 1.80, r3= 3.83, r4= 4.33,
 igr2= 164, 165,
 &end
#
# 10 LEU HG 11 PHE H 5.50 
 &rst
  ixpk= 0, nxpk= 0, iat= 148, 160, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
# 10 LEU HB2 11 PHE H 4.01 
 &rst
  ixpk= 0, nxpk= 0, iat= 145, 160, r1= 1.30, r2= 1.80, r3= 4.01, r4= 4.51,  &end
#
# 11 PHE H 81 VAL QG1 4.81 
 &rst
  ixpk= 0, nxpk= 0, iat= 160,  -1, r1= 1.30, r2= 1.80, r3= 5.78, r4= 6.28,
 igr2=1247,1248,1249,
 &end
#
# 36 GLU HA 55 THR H 5.50 
 &rst
  ixpk= 0, nxpk= 0, iat= 548, 863, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
# 38 LEU H 55 THR H 4.70 
 &rst
  ixpk= 0, nxpk= 0, iat= 577, 863, r1= 1.30, r2= 1.80, r3= 4.70, r4= 5.20,  &end
#
# 55 THR H 56 PHE HA 5.50 
 &rst
  ixpk= 0, nxpk= 0, iat= 863, 879, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
# 54 VAL HA 55 THR H 3.09 
 &rst
  ixpk= 0, nxpk= 0, iat= 849, 863, r1= 1.30, r2= 1.80, r3= 3.09, r4= 3.59,  &end
#
# 37 VAL HA 55 THR H 4.23 
 &rst
  ixpk= 0, nxpk= 0, iat= 563, 863, r1= 1.30, r2= 1.80, r3= 4.23, r4= 4.73,  &end
#
# 55 THR H 55 THR HB 3.53 
 &rst
  ixpk= 0, nxpk= 0, iat= 863, 867, r1= 1.30, r2= 1.80, r3= 3.53, r4= 4.03,  &end
#
# 36 GLU HG3 55 THR H 5.50 
 &rst
  ixpk= 0, nxpk= 0, iat= 554, 863, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
# 36 GLU HB3 55 THR H 4.83 
 &rst
  ixpk= 0, nxpk= 0, iat= 551, 863, r1= 1.30, r2= 1.80, r3= 4.83, r4= 5.33,  &end
#
# 55 THR H 55 THR QG2 4.64 
 &rst
  ixpk= 0, nxpk= 0, iat= 863,  -1, r1= 1.30, r2= 1.80, r3= 5.57, r4= 6.07,
 igr2= 869, 870, 871,
 &end
#
# 37 VAL QG2 55 THR H 4.95 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 863, r1= 1.30, r2= 1.80, r3= 5.94, r4= 6.44,
 igr1= 571, 572, 573,
 &end
#
# 35 VAL QG2 55 THR H 5.50 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 863, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr1= 540, 541, 542,
 &end
#
# 34 ILE QG2 55 THR H 4.48 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 863, r1= 1.30, r2= 1.80, r3= 5.38, r4= 5.88,
 igr1= 517, 518, 519,
 &end
#
# 93 ARG QB 94 ARG H 5.47 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1437, r1= 1.30, r2= 1.80, r3= 6.14, r4= 6.64,
 igr1=1417,1418,
 &end
#
# 20 ASN HA 23 ALA H 5.41 
 &rst
  ixpk= 0, nxpk= 0, iat= 291, 340, r1= 1.30, r2= 1.80, r3= 5.41, r4= 5.91,  &end
#
# 20 ASN HB3 23 ALA H 5.40 
 &rst
  ixpk= 0, nxpk= 0, iat= 294, 340, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,  &end
#
# 17 THR H 48 SER HB2 5.35 
 &rst
  ixpk= 0, nxpk= 0, iat= 246, 759, r1= 1.30, r2= 1.80, r3= 5.35, r4= 5.85,  &end
#
# 16 ASN H 17 THR H 5.50 
 &rst
  ixpk= 0, nxpk= 0, iat= 232, 246, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
# 16 ASN HB3 17 THR H 5.50 
 &rst
  ixpk= 0, nxpk= 0, iat= 237, 246, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
# 16 ASN HB2 17 THR H 5.29 
 &rst
  ixpk= 0, nxpk= 0, iat= 236, 246, r1= 1.30, r2= 1.80, r3= 5.29, r4= 5.79,  &end
#
# 17 THR H 18 GLU HB2 5.50 
 &rst
  ixpk= 0, nxpk= 0, iat= 246, 264, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
# 17 THR H 17 THR QG2 4.25 
 &rst
  ixpk= 0, nxpk= 0, iat= 246,  -1, r1= 1.30, r2= 1.80, r3= 5.10, r4= 5.60,
 igr2= 252, 253, 254,
 &end
#
# 35 VAL H 55 THR H 4.24 
 &rst
  ixpk= 0, nxpk= 0, iat= 530, 863, r1= 1.30, r2= 1.80, r3= 4.24, r4= 4.74,  &end
#
# 35 VAL H 56 PHE HA 3.96 
 &rst
  ixpk= 0, nxpk= 0, iat= 530, 879, r1= 1.30, r2= 1.80, r3= 3.96, r4= 4.46,  &end
#
# 35 VAL H 55 THR HB 4.61 
 &rst
  ixpk= 0, nxpk= 0, iat= 530, 867, r1= 1.30, r2= 1.80, r3= 4.61, r4= 5.11,  &end
#
# 35 VAL H 57 GLU QG 5.50 
 &rst
  ixpk= 0, nxpk= 0, iat= 530,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2= 904, 905,
 &end
#
# 35 VAL H 36 GLU HB3 5.29 
 &rst
  ixpk= 0, nxpk= 0, iat= 530, 551, r1= 1.30, r2= 1.80, r3= 5.29, r4= 5.79,  &end
#
# 34 ILE HB 35 VAL H 4.79 
 &rst
  ixpk= 0, nxpk= 0, iat= 515, 530, r1= 1.30, r2= 1.80, r3= 4.79, r4= 5.29,  &end
#
# 34 ILE HG13 35 VAL H 5.07 
 &rst
  ixpk= 0, nxpk= 0, iat= 522, 530, r1= 1.30, r2= 1.80, r3= 5.07, r4= 5.57,  &end
#
# 35 VAL H 55 THR QG2 4.98 
 &rst
  ixpk= 0, nxpk= 0, iat= 530,  -1, r1= 1.30, r2= 1.80, r3= 5.98, r4= 6.48,
 igr2= 869, 870, 871,
 &end
#
# 35 VAL H 54 VAL QG2 5.11 
 &rst
  ixpk= 0, nxpk= 0, iat= 530,  -1, r1= 1.30, r2= 1.80, r3= 6.14, r4= 6.64,
 igr2= 857, 858, 859,
 &end
#
# 34 ILE HG12 35 VAL H 4.91 
 &rst
  ixpk= 0, nxpk= 0, iat= 521, 530, r1= 1.30, r2= 1.80, r3= 4.91, r4= 5.41,  &end
#
# 40 MET H 41 LYS H 5.00 
 &rst
  ixpk= 0, nxpk= 0, iat= 615, 632, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50,  &end
#
# 41 LYS H 48 SER HA 5.05 
 &rst
  ixpk= 0, nxpk= 0, iat= 632, 757, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,  &end
#
# 41 LYS H 41 LYS QE 5.08 
 &rst
  ixpk= 0, nxpk= 0, iat= 632,  -1, r1= 1.30, r2= 1.80, r3= 5.70, r4= 6.20,
 igr2= 645, 646,
 &end
#
# 40 MET HG2 41 LYS H 5.48 
 &rst
  ixpk= 0, nxpk= 0, iat= 622, 632, r1= 1.30, r2= 1.80, r3= 5.48, r4= 5.98,  &end
#
# 41 LYS H 41 LYS HB3 3.82 
 &rst
  ixpk= 0, nxpk= 0, iat= 632, 637, r1= 1.30, r2= 1.80, r3= 3.82, r4= 4.32,  &end
#
# 41 LYS H 41 LYS HG3 3.99 
 &rst
  ixpk= 0, nxpk= 0, iat= 632, 640, r1= 1.30, r2= 1.80, r3= 3.99, r4= 4.49,  &end
#
# 41 LYS H 41 LYS HG2 4.18 
 &rst
  ixpk= 0, nxpk= 0, iat= 632, 639, r1= 1.30, r2= 1.80, r3= 4.18, r4= 4.68,  &end
#
# 65 ALA H 66 ALA H 3.55 
 &rst
  ixpk= 0, nxpk= 0, iat=1003,1013, r1= 1.30, r2= 1.80, r3= 3.55, r4= 4.05,  &end
#
# 63 LYS H 65 ALA H 4.61 
 &rst
  ixpk= 0, nxpk= 0, iat= 969,1003, r1= 1.30, r2= 1.80, r3= 4.61, r4= 5.11,  &end
#
# 64 ASP H 65 ALA H 3.23 
 &rst
  ixpk= 0, nxpk= 0, iat= 991,1003, r1= 1.30, r2= 1.80, r3= 3.23, r4= 3.73,  &end
#
# 31 TYR QE 65 ALA H 5.50 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1003, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 469, 474,
 &end
#
# 63 LYS HA 65 ALA H 5.01 
 &rst
  ixpk= 0, nxpk= 0, iat= 971,1003, r1= 1.30, r2= 1.80, r3= 5.01, r4= 5.51,  &end
#
# 65 ALA H 66 ALA HA 5.40 
 &rst
  ixpk= 0, nxpk= 0, iat=1003,1015, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,  &end
#
# 62 ALA HA 65 ALA H 3.87 
 &rst
  ixpk= 0, nxpk= 0, iat= 961,1003, r1= 1.30, r2= 1.80, r3= 3.87, r4= 4.37,  &end
#
# 64 ASP HB3 65 ALA H 3.46 
 &rst
  ixpk= 0, nxpk= 0, iat= 996,1003, r1= 1.30, r2= 1.80, r3= 3.46, r4= 3.96,  &end
#
# 64 ASP HB2 65 ALA H 3.72 
 &rst
  ixpk= 0, nxpk= 0, iat= 995,1003, r1= 1.30, r2= 1.80, r3= 3.72, r4= 4.22,  &end
#
# 63 LYS QB 65 ALA H 4.69 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1003, r1= 1.30, r2= 1.80, r3= 5.26, r4= 5.76,
 igr1= 973, 974,
 &end
#
# 62 ALA QB 65 ALA H 5.50 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1003, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr1= 963, 964, 965,
 &end
#
# 65 ALA H 66 ALA QB 4.94 
 &rst
  ixpk= 0, nxpk= 0, iat=1003,  -1, r1= 1.30, r2= 1.80, r3= 5.93, r4= 6.43,
 igr2=1017,1018,1019,
 &end
#
# 10 LEU QD1 65 ALA H 4.69 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1003, r1= 1.30, r2= 1.80, r3= 5.63, r4= 6.13,
 igr1= 150, 151, 152,
 &end
#
# 83 GLN H 84 ALA H 4.75 
 &rst
  ixpk= 0, nxpk= 0, iat=1272,1289, r1= 1.30, r2= 1.80, r3= 4.75, r4= 5.25,  &end
#
# 10 LEU HA 83 GLN H 5.50 
 &rst
  ixpk= 0, nxpk= 0, iat= 143,1272, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
# 82 GLU HA 83 GLN H 3.36 
 &rst
  ixpk= 0, nxpk= 0, iat=1259,1272, r1= 1.30, r2= 1.80, r3= 3.36, r4= 3.86,  &end
#
# 83 GLN H 83 GLN HG3 4.53 
 &rst
  ixpk= 0, nxpk= 0, iat=1272,1280, r1= 1.30, r2= 1.80, r3= 4.53, r4= 5.03,  &end
#
# 82 GLU HB3 83 GLN H 3.82 
 &rst
  ixpk= 0, nxpk= 0, iat=1262,1272, r1= 1.30, r2= 1.80, r3= 3.82, r4= 4.32,  &end
#
# 83 GLN H 83 GLN HB3 3.50 
 &rst
  ixpk= 0, nxpk= 0, iat=1272,1277, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
# 83 GLN H 83 GLN HB2 3.29 
 &rst
  ixpk= 0, nxpk= 0, iat=1272,1276, r1= 1.30, r2= 1.80, r3= 3.29, r4= 3.79,  &end
#
# 81 VAL QG1 83 GLN H 5.50 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1272, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr1=1247,1248,1249,
 &end
#
# 1 MET Q 2 VAL H 5.01 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  21, r1= 1.30, r2= 1.80, r3= 6.02, r4= 6.52,
 igr1=   2,   3,   4,
 &end
#
# 1 MET Q 2 VAL HA 5.50 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  23, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr1=   2,   3,   4,
 &end
#
# 1 MET Q 1 MET HG2 4.74 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  11, r1= 1.30, r2= 1.80, r3= 5.69, r4= 6.19,
 igr1=   2,   3,   4,
 &end
#
# 1 MET Q 1 MET HB2 3.77 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,   8, r1= 1.30, r2= 1.80, r3= 4.53, r4= 5.03,
 igr1=   2,   3,   4,
 &end
#
# 1 MET Q 2 VAL QQG 5.50 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.90, r4= 9.40,
 igr1=   2,   3,   4,
 igr2=  27,  28,  29,  31,  32,  33,
 &end
#
# 34 ILE HG12 57 GLU H 5.50 
 &rst
  ixpk= 0, nxpk= 0, iat= 521, 897, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
# 57 GLU H 58 SER H 3.67 
 &rst
  ixpk= 0, nxpk= 0, iat= 897, 912, r1= 1.30, r2= 1.80, r3= 3.67, r4= 4.17,  &end
#
# 35 VAL H 57 GLU H 4.29 
 &rst
  ixpk= 0, nxpk= 0, iat= 530, 897, r1= 1.30, r2= 1.80, r3= 4.29, r4= 4.79,  &end
#
# 56 PHE HA 57 GLU H 3.32 
 &rst
  ixpk= 0, nxpk= 0, iat= 879, 897, r1= 1.30, r2= 1.80, r3= 3.32, r4= 3.82,  &end
#
# 33 ARG HA 57 GLU H 5.43 
 &rst
  ixpk= 0, nxpk= 0, iat= 489, 897, r1= 1.30, r2= 1.80, r3= 5.43, r4= 5.93,  &end
#
# 34 ILE HA 57 GLU H 3.87 
 &rst
  ixpk= 0, nxpk= 0, iat= 513, 897, r1= 1.30, r2= 1.80, r3= 3.87, r4= 4.37,  &end
#
# 56 PHE HB3 57 GLU H 4.05 
 &rst
  ixpk= 0, nxpk= 0, iat= 882, 897, r1= 1.30, r2= 1.80, r3= 4.05, r4= 4.55,  &end
#
# 33 ARG QD 57 GLU H 5.50 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 897, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 497, 498,
 &end
#
# 56 PHE HB2 57 GLU H 4.25 
 &rst
  ixpk= 0, nxpk= 0, iat= 881, 897, r1= 1.30, r2= 1.80, r3= 4.25, r4= 4.75,  &end
#
# 57 GLU H 57 GLU HB3 3.32 
 &rst
  ixpk= 0, nxpk= 0, iat= 897, 902, r1= 1.30, r2= 1.80, r3= 3.32, r4= 3.82,  &end
#
# 57 GLU H 57 GLU HB2 3.41 
 &rst
  ixpk= 0, nxpk= 0, iat= 897, 901, r1= 1.30, r2= 1.80, r3= 3.41, r4= 3.91,  &end
#
# 55 THR QG2 57 GLU H 5.50 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 897, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr1= 869, 870, 871,
 &end
#
# 90 GLU H 90 GLU QG 5.25 
 &rst
  ixpk= 0, nxpk= 0, iat=1380,  -1, r1= 1.30, r2= 1.80, r3= 5.89, r4= 6.39,
 igr2=1387,1388,
 &end
#
# 9 LYS H 10 LEU H 4.92 
 &rst
  ixpk= 0, nxpk= 0, iat= 119, 141, r1= 1.30, r2= 1.80, r3= 4.92, r4= 5.42,  &end
#
# 9 LYS H 84 ALA H 5.50 
 &rst
  ixpk= 0, nxpk= 0, iat= 119,1289, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
# 8 GLY H 9 LYS H 3.60 
 &rst
  ixpk= 0, nxpk= 0, iat= 112, 119, r1= 1.30, r2= 1.80, r3= 3.60, r4= 4.10,  &end
#
# 9 LYS H 83 GLN HE22 4.67 
 &rst
  ixpk= 0, nxpk= 0, iat= 119,1284, r1= 1.30, r2= 1.80, r3= 4.67, r4= 5.17,  &end
#
# 9 LYS H 83 GLN HE21 4.50 
 &rst
  ixpk= 0, nxpk= 0, iat= 119,1285, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
# 7 PRO HA 9 LYS H 4.35 
 &rst
  ixpk= 0, nxpk= 0, iat= 108, 119, r1= 1.30, r2= 1.80, r3= 4.35, r4= 4.85,  &end
#
# 9 LYS H 83 GLN HG2 5.50 
 &rst
  ixpk= 0, nxpk= 0, iat= 119,1279, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
# 9 LYS H 9 LYS HB3 3.56 
 &rst
  ixpk= 0, nxpk= 0, iat= 119, 124, r1= 1.30, r2= 1.80, r3= 3.56, r4= 4.06,  &end
#
# 9 LYS H 10 LEU HG 4.80 
 &rst
  ixpk= 0, nxpk= 0, iat= 119, 148, r1= 1.30, r2= 1.80, r3= 4.80, r4= 5.30,  &end
#
# 9 LYS H 9 LYS HB2 3.62 
 &rst
  ixpk= 0, nxpk= 0, iat= 119, 123, r1= 1.30, r2= 1.80, r3= 3.62, r4= 4.12,  &end
#
# 9 LYS H 9 LYS HG3 4.70 
 &rst
  ixpk= 0, nxpk= 0, iat= 119, 127, r1= 1.30, r2= 1.80, r3= 4.70, r4= 5.20,  &end
#
# 9 LYS H 9 LYS HG2 5.14 
 &rst
  ixpk= 0, nxpk= 0, iat= 119, 126, r1= 1.30, r2= 1.80, r3= 5.14, r4= 5.64,  &end
#
# 9 LYS H 10 LEU QD2 5.50 
 &rst
  ixpk= 0, nxpk= 0, iat= 119,  -1, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr2= 154, 155, 156,
 &end
#
# 41 LYS H 49 ARG HG3 4.38 
 &rst
  ixpk= 0, nxpk= 0, iat= 632, 774, r1= 1.30, r2= 1.80, r3= 4.38, r4= 4.88,  &end
#
# 89 PHE QB 90 GLU H 4.98 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1380, r1= 1.30, r2= 1.80, r3= 5.59, r4= 6.09,
 igr1=1364,1365,
 &end
#
# 13 GLY H 52 ALA H 5.22 
 &rst
  ixpk= 0, nxpk= 0, iat= 199, 817, r1= 1.30, r2= 1.80, r3= 5.22, r4= 5.72,  &end
#
# 52 ALA H 53 PHE H 5.17 
 &rst
  ixpk= 0, nxpk= 0, iat= 817, 827, r1= 1.30, r2= 1.80, r3= 5.17, r4= 5.67,  &end
#
# 13 GLY HA2 52 ALA H 5.50 
 &rst
  ixpk= 0, nxpk= 0, iat= 201, 817, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
# 12 ILE H 52 ALA H 4.49 
 &rst
  ixpk= 0, nxpk= 0, iat= 180, 817, r1= 1.30, r2= 1.80, r3= 4.49, r4= 4.99,  &end
#
# 40 MET H 52 ALA H 5.50 
 &rst
  ixpk= 0, nxpk= 0, iat= 615, 817, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
# 11 PHE QE 52 ALA H 5.50 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 817, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 170, 174,
 &end
#
# 13 GLY HA3 52 ALA H 5.50 
 &rst
  ixpk= 0, nxpk= 0, iat= 202, 817, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
# 51 PHE HB3 52 ALA H 4.27 
 &rst
  ixpk= 0, nxpk= 0, iat= 802, 817, r1= 1.30, r2= 1.80, r3= 4.27, r4= 4.77,  &end
#
# 25 GLU H 26 ALA H 3.28 
 &rst
  ixpk= 0, nxpk= 0, iat= 369, 384, r1= 1.30, r2= 1.80, r3= 3.28, r4= 3.78,  &end
#
# 23 ALA HA 26 ALA H 3.79 
 &rst
  ixpk= 0, nxpk= 0, iat= 342, 384, r1= 1.30, r2= 1.80, r3= 3.79, r4= 4.29,  &end
#
# 25 GLU QB 26 ALA H 3.22 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 384, r1= 1.30, r2= 1.80, r3= 3.61, r4= 4.11,
 igr1= 373, 374,
 &end
#
# 26 ALA H 34 ILE QD1 5.50 
 &rst
  ixpk= 0, nxpk= 0, iat= 384,  -1, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr2= 524, 525, 526,
 &end
#
# 60 ALA H 62 ALA H 4.86 
 &rst
  ixpk= 0, nxpk= 0, iat= 937, 959, r1= 1.30, r2= 1.80, r3= 4.86, r4= 5.36,  &end
#
# 60 ALA H 61 ASP HB3 5.41 
 &rst
  ixpk= 0, nxpk= 0, iat= 937, 952, r1= 1.30, r2= 1.80, r3= 5.41, r4= 5.91,  &end
#
# 71 GLY H 72 LYS H 3.44 
 &rst
  ixpk= 0, nxpk= 0, iat=1090,1097, r1= 1.30, r2= 1.80, r3= 3.44, r4= 3.94,  &end
#
# 70 ASN H 72 LYS H 4.99 
 &rst
  ixpk= 0, nxpk= 0, iat=1076,1097, r1= 1.30, r2= 1.80, r3= 4.99, r4= 5.49,  &end
#
# 60 ALA H 61 ASP H 3.48 
 &rst
  ixpk= 0, nxpk= 0, iat= 937, 947, r1= 1.30, r2= 1.80, r3= 3.48, r4= 3.98,  &end
#
# 58 SER HA 60 ALA H 4.84 
 &rst
  ixpk= 0, nxpk= 0, iat= 914, 937, r1= 1.30, r2= 1.80, r3= 4.84, r4= 5.34,  &end
#
# 72 LYS H 72 LYS QE 5.50 
 &rst
  ixpk= 0, nxpk= 0, iat=1097,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=1110,1111,
 &end
#
# 59 PRO HG3 60 ALA H 4.39 
 &rst
  ixpk= 0, nxpk= 0, iat= 928, 937, r1= 1.30, r2= 1.80, r3= 4.39, r4= 4.89,  &end
#
# 72 LYS H 72 LYS HB3 3.15 
 &rst
  ixpk= 0, nxpk= 0, iat=1097,1102, r1= 1.30, r2= 1.80, r3= 3.15, r4= 3.65,  &end
#
# 72 LYS H 72 LYS HB2 3.49 
 &rst
  ixpk= 0, nxpk= 0, iat=1097,1101, r1= 1.30, r2= 1.80, r3= 3.49, r4= 3.99,  &end
#
# 72 LYS H 72 LYS HG3 3.77 
 &rst
  ixpk= 0, nxpk= 0, iat=1097,1105, r1= 1.30, r2= 1.80, r3= 3.77, r4= 4.27,  &end
#
# 60 ALA H 60 ALA QB 3.31 
 &rst
  ixpk= 0, nxpk= 0, iat= 937,  -1, r1= 1.30, r2= 1.80, r3= 3.98, r4= 4.48,
 igr2= 941, 942, 943,
 &end
#
# 72 LYS H 72 LYS HG2 3.65 
 &rst
  ixpk= 0, nxpk= 0, iat=1097,1104, r1= 1.30, r2= 1.80, r3= 3.65, r4= 4.15,  &end
#
# 72 LYS H 78 ALA QB 5.50 
 &rst
  ixpk= 0, nxpk= 0, iat=1097,  -1, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr2=1194,1195,1196,
 &end
#
# 62 ALA H 64 ASP H 4.80 
 &rst
  ixpk= 0, nxpk= 0, iat= 959, 991, r1= 1.30, r2= 1.80, r3= 4.80, r4= 5.30,  &end
#
# 62 ALA HA 64 ASP H 4.84 
 &rst
  ixpk= 0, nxpk= 0, iat= 961, 991, r1= 1.30, r2= 1.80, r3= 4.84, r4= 5.34,  &end
#
# 64 ASP H 64 ASP HB3 3.19 
 &rst
  ixpk= 0, nxpk= 0, iat= 991, 996, r1= 1.30, r2= 1.80, r3= 3.19, r4= 3.69,  &end
#
# 64 ASP H 65 ALA HA 5.45 
 &rst
  ixpk= 0, nxpk= 0, iat= 991,1005, r1= 1.30, r2= 1.80, r3= 5.45, r4= 5.95,  &end
#
# 63 LYS QB 64 ASP H 3.20 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 991, r1= 1.30, r2= 1.80, r3= 3.59, r4= 4.09,
 igr1= 973, 974,
 &end
#
# 63 LYS QD 64 ASP H 5.38 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 991, r1= 1.30, r2= 1.80, r3= 6.04, r4= 6.54,
 igr1= 979, 980,
 &end
#
# 63 LYS HG3 64 ASP H 5.04 
 &rst
  ixpk= 0, nxpk= 0, iat= 977, 991, r1= 1.30, r2= 1.80, r3= 5.04, r4= 5.54,  &end
#
# 62 ALA QB 64 ASP H 5.18 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 991, r1= 1.30, r2= 1.80, r3= 6.22, r4= 6.72,
 igr1= 963, 964, 965,
 &end
#
# 64 ASP H 65 ALA QB 4.84 
 &rst
  ixpk= 0, nxpk= 0, iat= 991,  -1, r1= 1.30, r2= 1.80, r3= 5.81, r4= 6.31,
 igr2=1007,1008,1009,
 &end
#
# 10 LEU QD1 64 ASP H 5.50 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 991, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr1= 150, 151, 152,
 &end
#
# 16 ASN H 75 ASP HB3 5.50 
 &rst
  ixpk= 0, nxpk= 0, iat= 232,1154, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
# 16 ASN H 75 ASP HB2 5.12 
 &rst
  ixpk= 0, nxpk= 0, iat= 232,1153, r1= 1.30, r2= 1.80, r3= 5.12, r4= 5.62,  &end
#
# 16 ASN H 19 THR H 4.69 
 &rst
  ixpk= 0, nxpk= 0, iat= 232, 275, r1= 1.30, r2= 1.80, r3= 4.69, r4= 5.19,  &end
#
# 16 ASN H 16 ASN HB3 3.73 
 &rst
  ixpk= 0, nxpk= 0, iat= 232, 237, r1= 1.30, r2= 1.80, r3= 3.73, r4= 4.23,  &end
#
# 16 ASN H 16 ASN HB2 3.74 
 &rst
  ixpk= 0, nxpk= 0, iat= 232, 236, r1= 1.30, r2= 1.80, r3= 3.74, r4= 4.24,  &end
#
# 16 ASN H 77 LYS HB3 5.46 
 &rst
  ixpk= 0, nxpk= 0, iat= 232,1173, r1= 1.30, r2= 1.80, r3= 5.46, r4= 5.96,  &end
#
# 16 ASN H 77 LYS HB2 4.85 
 &rst
  ixpk= 0, nxpk= 0, iat= 232,1172, r1= 1.30, r2= 1.80, r3= 4.85, r4= 5.35,  &end
#
# 15 LEU HB3 16 ASN H 4.15 
 &rst
  ixpk= 0, nxpk= 0, iat= 218, 232, r1= 1.30, r2= 1.80, r3= 4.15, r4= 4.65,  &end
#
# 15 LEU HB2 16 ASN H 4.78 
 &rst
  ixpk= 0, nxpk= 0, iat= 217, 232, r1= 1.30, r2= 1.80, r3= 4.78, r4= 5.28,  &end
#
# 5 ASP H 86 LYS H 4.89 
 &rst
  ixpk= 0, nxpk= 0, iat=  62,1313, r1= 1.30, r2= 1.80, r3= 4.89, r4= 5.39,  &end
#
# 85 THR HB 86 LYS H 3.36 
 &rst
  ixpk= 0, nxpk= 0, iat=1303,1313, r1= 1.30, r2= 1.80, r3= 3.36, r4= 3.86,  &end
#
# 86 LYS H 87 PRO HD3 5.50 
 &rst
  ixpk= 0, nxpk= 0, iat=1313,1337, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
# 86 LYS H 86 LYS QE 5.50 
 &rst
  ixpk= 0, nxpk= 0, iat=1313,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=1326,1327,
 &end
#
# 5 ASP HB3 86 LYS H 5.29 
 &rst
  ixpk= 0, nxpk= 0, iat=  67,1313, r1= 1.30, r2= 1.80, r3= 5.29, r4= 5.79,  &end
#
# 5 ASP HB2 86 LYS H 5.06 
 &rst
  ixpk= 0, nxpk= 0, iat=  66,1313, r1= 1.30, r2= 1.80, r3= 5.06, r4= 5.56,  &end
#
# 86 LYS H 86 LYS HB3 4.06 
 &rst
  ixpk= 0, nxpk= 0, iat=1313,1318, r1= 1.30, r2= 1.80, r3= 4.06, r4= 4.56,  &end
#
# 86 LYS H 86 LYS HB2 3.56 
 &rst
  ixpk= 0, nxpk= 0, iat=1313,1317, r1= 1.30, r2= 1.80, r3= 3.56, r4= 4.06,  &end
#
# 4 ALA QB 86 LYS H 5.50 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1313, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr1=  56,  57,  58,
 &end
#
# 86 LYS H 86 LYS HG3 4.07 
 &rst
  ixpk= 0, nxpk= 0, iat=1313,1321, r1= 1.30, r2= 1.80, r3= 4.07, r4= 4.57,  &end
#
# 2 VAL H 3 GLU H 4.86 
 &rst
  ixpk= 0, nxpk= 0, iat=  21,  37, r1= 1.30, r2= 1.80, r3= 4.86, r4= 5.36,  &end
#
# 2 VAL H 2 VAL HB 3.48 
 &rst
  ixpk= 0, nxpk= 0, iat=  21,  25, r1= 1.30, r2= 1.80, r3= 3.48, r4= 3.98,  &end
#
# 2 VAL H 2 VAL QQG 3.58 
 &rst
  ixpk= 0, nxpk= 0, iat=  21,  -1, r1= 1.30, r2= 1.80, r3= 4.83, r4= 5.33,
 igr2=  27,  28,  29,  31,  32,  33,
 &end
#
# 2 VAL H 3 GLU HA 5.05 
 &rst
  ixpk= 0, nxpk= 0, iat=  21,  39, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,  &end
#
# 1 MET HG2 2 VAL H 5.50 
 &rst
  ixpk= 0, nxpk= 0, iat=  11,  21, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
# 58 SER H 60 ALA H 5.50 
 &rst
  ixpk= 0, nxpk= 0, iat= 912, 937, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
# 91 SER QB 93 ARG H 5.50 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1413, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=1399,1400,
 &end
#
# 93 ARG H 93 ARG QG 4.84 
 &rst
  ixpk= 0, nxpk= 0, iat=1413,  -1, r1= 1.30, r2= 1.80, r3= 5.43, r4= 5.93,
 igr2=1420,1421,
 &end
#
# 87 PRO QG 89 PHE H 5.13 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1360, r1= 1.30, r2= 1.80, r3= 5.76, r4= 6.26,
 igr1=1339,1340,
 &end
#
# 58 SER H 61 ASP H 5.03 
 &rst
  ixpk= 0, nxpk= 0, iat= 912, 947, r1= 1.30, r2= 1.80, r3= 5.03, r4= 5.53,  &end
#
# 61 ASP H 64 ASP H 5.50 
 &rst
  ixpk= 0, nxpk= 0, iat= 947, 991, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
# 61 ASP H 62 ALA H 3.39 
 &rst
  ixpk= 0, nxpk= 0, iat= 947, 959, r1= 1.30, r2= 1.80, r3= 3.39, r4= 3.89,  &end
#
# 58 SER HA 61 ASP H 5.35 
 &rst
  ixpk= 0, nxpk= 0, iat= 914, 947, r1= 1.30, r2= 1.80, r3= 5.35, r4= 5.85,  &end
#
# 32 GLY HA3 61 ASP H 5.50 
 &rst
  ixpk= 0, nxpk= 0, iat= 483, 947, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
# 58 SER QB 61 ASP H 3.48 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 947, r1= 1.30, r2= 1.80, r3= 3.91, r4= 4.41,
 igr1= 916, 917,
 &end
#
# 56 PHE HB3 61 ASP H 5.45 
 &rst
  ixpk= 0, nxpk= 0, iat= 882, 947, r1= 1.30, r2= 1.80, r3= 5.45, r4= 5.95,  &end
#
# 61 ASP H 62 ALA HA 5.29 
 &rst
  ixpk= 0, nxpk= 0, iat= 947, 961, r1= 1.30, r2= 1.80, r3= 5.29, r4= 5.79,  &end
#
# 61 ASP H 61 ASP HB3 3.49 
 &rst
  ixpk= 0, nxpk= 0, iat= 947, 952, r1= 1.30, r2= 1.80, r3= 3.49, r4= 3.99,  &end
#
# 61 ASP H 61 ASP HB2 3.72 
 &rst
  ixpk= 0, nxpk= 0, iat= 947, 951, r1= 1.30, r2= 1.80, r3= 3.72, r4= 4.22,  &end
#
# 61 ASP H 63 LYS QB 5.50 
 &rst
  ixpk= 0, nxpk= 0, iat= 947,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2= 973, 974,
 &end
#
# 61 ASP H 62 ALA QB 4.89 
 &rst
  ixpk= 0, nxpk= 0, iat= 947,  -1, r1= 1.30, r2= 1.80, r3= 5.87, r4= 6.37,
 igr2= 963, 964, 965,
 &end
#
# 60 ALA QB 61 ASP H 3.68 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 947, r1= 1.30, r2= 1.80, r3= 4.42, r4= 4.92,
 igr1= 941, 942, 943,
 &end
#
# 74 LEU H 77 LYS H 3.63 
 &rst
  ixpk= 0, nxpk= 0, iat=1130,1168, r1= 1.30, r2= 1.80, r3= 3.63, r4= 4.13,  &end
#
# 77 LYS H 78 ALA H 4.40 
 &rst
  ixpk= 0, nxpk= 0, iat=1168,1190, r1= 1.30, r2= 1.80, r3= 4.40, r4= 4.90,  &end
#
# 74 LEU HA 77 LYS H 5.50 
 &rst
  ixpk= 0, nxpk= 0, iat=1132,1168, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
# 75 ASP HA 77 LYS H 5.45 
 &rst
  ixpk= 0, nxpk= 0, iat=1151,1168, r1= 1.30, r2= 1.80, r3= 5.45, r4= 5.95,  &end
#
# 16 ASN HB3 77 LYS H 5.50 
 &rst
  ixpk= 0, nxpk= 0, iat= 237,1168, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
# 77 LYS H 77 LYS QE 5.50 
 &rst
  ixpk= 0, nxpk= 0, iat=1168,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=1181,1182,
 &end
#
# 75 ASP HB3 77 LYS H 5.50 
 &rst
  ixpk= 0, nxpk= 0, iat=1154,1168, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
# 16 ASN HB2 77 LYS H 5.31 
 &rst
  ixpk= 0, nxpk= 0, iat= 236,1168, r1= 1.30, r2= 1.80, r3= 5.31, r4= 5.81,  &end
#
# 75 ASP HB2 77 LYS H 5.50 
 &rst
  ixpk= 0, nxpk= 0, iat=1153,1168, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
# 77 LYS H 77 LYS HB3 3.81 
 &rst
  ixpk= 0, nxpk= 0, iat=1168,1173, r1= 1.30, r2= 1.80, r3= 3.81, r4= 4.31,  &end
#
# 77 LYS H 77 LYS HB2 3.42 
 &rst
  ixpk= 0, nxpk= 0, iat=1168,1172, r1= 1.30, r2= 1.80, r3= 3.42, r4= 3.92,  &end
#
# 77 LYS H 77 LYS HG2 3.95 
 &rst
  ixpk= 0, nxpk= 0, iat=1168,1175, r1= 1.30, r2= 1.80, r3= 3.95, r4= 4.45,  &end
#
# 77 LYS H 79 ILE QG2 5.33 
 &rst
  ixpk= 0, nxpk= 0, iat=1168,  -1, r1= 1.30, r2= 1.80, r3= 6.40, r4= 6.90,
 igr2=1206,1207,1208,
 &end
#
# 75 ASP H 77 LYS H 4.99 
 &rst
  ixpk= 0, nxpk= 0, iat=1149,1168, r1= 1.30, r2= 1.80, r3= 4.99, r4= 5.49,  &end
#
# 74 LEU HB2 77 LYS H 5.05 
 &rst
  ixpk= 0, nxpk= 0, iat=1134,1168, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,  &end
#
# 22 LYS HA 25 GLU H 3.58 
 &rst
  ixpk= 0, nxpk= 0, iat= 320, 369, r1= 1.30, r2= 1.80, r3= 3.58, r4= 4.08,  &end
#
# 25 GLU H 25 GLU QB 3.00 
 &rst
  ixpk= 0, nxpk= 0, iat= 369,  -1, r1= 1.30, r2= 1.80, r3= 3.37, r4= 3.87,
 igr2= 373, 374,
 &end
#
# 24 LEU HB3 25 GLU H 3.57 
 &rst
  ixpk= 0, nxpk= 0, iat= 355, 369, r1= 1.30, r2= 1.80, r3= 3.57, r4= 4.07,  &end
#
# 24 LEU HG 25 GLU H 4.73 
 &rst
  ixpk= 0, nxpk= 0, iat= 357, 369, r1= 1.30, r2= 1.80, r3= 4.73, r4= 5.23,  &end
#
# 25 GLU H 26 ALA QB 4.83 
 &rst
  ixpk= 0, nxpk= 0, iat= 369,  -1, r1= 1.30, r2= 1.80, r3= 5.80, r4= 6.30,
 igr2= 388, 389, 390,
 &end
#
# 24 LEU HB2 25 GLU H 3.88 
 &rst
  ixpk= 0, nxpk= 0, iat= 354, 369, r1= 1.30, r2= 1.80, r3= 3.88, r4= 4.38,  &end
#
# 25 GLU H 37 VAL QG2 4.57 
 &rst
  ixpk= 0, nxpk= 0, iat= 369,  -1, r1= 1.30, r2= 1.80, r3= 5.49, r4= 5.99,
 igr2= 571, 572, 573,
 &end
#
# 25 GLU H 37 VAL QG1 4.67 
 &rst
  ixpk= 0, nxpk= 0, iat= 369,  -1, r1= 1.30, r2= 1.80, r3= 5.61, r4= 6.11,
 igr2= 567, 568, 569,
 &end
#
# 24 LEU QD1 25 GLU H 4.94 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 369, r1= 1.30, r2= 1.80, r3= 5.93, r4= 6.43,
 igr1= 359, 360, 361,
 &end
#
# 25 GLU H 34 ILE QD1 5.31 
 &rst
  ixpk= 0, nxpk= 0, iat= 369,  -1, r1= 1.30, r2= 1.80, r3= 6.38, r4= 6.88,
 igr2= 524, 525, 526,
 &end
#
# 4 ALA H 5 ASP H 4.08 
 &rst
  ixpk= 0, nxpk= 0, iat=  52,  62, r1= 1.30, r2= 1.80, r3= 4.08, r4= 4.58,  &end
#
# 5 ASP H 83 GLN HE22 4.59 
 &rst
  ixpk= 0, nxpk= 0, iat=  62,1284, r1= 1.30, r2= 1.80, r3= 4.59, r4= 5.09,  &end
#
# 5 ASP H 83 GLN HE21 4.91 
 &rst
  ixpk= 0, nxpk= 0, iat=  62,1285, r1= 1.30, r2= 1.80, r3= 4.91, r4= 5.41,  &end
#
# 3 GLU HA 5 ASP H 5.49 
 &rst
  ixpk= 0, nxpk= 0, iat=  39,  62, r1= 1.30, r2= 1.80, r3= 5.49, r4= 5.99,  &end
#
# 4 ALA HA 5 ASP H 3.55 
 &rst
  ixpk= 0, nxpk= 0, iat=  54,  62, r1= 1.30, r2= 1.80, r3= 3.55, r4= 4.05,  &end
#
# 5 ASP H 5 ASP HB3 3.72 
 &rst
  ixpk= 0, nxpk= 0, iat=  62,  67, r1= 1.30, r2= 1.80, r3= 3.72, r4= 4.22,  &end
#
# 5 ASP H 5 ASP HB2 3.65 
 &rst
  ixpk= 0, nxpk= 0, iat=  62,  66, r1= 1.30, r2= 1.80, r3= 3.65, r4= 4.15,  &end
#
# 4 ALA QB 5 ASP H 3.92 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  62, r1= 1.30, r2= 1.80, r3= 4.71, r4= 5.21,
 igr1=  56,  57,  58,
 &end
#
# 5 ASP H 86 LYS HG3 5.50 
 &rst
  ixpk= 0, nxpk= 0, iat=  62,1321, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
# 74 LEU H 79 ILE H 4.34 
 &rst
  ixpk= 0, nxpk= 0, iat=1130,1200, r1= 1.30, r2= 1.80, r3= 4.34, r4= 4.84,  &end
#
# 79 ILE H 80 LYS H 4.65 
 &rst
  ixpk= 0, nxpk= 0, iat=1200,1219, r1= 1.30, r2= 1.80, r3= 4.65, r4= 5.15,  &end
#
# 72 LYS H 79 ILE H 5.17 
 &rst
  ixpk= 0, nxpk= 0, iat=1097,1200, r1= 1.30, r2= 1.80, r3= 5.17, r4= 5.67,  &end
#
# 71 GLY HA2 79 ILE H 5.19 
 &rst
  ixpk= 0, nxpk= 0, iat=1092,1200, r1= 1.30, r2= 1.80, r3= 5.19, r4= 5.69,  &end
#
# 72 LYS HB3 79 ILE H 5.50 
 &rst
  ixpk= 0, nxpk= 0, iat=1102,1200, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
# 79 ILE H 79 ILE QG1 3.24 
 &rst
  ixpk= 0, nxpk= 0, iat=1200,  -1, r1= 1.30, r2= 1.80, r3= 3.64, r4= 4.14,
 igr2=1210,1211,
 &end
#
# 78 ALA QB 79 ILE H 3.93 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1200, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,
 igr1=1194,1195,1196,
 &end
#
# 79 ILE H 81 VAL QG2 5.48 
 &rst
  ixpk= 0, nxpk= 0, iat=1200,  -1, r1= 1.30, r2= 1.80, r3= 6.58, r4= 7.08,
 igr2=1251,1252,1253,
 &end
#
# 79 ILE H 79 ILE QD1 4.42 
 &rst
  ixpk= 0, nxpk= 0, iat=1200,  -1, r1= 1.30, r2= 1.80, r3= 5.31, r4= 5.81,
 igr2=1213,1214,1215,
 &end
#
# 58 SER H 62 ALA H 5.39 
 &rst
  ixpk= 0, nxpk= 0, iat= 912, 959, r1= 1.30, r2= 1.80, r3= 5.39, r4= 5.89,  &end
#
# 62 ALA H 65 ALA QB 5.50 
 &rst
  ixpk= 0, nxpk= 0, iat= 959,  -1, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr2=1007,1008,1009,
 &end
#
# 59 PRO HA 62 ALA H 4.12 
 &rst
  ixpk= 0, nxpk= 0, iat= 933, 959, r1= 1.30, r2= 1.80, r3= 4.12, r4= 4.62,  &end
#
# 62 ALA H 63 LYS HA 5.40 
 &rst
  ixpk= 0, nxpk= 0, iat= 959, 971, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,  &end
#
# 8 GLY HA2 62 ALA H 5.20 
 &rst
  ixpk= 0, nxpk= 0, iat= 114, 959, r1= 1.30, r2= 1.80, r3= 5.20, r4= 5.70,  &end
#
# 56 PHE HB3 62 ALA H 4.65 
 &rst
  ixpk= 0, nxpk= 0, iat= 882, 959, r1= 1.30, r2= 1.80, r3= 4.65, r4= 5.15,  &end
#
# 61 ASP HB3 62 ALA H 3.71 
 &rst
  ixpk= 0, nxpk= 0, iat= 952, 959, r1= 1.30, r2= 1.80, r3= 3.71, r4= 4.21,  &end
#
# 61 ASP HB2 62 ALA H 4.10 
 &rst
  ixpk= 0, nxpk= 0, iat= 951, 959, r1= 1.30, r2= 1.80, r3= 4.10, r4= 4.60,  &end
#
# 62 ALA H 63 LYS QB 4.54 
 &rst
  ixpk= 0, nxpk= 0, iat= 959,  -1, r1= 1.30, r2= 1.80, r3= 5.10, r4= 5.60,
 igr2= 973, 974,
 &end
#
# 62 ALA H 63 LYS HG3 5.46 
 &rst
  ixpk= 0, nxpk= 0, iat= 959, 977, r1= 1.30, r2= 1.80, r3= 5.46, r4= 5.96,  &end
#
# 10 LEU QD1 62 ALA H 5.50 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 959, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr1= 150, 151, 152,
 &end
#
# 10 LEU QD2 62 ALA H 5.50 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 959, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr1= 154, 155, 156,
 &end
#
# 17 THR H 19 THR H 4.99 
 &rst
  ixpk= 0, nxpk= 0, iat= 246, 275, r1= 1.30, r2= 1.80, r3= 4.99, r4= 5.49,  &end
#
# 18 GLU H 19 THR H 3.20 
 &rst
  ixpk= 0, nxpk= 0, iat= 260, 275, r1= 1.30, r2= 1.80, r3= 3.20, r4= 3.70,  &end
#
# 16 ASN HA 19 THR H 5.50 
 &rst
  ixpk= 0, nxpk= 0, iat= 234, 275, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
# 17 THR HB 19 THR H 5.50 
 &rst
  ixpk= 0, nxpk= 0, iat= 250, 275, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
# 19 THR H 19 THR HB 3.09 
 &rst
  ixpk= 0, nxpk= 0, iat= 275, 279, r1= 1.30, r2= 1.80, r3= 3.09, r4= 3.59,  &end
#
# 17 THR HA 19 THR H 4.24 
 &rst
  ixpk= 0, nxpk= 0, iat= 248, 275, r1= 1.30, r2= 1.80, r3= 4.24, r4= 4.74,  &end
#
# 16 ASN HB3 19 THR H 3.92 
 &rst
  ixpk= 0, nxpk= 0, iat= 237, 275, r1= 1.30, r2= 1.80, r3= 3.92, r4= 4.42,  &end
#
# 19 THR H 75 ASP HB3 5.50 
 &rst
  ixpk= 0, nxpk= 0, iat= 275,1154, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
# 16 ASN HB2 19 THR H 4.74 
 &rst
  ixpk= 0, nxpk= 0, iat= 236, 275, r1= 1.30, r2= 1.80, r3= 4.74, r4= 5.24,  &end
#
# 18 GLU HG3 19 THR H 5.42 
 &rst
  ixpk= 0, nxpk= 0, iat= 268, 275, r1= 1.30, r2= 1.80, r3= 5.42, r4= 5.92,  &end
#
# 18 GLU HB2 19 THR H 4.05 
 &rst
  ixpk= 0, nxpk= 0, iat= 264, 275, r1= 1.30, r2= 1.80, r3= 4.05, r4= 4.55,  &end
#
# 15 LEU HB3 19 THR H 5.50 
 &rst
  ixpk= 0, nxpk= 0, iat= 218, 275, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
# 19 THR H 19 THR QG2 4.20 
 &rst
  ixpk= 0, nxpk= 0, iat= 275,  -1, r1= 1.30, r2= 1.80, r3= 5.04, r4= 5.54,
 igr2= 281, 282, 283,
 &end
#
# 15 LEU QD2 19 THR H 5.47 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 275, r1= 1.30, r2= 1.80, r3= 6.57, r4= 7.07,
 igr1= 226, 227, 228,
 &end
#
# 63 LYS H 66 ALA H 5.10 
 &rst
  ixpk= 0, nxpk= 0, iat= 969,1013, r1= 1.30, r2= 1.80, r3= 5.10, r4= 5.60,  &end
#
# 64 ASP H 66 ALA H 4.72 
 &rst
  ixpk= 0, nxpk= 0, iat= 991,1013, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,  &end
#
# 21 GLU H 22 LYS H 3.55 
 &rst
  ixpk= 0, nxpk= 0, iat= 303, 318, r1= 1.30, r2= 1.80, r3= 3.55, r4= 4.05,  &end
#
# 22 LYS H 25 GLU H 5.24 
 &rst
  ixpk= 0, nxpk= 0, iat= 318, 369, r1= 1.30, r2= 1.80, r3= 5.24, r4= 5.74,  &end
#
# 20 ASN H 22 LYS H 4.83 
 &rst
  ixpk= 0, nxpk= 0, iat= 289, 318, r1= 1.30, r2= 1.80, r3= 4.83, r4= 5.33,  &end
#
# 20 ASN HD21 22 LYS H 5.14 
 &rst
  ixpk= 0, nxpk= 0, iat= 299, 318, r1= 1.30, r2= 1.80, r3= 5.14, r4= 5.64,  &end
#
# 20 ASN HA 22 LYS H 4.82 
 &rst
  ixpk= 0, nxpk= 0, iat= 291, 318, r1= 1.30, r2= 1.80, r3= 4.82, r4= 5.32,  &end
#
# 22 LYS H 23 ALA HA 5.31 
 &rst
  ixpk= 0, nxpk= 0, iat= 318, 342, r1= 1.30, r2= 1.80, r3= 5.31, r4= 5.81,  &end
#
# 21 GLU HG3 22 LYS H 4.64 
 &rst
  ixpk= 0, nxpk= 0, iat= 311, 318, r1= 1.30, r2= 1.80, r3= 4.64, r4= 5.14,  &end
#
# 22 LYS H 22 LYS HB3 3.05 
 &rst
  ixpk= 0, nxpk= 0, iat= 318, 323, r1= 1.30, r2= 1.80, r3= 3.05, r4= 3.55,  &end
#
# 22 LYS H 22 LYS QD 4.54 
 &rst
  ixpk= 0, nxpk= 0, iat= 318,  -1, r1= 1.30, r2= 1.80, r3= 5.10, r4= 5.60,
 igr2= 328, 329,
 &end
#
# 22 LYS H 37 VAL QG1 5.36 
 &rst
  ixpk= 0, nxpk= 0, iat= 318,  -1, r1= 1.30, r2= 1.80, r3= 6.44, r4= 6.94,
 igr2= 567, 568, 569,
 &end
#
# 22 LYS H 24 LEU QD1 5.50 
 &rst
  ixpk= 0, nxpk= 0, iat= 318,  -1, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr2= 359, 360, 361,
 &end
#
# 36 GLU H 55 THR H 3.72 
 &rst
  ixpk= 0, nxpk= 0, iat= 546, 863, r1= 1.30, r2= 1.80, r3= 3.72, r4= 4.22,  &end
#
# 35 VAL H 36 GLU H 3.09 
 &rst
  ixpk= 0, nxpk= 0, iat= 530, 546, r1= 1.30, r2= 1.80, r3= 3.09, r4= 3.59,  &end
#
# 36 GLU H 37 VAL H 4.43 
 &rst
  ixpk= 0, nxpk= 0, iat= 546, 561, r1= 1.30, r2= 1.80, r3= 4.43, r4= 4.93,  &end
#
# 36 GLU H 55 THR HA 5.47 
 &rst
  ixpk= 0, nxpk= 0, iat= 546, 865, r1= 1.30, r2= 1.80, r3= 5.47, r4= 5.97,  &end
#
# 36 GLU H 56 PHE HA 5.13 
 &rst
  ixpk= 0, nxpk= 0, iat= 546, 879, r1= 1.30, r2= 1.80, r3= 5.13, r4= 5.63,  &end
#
# 36 GLU H 55 THR HB 3.60 
 &rst
  ixpk= 0, nxpk= 0, iat= 546, 867, r1= 1.30, r2= 1.80, r3= 3.60, r4= 4.10,  &end
#
# 36 GLU H 36 GLU HG3 4.87 
 &rst
  ixpk= 0, nxpk= 0, iat= 546, 554, r1= 1.30, r2= 1.80, r3= 4.87, r4= 5.37,  &end
#
# 36 GLU H 36 GLU HB3 3.97 
 &rst
  ixpk= 0, nxpk= 0, iat= 546, 551, r1= 1.30, r2= 1.80, r3= 3.97, r4= 4.47,  &end
#
# 36 GLU H 36 GLU HB2 3.64 
 &rst
  ixpk= 0, nxpk= 0, iat= 546, 550, r1= 1.30, r2= 1.80, r3= 3.64, r4= 4.14,  &end
#
# 36 GLU H 37 VAL QG2 4.29 
 &rst
  ixpk= 0, nxpk= 0, iat= 546,  -1, r1= 1.30, r2= 1.80, r3= 5.15, r4= 5.65,
 igr2= 571, 572, 573,
 &end
#
# 36 GLU H 54 VAL QG2 4.90 
 &rst
  ixpk= 0, nxpk= 0, iat= 546,  -1, r1= 1.30, r2= 1.80, r3= 5.88, r4= 6.38,
 igr2= 857, 858, 859,
 &end
#
# 34 ILE HG12 36 GLU H 5.50 
 &rst
  ixpk= 0, nxpk= 0, iat= 521, 546, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
# 66 ALA H 67 ARG H 3.06 
 &rst
  ixpk= 0, nxpk= 0, iat=1013,1023, r1= 1.30, r2= 1.80, r3= 3.06, r4= 3.56,  &end
#
# 66 ALA H 67 ARG HA 5.50 
 &rst
  ixpk= 0, nxpk= 0, iat=1013,1025, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
# 63 LYS HA 66 ALA H 4.12 
 &rst
  ixpk= 0, nxpk= 0, iat= 971,1013, r1= 1.30, r2= 1.80, r3= 4.12, r4= 4.62,  &end
#
# 64 ASP HB3 66 ALA H 5.24 
 &rst
  ixpk= 0, nxpk= 0, iat= 996,1013, r1= 1.30, r2= 1.80, r3= 5.24, r4= 5.74,  &end
#
# 10 LEU QD1 66 ALA H 3.98 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1013, r1= 1.30, r2= 1.80, r3= 4.78, r4= 5.28,
 igr1= 150, 151, 152,
 &end
#
# 21 GLU H 24 LEU H 4.81 
 &rst
  ixpk= 0, nxpk= 0, iat= 303, 350, r1= 1.30, r2= 1.80, r3= 4.81, r4= 5.31,  &end
#
# 20 ASN HD21 21 GLU H 5.32 
 &rst
  ixpk= 0, nxpk= 0, iat= 299, 303, r1= 1.30, r2= 1.80, r3= 5.32, r4= 5.82,  &end
#
# 21 GLU H 22 LYS HA 5.50 
 &rst
  ixpk= 0, nxpk= 0, iat= 303, 320, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
# 20 ASN HB3 21 GLU H 3.30 
 &rst
  ixpk= 0, nxpk= 0, iat= 294, 303, r1= 1.30, r2= 1.80, r3= 3.30, r4= 3.80,  &end
#
# 21 GLU H 21 GLU HB3 3.52 
 &rst
  ixpk= 0, nxpk= 0, iat= 303, 308, r1= 1.30, r2= 1.80, r3= 3.52, r4= 4.02,  &end
#
# 16 ASN HB2 18 GLU H 5.04 
 &rst
  ixpk= 0, nxpk= 0, iat= 236, 260, r1= 1.30, r2= 1.80, r3= 5.04, r4= 5.54,  &end
#
# 18 GLU H 19 THR QG2 5.50 
 &rst
  ixpk= 0, nxpk= 0, iat= 260,  -1, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr2= 281, 282, 283,
 &end
#
# 16 ASN H 18 GLU H 5.50 
 &rst
  ixpk= 0, nxpk= 0, iat= 232, 260, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
# 17 THR H 18 GLU H 3.82 
 &rst
  ixpk= 0, nxpk= 0, iat= 246, 260, r1= 1.30, r2= 1.80, r3= 3.82, r4= 4.32,  &end
#
# 16 ASN HD22 18 GLU H 5.32 
 &rst
  ixpk= 0, nxpk= 0, iat= 241, 260, r1= 1.30, r2= 1.80, r3= 5.32, r4= 5.82,  &end
#
# 16 ASN HD21 18 GLU H 5.00 
 &rst
  ixpk= 0, nxpk= 0, iat= 242, 260, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50,  &end
#
# 16 ASN HA 18 GLU H 4.59 
 &rst
  ixpk= 0, nxpk= 0, iat= 234, 260, r1= 1.30, r2= 1.80, r3= 4.59, r4= 5.09,  &end
#
# 17 THR HB 18 GLU H 4.49 
 &rst
  ixpk= 0, nxpk= 0, iat= 250, 260, r1= 1.30, r2= 1.80, r3= 4.49, r4= 4.99,  &end
#
# 18 GLU H 19 THR HA 5.02 
 &rst
  ixpk= 0, nxpk= 0, iat= 260, 277, r1= 1.30, r2= 1.80, r3= 5.02, r4= 5.52,  &end
#
# 18 GLU H 19 THR HB 4.76 
 &rst
  ixpk= 0, nxpk= 0, iat= 260, 279, r1= 1.30, r2= 1.80, r3= 4.76, r4= 5.26,  &end
#
# 16 ASN HB3 18 GLU H 4.43 
 &rst
  ixpk= 0, nxpk= 0, iat= 237, 260, r1= 1.30, r2= 1.80, r3= 4.43, r4= 4.93,  &end
#
# 18 GLU H 18 GLU HG3 3.81 
 &rst
  ixpk= 0, nxpk= 0, iat= 260, 268, r1= 1.30, r2= 1.80, r3= 3.81, r4= 4.31,  &end
#
# 18 GLU H 18 GLU HB2 3.22 
 &rst
  ixpk= 0, nxpk= 0, iat= 260, 264, r1= 1.30, r2= 1.80, r3= 3.22, r4= 3.72,  &end
#
# 17 THR QG2 18 GLU H 4.88 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 260, r1= 1.30, r2= 1.80, r3= 5.86, r4= 6.36,
 igr1= 252, 253, 254,
 &end
#
# 42 ASP H 47 LYS H 4.09 
 &rst
  ixpk= 0, nxpk= 0, iat= 654, 733, r1= 1.30, r2= 1.80, r3= 4.09, r4= 4.59,  &end
#
# 41 LYS HA 47 LYS H 5.28 
 &rst
  ixpk= 0, nxpk= 0, iat= 634, 733, r1= 1.30, r2= 1.80, r3= 5.28, r4= 5.78,  &end
#
# 46 ASN HB3 47 LYS H 4.76 
 &rst
  ixpk= 0, nxpk= 0, iat= 724, 733, r1= 1.30, r2= 1.80, r3= 4.76, r4= 5.26,  &end
#
# 42 ASP HB3 47 LYS H 3.51 
 &rst
  ixpk= 0, nxpk= 0, iat= 659, 733, r1= 1.30, r2= 1.80, r3= 3.51, r4= 4.01,  &end
#
# 46 ASN HB2 47 LYS H 4.64 
 &rst
  ixpk= 0, nxpk= 0, iat= 723, 733, r1= 1.30, r2= 1.80, r3= 4.64, r4= 5.14,  &end
#
# 42 ASP HB2 47 LYS H 3.88 
 &rst
  ixpk= 0, nxpk= 0, iat= 658, 733, r1= 1.30, r2= 1.80, r3= 3.88, r4= 4.38,  &end
#
# 47 LYS H 47 LYS HB3 3.56 
 &rst
  ixpk= 0, nxpk= 0, iat= 733, 738, r1= 1.30, r2= 1.80, r3= 3.56, r4= 4.06,  &end
#
# 47 LYS H 47 LYS HB2 3.12 
 &rst
  ixpk= 0, nxpk= 0, iat= 733, 737, r1= 1.30, r2= 1.80, r3= 3.12, r4= 3.62,  &end
#
# 47 LYS H 47 LYS HG2 3.52 
 &rst
  ixpk= 0, nxpk= 0, iat= 733, 740, r1= 1.30, r2= 1.80, r3= 3.52, r4= 4.02,  &end
#
# 45 THR QG2 47 LYS H 4.81 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 733, r1= 1.30, r2= 1.80, r3= 5.78, r4= 6.28,
 igr1= 711, 712, 713,
 &end
#
# 43 ARG QD 44 GLU H 5.50 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 690, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 676, 677,
 &end
#
# 43 ARG H 44 GLU H 3.70 
 &rst
  ixpk= 0, nxpk= 0, iat= 666, 690, r1= 1.30, r2= 1.80, r3= 3.70, r4= 4.20,  &end
#
# 44 GLU H 45 THR H 3.12 
 &rst
  ixpk= 0, nxpk= 0, iat= 690, 705, r1= 1.30, r2= 1.80, r3= 3.12, r4= 3.62,  &end
#
# 44 GLU H 47 LYS H 5.50 
 &rst
  ixpk= 0, nxpk= 0, iat= 690, 733, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
# 42 ASP HA 44 GLU H 4.01 
 &rst
  ixpk= 0, nxpk= 0, iat= 656, 690, r1= 1.30, r2= 1.80, r3= 4.01, r4= 4.51,  &end
#
# 42 ASP HB3 44 GLU H 4.92 
 &rst
  ixpk= 0, nxpk= 0, iat= 659, 690, r1= 1.30, r2= 1.80, r3= 4.92, r4= 5.42,  &end
#
# 42 ASP HB2 44 GLU H 5.19 
 &rst
  ixpk= 0, nxpk= 0, iat= 658, 690, r1= 1.30, r2= 1.80, r3= 5.19, r4= 5.69,  &end
#
# 44 GLU H 44 GLU QG 4.06 
 &rst
  ixpk= 0, nxpk= 0, iat= 690,  -1, r1= 1.30, r2= 1.80, r3= 4.56, r4= 5.06,
 igr2= 697, 698,
 &end
#
# 44 GLU H 44 GLU QB 3.07 
 &rst
  ixpk= 0, nxpk= 0, iat= 690,  -1, r1= 1.30, r2= 1.80, r3= 3.45, r4= 3.95,
 igr2= 694, 695,
 &end
#
# 43 ARG QG 44 GLU H 4.46 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 690, r1= 1.30, r2= 1.80, r3= 5.01, r4= 5.51,
 igr1= 673, 674,
 &end
#
# 44 GLU H 45 THR QG2 4.59 
 &rst
  ixpk= 0, nxpk= 0, iat= 690,  -1, r1= 1.30, r2= 1.80, r3= 5.51, r4= 6.01,
 igr2= 711, 712, 713,
 &end
#
# 44 GLU H 46 ASN H 4.16 
 &rst
  ixpk= 0, nxpk= 0, iat= 690, 719, r1= 1.30, r2= 1.80, r3= 4.16, r4= 4.66,  &end
#
# 45 THR H 46 ASN H 3.10 
 &rst
  ixpk= 0, nxpk= 0, iat= 705, 719, r1= 1.30, r2= 1.80, r3= 3.10, r4= 3.60,  &end
#
# 46 ASN H 47 LYS H 3.43 
 &rst
  ixpk= 0, nxpk= 0, iat= 719, 733, r1= 1.30, r2= 1.80, r3= 3.43, r4= 3.93,  &end
#
# 42 ASP HA 46 ASN H 4.60 
 &rst
  ixpk= 0, nxpk= 0, iat= 656, 719, r1= 1.30, r2= 1.80, r3= 4.60, r4= 5.10,  &end
#
# 46 ASN H 46 ASN HA 2.89 
 &rst
  ixpk= 0, nxpk= 0, iat= 719, 721, r1= 1.30, r2= 1.80, r3= 2.89, r4= 3.39,  &end
#
# 43 ARG HA 46 ASN H 4.55 
 &rst
  ixpk= 0, nxpk= 0, iat= 668, 719, r1= 1.30, r2= 1.80, r3= 4.55, r4= 5.05,  &end
#
# 46 ASN H 46 ASN HB3 4.07 
 &rst
  ixpk= 0, nxpk= 0, iat= 719, 724, r1= 1.30, r2= 1.80, r3= 4.07, r4= 4.57,  &end
#
# 42 ASP HB3 46 ASN H 4.20 
 &rst
  ixpk= 0, nxpk= 0, iat= 659, 719, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,  &end
#
# 46 ASN H 46 ASN HB2 3.87 
 &rst
  ixpk= 0, nxpk= 0, iat= 719, 723, r1= 1.30, r2= 1.80, r3= 3.87, r4= 4.37,  &end
#
# 42 ASP HB2 46 ASN H 4.65 
 &rst
  ixpk= 0, nxpk= 0, iat= 658, 719, r1= 1.30, r2= 1.80, r3= 4.65, r4= 5.15,  &end
#
# 44 GLU QB 46 ASN H 4.68 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 719, r1= 1.30, r2= 1.80, r3= 5.25, r4= 5.75,
 igr1= 694, 695,
 &end
#
# 46 ASN H 47 LYS HB2 5.09 
 &rst
  ixpk= 0, nxpk= 0, iat= 719, 737, r1= 1.30, r2= 1.80, r3= 5.09, r4= 5.59,  &end
#
# 46 ASN H 47 LYS HG2 5.50 
 &rst
  ixpk= 0, nxpk= 0, iat= 719, 740, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
# 45 THR QG2 46 ASN H 4.59 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 719, r1= 1.30, r2= 1.80, r3= 5.51, r4= 6.01,
 igr1= 711, 712, 713,
 &end
#
# 56 PHE QR 63 LYS H 5.44 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 969, r1= 1.30, r2= 1.80, r3= 6.85, r4= 7.35,
 igr1= 885, 893, 887, 891,
 &end
#
# 61 ASP HA 63 LYS H 4.78 
 &rst
  ixpk= 0, nxpk= 0, iat= 949, 969, r1= 1.30, r2= 1.80, r3= 4.78, r4= 5.28,  &end
#
# 63 LYS H 64 ASP HB3 5.24 
 &rst
  ixpk= 0, nxpk= 0, iat= 969, 996, r1= 1.30, r2= 1.80, r3= 5.24, r4= 5.74,  &end
#
# 60 ALA QB 63 LYS H 4.54 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 969, r1= 1.30, r2= 1.80, r3= 5.45, r4= 5.95,
 igr1= 941, 942, 943,
 &end
#
# 63 LYS H 65 ALA QB 5.50 
 &rst
  ixpk= 0, nxpk= 0, iat= 969,  -1, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr2=1007,1008,1009,
 &end
#
# 29 GLY H 30 LYS H 3.52 
 &rst
  ixpk= 0, nxpk= 0, iat= 430, 437, r1= 1.30, r2= 1.80, r3= 3.52, r4= 4.02,  &end
#
# 30 LYS H 31 TYR H 3.37 
 &rst
  ixpk= 0, nxpk= 0, iat= 437, 459, r1= 1.30, r2= 1.80, r3= 3.37, r4= 3.87,  &end
#
# 30 LYS H 31 TYR QE 5.50 
 &rst
  ixpk= 0, nxpk= 0, iat= 437,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2= 469, 474,
 &end
#
# 30 LYS H 31 TYR HA 5.13 
 &rst
  ixpk= 0, nxpk= 0, iat= 437, 461, r1= 1.30, r2= 1.80, r3= 5.13, r4= 5.63,  &end
#
# 27 VAL HA 30 LYS H 5.07 
 &rst
  ixpk= 0, nxpk= 0, iat= 396, 437, r1= 1.30, r2= 1.80, r3= 5.07, r4= 5.57,  &end
#
# 30 LYS H 31 TYR HB3 6.00 
 &rst
  ixpk= 0, nxpk= 0, iat= 437, 464, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,  &end
#
# 30 LYS H 30 LYS QE 5.50 
 &rst
  ixpk= 0, nxpk= 0, iat= 437,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2= 450, 451,
 &end
#
# 30 LYS H 30 LYS HB2 3.43 
 &rst
  ixpk= 0, nxpk= 0, iat= 437, 441, r1= 1.30, r2= 1.80, r3= 3.43, r4= 3.93,  &end
#
# 30 LYS H 30 LYS HG3 3.98 
 &rst
  ixpk= 0, nxpk= 0, iat= 437, 445, r1= 1.30, r2= 1.80, r3= 3.98, r4= 4.48,  &end
#
# 30 LYS H 30 LYS HG2 4.20 
 &rst
  ixpk= 0, nxpk= 0, iat= 437, 444, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,  &end
#
# 88 SER H 89 PHE H 5.38 
 &rst
  ixpk= 0, nxpk= 0, iat=1349,1360, r1= 1.30, r2= 1.80, r3= 5.38, r4= 5.88,  &end
#
# 63 LYS H 64 ASP H 3.20 
 &rst
  ixpk= 0, nxpk= 0, iat= 969, 991, r1= 1.30, r2= 1.80, r3= 3.20, r4= 3.70,  &end
#
# 61 ASP H 63 LYS H 4.41 
 &rst
  ixpk= 0, nxpk= 0, iat= 947, 969, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,  &end
#
# 62 ALA H 63 LYS H 3.42 
 &rst
  ixpk= 0, nxpk= 0, iat= 959, 969, r1= 1.30, r2= 1.80, r3= 3.42, r4= 3.92,  &end
#
# 60 ALA HA 63 LYS H 3.83 
 &rst
  ixpk= 0, nxpk= 0, iat= 939, 969, r1= 1.30, r2= 1.80, r3= 3.83, r4= 4.33,  &end
#
# 63 LYS H 63 LYS QB 2.94 
 &rst
  ixpk= 0, nxpk= 0, iat= 969,  -1, r1= 1.30, r2= 1.80, r3= 3.30, r4= 3.80,
 igr2= 973, 974,
 &end
#
# 63 LYS H 63 LYS HG3 3.92 
 &rst
  ixpk= 0, nxpk= 0, iat= 969, 977, r1= 1.30, r2= 1.80, r3= 3.92, r4= 4.42,  &end
#
# 10 LEU QD1 63 LYS H 5.50 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 969, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr1= 150, 151, 152,
 &end
#
# 10 LEU QD2 63 LYS H 5.50 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 969, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr1= 154, 155, 156,
 &end
#
# 71 GLY H 81 VAL H 4.45 
 &rst
  ixpk= 0, nxpk= 0, iat=1090,1241, r1= 1.30, r2= 1.80, r3= 4.45, r4= 4.95,  &end
#
# 71 GLY H 79 ILE H 5.14 
 &rst
  ixpk= 0, nxpk= 0, iat=1090,1200, r1= 1.30, r2= 1.80, r3= 5.14, r4= 5.64,  &end
#
# 70 ASN HB3 71 GLY H 4.67 
 &rst
  ixpk= 0, nxpk= 0, iat=1081,1090, r1= 1.30, r2= 1.80, r3= 4.67, r4= 5.17,  &end
#
# 71 GLY H 81 VAL HB 5.42 
 &rst
  ixpk= 0, nxpk= 0, iat=1090,1245, r1= 1.30, r2= 1.80, r3= 5.42, r4= 5.92,  &end
#
# 71 GLY H 79 ILE QG1 4.74 
 &rst
  ixpk= 0, nxpk= 0, iat=1090,  -1, r1= 1.30, r2= 1.80, r3= 5.32, r4= 5.82,
 igr2=1210,1211,
 &end
#
# 71 GLY H 78 ALA QB 5.50 
 &rst
  ixpk= 0, nxpk= 0, iat=1090,  -1, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr2=1194,1195,1196,
 &end
#
# 71 GLY H 79 ILE QD1 5.50 
 &rst
  ixpk= 0, nxpk= 0, iat=1090,  -1, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr2=1213,1214,1215,
 &end
#
# 33 ARG H 58 SER H 5.50 
 &rst
  ixpk= 0, nxpk= 0, iat= 487, 912, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
# 33 ARG H 56 PHE QR 4.89 
 &rst
  ixpk= 0, nxpk= 0, iat= 487,  -1, r1= 1.30, r2= 1.80, r3= 6.16, r4= 6.66,
 igr2= 885, 893, 887, 891,
 &end
#
# 32 GLY HA3 33 ARG H 3.26 
 &rst
  ixpk= 0, nxpk= 0, iat= 483, 487, r1= 1.30, r2= 1.80, r3= 3.26, r4= 3.76,  &end
#
# 32 GLY HA2 33 ARG H 3.20 
 &rst
  ixpk= 0, nxpk= 0, iat= 482, 487, r1= 1.30, r2= 1.80, r3= 3.20, r4= 3.70,  &end
#
# 33 ARG H 61 ASP HB3 5.40 
 &rst
  ixpk= 0, nxpk= 0, iat= 487, 952, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,  &end
#
# 33 ARG H 61 ASP HB2 5.27 
 &rst
  ixpk= 0, nxpk= 0, iat= 487, 951, r1= 1.30, r2= 1.80, r3= 5.27, r4= 5.77,  &end
#
# 33 ARG H 57 GLU HB3 4.88 
 &rst
  ixpk= 0, nxpk= 0, iat= 487, 902, r1= 1.30, r2= 1.80, r3= 4.88, r4= 5.38,  &end
#
# 33 ARG H 33 ARG QB 2.97 
 &rst
  ixpk= 0, nxpk= 0, iat= 487,  -1, r1= 1.30, r2= 1.80, r3= 3.33, r4= 3.83,
 igr2= 491, 492,
 &end
#
# 33 ARG H 33 ARG HG3 3.95 
 &rst
  ixpk= 0, nxpk= 0, iat= 487, 495, r1= 1.30, r2= 1.80, r3= 3.95, r4= 4.45,  &end
#
# 33 ARG H 33 ARG HG2 4.51 
 &rst
  ixpk= 0, nxpk= 0, iat= 487, 494, r1= 1.30, r2= 1.80, r3= 4.51, r4= 5.01,  &end
#
# 90 GLU QG 91 SER H 5.50 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1395, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=1387,1388,
 &end
#
# 90 GLU HB3 91 SER H 5.33 
 &rst
  ixpk= 0, nxpk= 0, iat=1385,1395, r1= 1.30, r2= 1.80, r3= 5.33, r4= 5.83,  &end
#
# 90 GLU HB2 91 SER H 5.23 
 &rst
  ixpk= 0, nxpk= 0, iat=1384,1395, r1= 1.30, r2= 1.80, r3= 5.23, r4= 5.73,  &end
#
# 94 ARG H 95 GLY H 5.48 
 &rst
  ixpk= 0, nxpk= 0, iat=1437,1461, r1= 1.30, r2= 1.80, r3= 5.48, r4= 5.98,  &end
#
# 64 ASP H 67 ARG H 5.14 
 &rst
  ixpk= 0, nxpk= 0, iat= 991,1023, r1= 1.30, r2= 1.80, r3= 5.14, r4= 5.64,  &end
#
# 31 TYR QE 68 ASP H 5.23 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1047, r1= 1.30, r2= 1.80, r3= 5.87, r4= 6.37,
 igr1= 469, 474,
 &end
#
# 68 ASP H 68 ASP HB3 3.10 
 &rst
  ixpk= 0, nxpk= 0, iat=1047,1052, r1= 1.30, r2= 1.80, r3= 3.10, r4= 3.60,  &end
#
# 68 ASP H 69 MET QG 5.13 
 &rst
  ixpk= 0, nxpk= 0, iat=1047,  -1, r1= 1.30, r2= 1.80, r3= 5.76, r4= 6.26,
 igr2=1066,1067,
 &end
#
# 65 ALA HA 68 ASP H 4.20 
 &rst
  ixpk= 0, nxpk= 0, iat=1005,1047, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,  &end
#
# 68 ASP H 69 MET HB3 4.73 
 &rst
  ixpk= 0, nxpk= 0, iat=1047,1064, r1= 1.30, r2= 1.80, r3= 4.73, r4= 5.23,  &end
#
# 67 ARG H 67 ARG QB 2.69 
 &rst
  ixpk= 0, nxpk= 0, iat=1023,  -1, r1= 1.30, r2= 1.80, r3= 3.02, r4= 3.52,
 igr2=1027,1028,
 &end
#
# 67 ARG H 67 ARG HG3 3.80 
 &rst
  ixpk= 0, nxpk= 0, iat=1023,1031, r1= 1.30, r2= 1.80, r3= 3.80, r4= 4.30,  &end
#
# 67 ARG H 67 ARG HG2 4.62 
 &rst
  ixpk= 0, nxpk= 0, iat=1023,1030, r1= 1.30, r2= 1.80, r3= 4.62, r4= 5.12,  &end
#
# 65 ALA QB 67 ARG H 4.79 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1023, r1= 1.30, r2= 1.80, r3= 5.75, r4= 6.25,
 igr1=1007,1008,1009,
 &end
#
# 10 LEU QD2 67 ARG H 5.50 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1023, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr1= 154, 155, 156,
 &end
#
# 68 ASP H 69 MET HA 5.50 
 &rst
  ixpk= 0, nxpk= 0, iat=1047,1061, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
# 70 ASN H 71 GLY H 4.69 
 &rst
  ixpk= 0, nxpk= 0, iat=1076,1090, r1= 1.30, r2= 1.80, r3= 4.69, r4= 5.19,  &end
#
# 70 ASN H 70 ASN HD21 5.10 
 &rst
  ixpk= 0, nxpk= 0, iat=1076,1086, r1= 1.30, r2= 1.80, r3= 5.10, r4= 5.60,  &end
#
# 68 ASP HA 70 ASN H 5.50 
 &rst
  ixpk= 0, nxpk= 0, iat=1049,1076, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
# 67 ARG HA 70 ASN H 5.14 
 &rst
  ixpk= 0, nxpk= 0, iat=1025,1076, r1= 1.30, r2= 1.80, r3= 5.14, r4= 5.64,  &end
#
# 66 ALA HA 70 ASN H 4.41 
 &rst
  ixpk= 0, nxpk= 0, iat=1015,1076, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,  &end
#
# 68 ASP HB3 70 ASN H 5.50 
 &rst
  ixpk= 0, nxpk= 0, iat=1052,1076, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
# 68 ASP HB2 70 ASN H 5.50 
 &rst
  ixpk= 0, nxpk= 0, iat=1051,1076, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
# 69 MET QG 70 ASN H 5.50 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1076, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=1066,1067,
 &end
#
# 69 MET HB3 70 ASN H 4.44 
 &rst
  ixpk= 0, nxpk= 0, iat=1064,1076, r1= 1.30, r2= 1.80, r3= 4.44, r4= 4.94,  &end
#
# 70 ASN H 81 VAL HB 3.87 
 &rst
  ixpk= 0, nxpk= 0, iat=1076,1245, r1= 1.30, r2= 1.80, r3= 3.87, r4= 4.37,  &end
#
# 69 MET QE 70 ASN H 5.50 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1076, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr1=1070,1071,1072,
 &end
#
# 66 ALA QB 70 ASN H 5.40 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1076, r1= 1.30, r2= 1.80, r3= 6.49, r4= 6.99,
 igr1=1017,1018,1019,
 &end
#
# 70 ASN H 81 VAL QG2 4.69 
 &rst
  ixpk= 0, nxpk= 0, iat=1076,  -1, r1= 1.30, r2= 1.80, r3= 5.63, r4= 6.13,
 igr2=1251,1252,1253,
 &end
#
# 70 ASN H 81 VAL QG1 4.85 
 &rst
  ixpk= 0, nxpk= 0, iat=1076,  -1, r1= 1.30, r2= 1.80, r3= 5.82, r4= 6.32,
 igr2=1247,1248,1249,
 &end
#
# 70 ASN H 79 ILE QD1 5.50 
 &rst
  ixpk= 0, nxpk= 0, iat=1076,  -1, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr2=1213,1214,1215,
 &end
#
# 39 LEU QD1 48 SER H 5.50 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 755, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr1= 605, 606, 607,
 &end
#
# 48 SER H 49 ARG H 4.86 
 &rst
  ixpk= 0, nxpk= 0, iat= 755, 766, r1= 1.30, r2= 1.80, r3= 4.86, r4= 5.36,  &end
#
# 47 LYS H 48 SER H 4.96 
 &rst
  ixpk= 0, nxpk= 0, iat= 733, 755, r1= 1.30, r2= 1.80, r3= 4.96, r4= 5.46,  &end
#
# 41 LYS HA 48 SER H 5.49 
 &rst
  ixpk= 0, nxpk= 0, iat= 634, 755, r1= 1.30, r2= 1.80, r3= 5.49, r4= 5.99,  &end
#
# 47 LYS HA 48 SER H 3.15 
 &rst
  ixpk= 0, nxpk= 0, iat= 735, 755, r1= 1.30, r2= 1.80, r3= 3.15, r4= 3.65,  &end
#
# 48 SER H 48 SER HB3 3.56 
 &rst
  ixpk= 0, nxpk= 0, iat= 755, 760, r1= 1.30, r2= 1.80, r3= 3.56, r4= 4.06,  &end
#
# 48 SER H 48 SER HB2 3.55 
 &rst
  ixpk= 0, nxpk= 0, iat= 755, 759, r1= 1.30, r2= 1.80, r3= 3.55, r4= 4.05,  &end
#
# 17 THR HA 48 SER H 5.11 
 &rst
  ixpk= 0, nxpk= 0, iat= 248, 755, r1= 1.30, r2= 1.80, r3= 5.11, r4= 5.61,  &end
#
# 47 LYS HB3 48 SER H 4.01 
 &rst
  ixpk= 0, nxpk= 0, iat= 738, 755, r1= 1.30, r2= 1.80, r3= 4.01, r4= 4.51,  &end
#
# 47 LYS QD 48 SER H 4.29 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 755, r1= 1.30, r2= 1.80, r3= 4.82, r4= 5.32,
 igr1= 743, 744,
 &end
#
# 41 LYS HD3 48 SER H 5.50 
 &rst
  ixpk= 0, nxpk= 0, iat= 643, 755, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
# 47 LYS HG2 48 SER H 4.44 
 &rst
  ixpk= 0, nxpk= 0, iat= 740, 755, r1= 1.30, r2= 1.80, r3= 4.44, r4= 4.94,  &end
#
# 41 LYS HG2 48 SER H 5.37 
 &rst
  ixpk= 0, nxpk= 0, iat= 639, 755, r1= 1.30, r2= 1.80, r3= 5.37, r4= 5.87,  &end
#
# 24 LEU H 25 GLU H 3.36 
 &rst
  ixpk= 0, nxpk= 0, iat= 350, 369, r1= 1.30, r2= 1.80, r3= 3.36, r4= 3.86,  &end
#
# 23 ALA H 24 LEU H 3.23 
 &rst
  ixpk= 0, nxpk= 0, iat= 340, 350, r1= 1.30, r2= 1.80, r3= 3.23, r4= 3.73,  &end
#
# 20 ASN HA 24 LEU H 5.50 
 &rst
  ixpk= 0, nxpk= 0, iat= 291, 350, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
# 24 LEU H 25 GLU HG3 5.50 
 &rst
  ixpk= 0, nxpk= 0, iat= 350, 377, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
# 24 LEU H 25 GLU QB 4.24 
 &rst
  ixpk= 0, nxpk= 0, iat= 350,  -1, r1= 1.30, r2= 1.80, r3= 4.76, r4= 5.26,
 igr2= 373, 374,
 &end
#
# 24 LEU H 24 LEU HB3 3.24 
 &rst
  ixpk= 0, nxpk= 0, iat= 350, 355, r1= 1.30, r2= 1.80, r3= 3.24, r4= 3.74,  &end
#
# 24 LEU H 24 LEU HG 3.29 
 &rst
  ixpk= 0, nxpk= 0, iat= 350, 357, r1= 1.30, r2= 1.80, r3= 3.29, r4= 3.79,  &end
#
# 24 LEU H 24 LEU HB2 3.59 
 &rst
  ixpk= 0, nxpk= 0, iat= 350, 354, r1= 1.30, r2= 1.80, r3= 3.59, r4= 4.09,  &end
#
# 24 LEU H 24 LEU QD2 4.24 
 &rst
  ixpk= 0, nxpk= 0, iat= 350,  -1, r1= 1.30, r2= 1.80, r3= 5.09, r4= 5.59,
 igr2= 363, 364, 365,
 &end
#
# 27 VAL H 28 PHE H 3.33 
 &rst
  ixpk= 0, nxpk= 0, iat= 394, 410, r1= 1.30, r2= 1.80, r3= 3.33, r4= 3.83,  &end
#
# 27 VAL H 29 GLY H 4.50 
 &rst
  ixpk= 0, nxpk= 0, iat= 394, 430, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
# 26 ALA H 27 VAL H 3.36 
 &rst
  ixpk= 0, nxpk= 0, iat= 384, 394, r1= 1.30, r2= 1.80, r3= 3.36, r4= 3.86,  &end
#
# 27 VAL H 28 PHE QD 4.94 
 &rst
  ixpk= 0, nxpk= 0, iat= 394,  -1, r1= 1.30, r2= 1.80, r3= 5.54, r4= 6.04,
 igr2= 418, 426,
 &end
#
# 27 VAL H 30 LYS H 5.20 
 &rst
  ixpk= 0, nxpk= 0, iat= 394, 437, r1= 1.30, r2= 1.80, r3= 5.20, r4= 5.70,  &end
#
# 23 ALA HA 27 VAL H 4.76 
 &rst
  ixpk= 0, nxpk= 0, iat= 342, 394, r1= 1.30, r2= 1.80, r3= 4.76, r4= 5.26,  &end
#
# 27 VAL H 28 PHE HB2 5.15 
 &rst
  ixpk= 0, nxpk= 0, iat= 394, 414, r1= 1.30, r2= 1.80, r3= 5.15, r4= 5.65,  &end
#
# 25 GLU QB 27 VAL H 5.50 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 394, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 373, 374,
 &end
#
# 27 VAL H 74 LEU QD2 5.50 
 &rst
  ixpk= 0, nxpk= 0, iat= 394,  -1, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr2=1143,1144,1145,
 &end
#
# 27 VAL H 74 LEU QD1 5.50 
 &rst
  ixpk= 0, nxpk= 0, iat= 394,  -1, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr2=1139,1140,1141,
 &end
#
# 27 VAL H 34 ILE QD1 5.50 
 &rst
  ixpk= 0, nxpk= 0, iat= 394,  -1, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr2= 524, 525, 526,
 &end
#
# 27 VAL H 28 PHE HA 5.50 
 &rst
  ixpk= 0, nxpk= 0, iat= 394, 412, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
# 31 TYR H 32 GLY HA3 5.50 
 &rst
  ixpk= 0, nxpk= 0, iat= 459, 483, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
# 28 PHE HA 31 TYR H 4.80 
 &rst
  ixpk= 0, nxpk= 0, iat= 412, 459, r1= 1.30, r2= 1.80, r3= 4.80, r4= 5.30,  &end
#
# 31 TYR H 32 GLY HA2 5.06 
 &rst
  ixpk= 0, nxpk= 0, iat= 459, 482, r1= 1.30, r2= 1.80, r3= 5.06, r4= 5.56,  &end
#
# 31 TYR H 31 TYR HB3 3.69 
 &rst
  ixpk= 0, nxpk= 0, iat= 459, 464, r1= 1.30, r2= 1.80, r3= 3.69, r4= 4.19,  &end
#
# 30 LYS HB3 31 TYR H 4.18 
 &rst
  ixpk= 0, nxpk= 0, iat= 442, 459, r1= 1.30, r2= 1.80, r3= 4.18, r4= 4.68,  &end
#
# 30 LYS HB2 31 TYR H 4.25 
 &rst
  ixpk= 0, nxpk= 0, iat= 441, 459, r1= 1.30, r2= 1.80, r3= 4.25, r4= 4.75,  &end
#
# 31 TYR H 65 ALA QB 4.79 
 &rst
  ixpk= 0, nxpk= 0, iat= 459,  -1, r1= 1.30, r2= 1.80, r3= 5.75, r4= 6.25,
 igr2=1007,1008,1009,
 &end
#
# 30 LYS HG2 31 TYR H 4.89 
 &rst
  ixpk= 0, nxpk= 0, iat= 444, 459, r1= 1.30, r2= 1.80, r3= 4.89, r4= 5.39,  &end
#
# 31 TYR H 34 ILE QD1 5.50 
 &rst
  ixpk= 0, nxpk= 0, iat= 459,  -1, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr2= 524, 525, 526,
 &end
#
# 4 ALA HA 83 GLN HE22 5.50 
 &rst
  ixpk= 0, nxpk= 0, iat=  54,1284, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
# 83 GLN HE22 84 ALA H 5.28 
 &rst
  ixpk= 0, nxpk= 0, iat=1284,1289, r1= 1.30, r2= 1.80, r3= 5.28, r4= 5.78,  &end
#
# 5 ASP HA 83 GLN HE22 5.50 
 &rst
  ixpk= 0, nxpk= 0, iat=  64,1284, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
# 83 GLN HB2 83 GLN HE22 5.26 
 &rst
  ixpk= 0, nxpk= 0, iat=1276,1284, r1= 1.30, r2= 1.80, r3= 5.26, r4= 5.76,  &end
#
# 31 TYR H 31 TYR QE 5.05 
 &rst
  ixpk= 0, nxpk= 0, iat= 459,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr2= 469, 474,
 &end
#
# 29 GLY HA3 31 TYR H 4.77 
 &rst
  ixpk= 0, nxpk= 0, iat= 433, 459, r1= 1.30, r2= 1.80, r3= 4.77, r4= 5.27,  &end
#
# 83 GLN HE21 84 ALA H 5.50 
 &rst
  ixpk= 0, nxpk= 0, iat=1285,1289, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
# 7 PRO HA 83 GLN HE21 5.47 
 &rst
  ixpk= 0, nxpk= 0, iat= 108,1285, r1= 1.30, r2= 1.80, r3= 5.47, r4= 5.97,  &end
#
# 83 GLN HB2 83 GLN HE21 5.50 
 &rst
  ixpk= 0, nxpk= 0, iat=1276,1285, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
# 28 PHE H 29 GLY H 3.41 
 &rst
  ixpk= 0, nxpk= 0, iat= 410, 430, r1= 1.30, r2= 1.80, r3= 3.41, r4= 3.91,  &end
#
# 26 ALA H 28 PHE H 4.74 
 &rst
  ixpk= 0, nxpk= 0, iat= 384, 410, r1= 1.30, r2= 1.80, r3= 4.74, r4= 5.24,  &end
#
# 28 PHE H 31 TYR QD 4.92 
 &rst
  ixpk= 0, nxpk= 0, iat= 410,  -1, r1= 1.30, r2= 1.80, r3= 5.52, r4= 6.02,
 igr2= 467, 476,
 &end
#
# 28 PHE H 30 LYS H 4.62 
 &rst
  ixpk= 0, nxpk= 0, iat= 410, 437, r1= 1.30, r2= 1.80, r3= 4.62, r4= 5.12,  &end
#
# 28 PHE H 31 TYR QE 5.50 
 &rst
  ixpk= 0, nxpk= 0, iat= 410,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2= 469, 474,
 &end
#
# 28 PHE H 29 GLY HA3 5.16 
 &rst
  ixpk= 0, nxpk= 0, iat= 410, 433, r1= 1.30, r2= 1.80, r3= 5.16, r4= 5.66,  &end
#
# 24 LEU HA 28 PHE H 4.31 
 &rst
  ixpk= 0, nxpk= 0, iat= 352, 410, r1= 1.30, r2= 1.80, r3= 4.31, r4= 4.81,  &end
#
# 25 GLU HA 28 PHE H 4.49 
 &rst
  ixpk= 0, nxpk= 0, iat= 371, 410, r1= 1.30, r2= 1.80, r3= 4.49, r4= 4.99,  &end
#
# 28 PHE H 28 PHE HB3 3.65 
 &rst
  ixpk= 0, nxpk= 0, iat= 410, 415, r1= 1.30, r2= 1.80, r3= 3.65, r4= 4.15,  &end
#
# 28 PHE H 28 PHE HB2 3.33 
 &rst
  ixpk= 0, nxpk= 0, iat= 410, 414, r1= 1.30, r2= 1.80, r3= 3.33, r4= 3.83,  &end
#
# 27 VAL HB 28 PHE H 3.53 
 &rst
  ixpk= 0, nxpk= 0, iat= 398, 410, r1= 1.30, r2= 1.80, r3= 3.53, r4= 4.03,  &end
#
# 26 ALA QB 28 PHE H 5.01 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 410, r1= 1.30, r2= 1.80, r3= 6.02, r4= 6.52,
 igr1= 388, 389, 390,
 &end
#
# 28 PHE H 34 ILE QD1 4.57 
 &rst
  ixpk= 0, nxpk= 0, iat= 410,  -1, r1= 1.30, r2= 1.80, r3= 5.49, r4= 5.99,
 igr2= 524, 525, 526,
 &end
#
# 15 LEU H 16 ASN H 4.63 
 &rst
  ixpk= 0, nxpk= 0, iat= 213, 232, r1= 1.30, r2= 1.80, r3= 4.63, r4= 5.13,  &end
#
# 15 LEU H 51 PHE HA 4.68 
 &rst
  ixpk= 0, nxpk= 0, iat= 213, 799, r1= 1.30, r2= 1.80, r3= 4.68, r4= 5.18,  &end
#
# 15 LEU H 79 ILE HA 5.50 
 &rst
  ixpk= 0, nxpk= 0, iat= 213,1202, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
# 13 GLY HA2 15 LEU H 4.97 
 &rst
  ixpk= 0, nxpk= 0, iat= 201, 213, r1= 1.30, r2= 1.80, r3= 4.97, r4= 5.47,  &end
#
# 15 LEU H 50 GLY HA2 4.49 
 &rst
  ixpk= 0, nxpk= 0, iat= 213, 792, r1= 1.30, r2= 1.80, r3= 4.49, r4= 4.99,  &end
#
# 15 LEU H 15 LEU HB3 3.64 
 &rst
  ixpk= 0, nxpk= 0, iat= 213, 218, r1= 1.30, r2= 1.80, r3= 3.64, r4= 4.14,  &end
#
# 15 LEU H 15 LEU HG 3.41 
 &rst
  ixpk= 0, nxpk= 0, iat= 213, 220, r1= 1.30, r2= 1.80, r3= 3.41, r4= 3.91,  &end
#
# 15 LEU H 15 LEU HB2 3.42 
 &rst
  ixpk= 0, nxpk= 0, iat= 213, 217, r1= 1.30, r2= 1.80, r3= 3.42, r4= 3.92,  &end
#
# 15 LEU H 79 ILE QG2 4.78 
 &rst
  ixpk= 0, nxpk= 0, iat= 213,  -1, r1= 1.30, r2= 1.80, r3= 5.74, r4= 6.24,
 igr2=1206,1207,1208,
 &end
#
# 15 LEU H 15 LEU QD2 4.08 
 &rst
  ixpk= 0, nxpk= 0, iat= 213,  -1, r1= 1.30, r2= 1.80, r3= 4.90, r4= 5.40,
 igr2= 226, 227, 228,
 &end
#
# 12 ILE QG2 15 LEU H 4.81 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 213, r1= 1.30, r2= 1.80, r3= 5.78, r4= 6.28,
 igr1= 186, 187, 188,
 &end
#
# 15 LEU H 15 LEU QD1 4.13 
 &rst
  ixpk= 0, nxpk= 0, iat= 213,  -1, r1= 1.30, r2= 1.80, r3= 4.96, r4= 5.46,
 igr2= 222, 223, 224,
 &end
#
# 70 ASN HD22 81 VAL H 5.50 
 &rst
  ixpk= 0, nxpk= 0, iat=1085,1241, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
# 70 ASN HA 70 ASN HD22 5.47 
 &rst
  ixpk= 0, nxpk= 0, iat=1078,1085, r1= 1.30, r2= 1.80, r3= 5.47, r4= 5.97,  &end
#
# 70 ASN HB2 70 ASN HD22 3.77 
 &rst
  ixpk= 0, nxpk= 0, iat=1080,1085, r1= 1.30, r2= 1.80, r3= 3.77, r4= 4.27,  &end
#
# 70 ASN HD22 81 VAL HB 5.50 
 &rst
  ixpk= 0, nxpk= 0, iat=1085,1245, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
# 70 ASN HD21 81 VAL H 5.50 
 &rst
  ixpk= 0, nxpk= 0, iat=1086,1241, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
# 70 ASN HA 70 ASN HD21 5.50 
 &rst
  ixpk= 0, nxpk= 0, iat=1078,1086, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
# 70 ASN HB2 70 ASN HD21 4.06 
 &rst
  ixpk= 0, nxpk= 0, iat=1080,1086, r1= 1.30, r2= 1.80, r3= 4.06, r4= 4.56,  &end
#
# 70 ASN HD21 81 VAL HB 5.50 
 &rst
  ixpk= 0, nxpk= 0, iat=1086,1245, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
# 38 LEU H 53 PHE H 4.36 
 &rst
  ixpk= 0, nxpk= 0, iat= 577, 827, r1= 1.30, r2= 1.80, r3= 4.36, r4= 4.86,  &end
#
# 40 MET H 53 PHE H 5.30 
 &rst
  ixpk= 0, nxpk= 0, iat= 615, 827, r1= 1.30, r2= 1.80, r3= 5.30, r4= 5.80,  &end
#
# 39 LEU HA 53 PHE H 4.34 
 &rst
  ixpk= 0, nxpk= 0, iat= 598, 827, r1= 1.30, r2= 1.80, r3= 4.34, r4= 4.84,  &end
#
# 53 PHE H 53 PHE HB2 4.09 
 &rst
  ixpk= 0, nxpk= 0, iat= 827, 831, r1= 1.30, r2= 1.80, r3= 4.09, r4= 4.59,  &end
#
# 40 MET HG2 53 PHE H 5.50 
 &rst
  ixpk= 0, nxpk= 0, iat= 622, 827, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
# 38 LEU HB2 53 PHE H 4.59 
 &rst
  ixpk= 0, nxpk= 0, iat= 581, 827, r1= 1.30, r2= 1.80, r3= 4.59, r4= 5.09,  &end
#
# 39 LEU QD2 53 PHE H 5.50 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 827, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr1= 609, 610, 611,
 &end
#
# 53 PHE H 54 VAL QG1 5.50 
 &rst
  ixpk= 0, nxpk= 0, iat= 827,  -1, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr2= 853, 854, 855,
 &end
#
# 16 ASN H 16 ASN HD22 5.50 
 &rst
  ixpk= 0, nxpk= 0, iat= 232, 241, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
# 16 ASN HD22 77 LYS H 5.50 
 &rst
  ixpk= 0, nxpk= 0, iat= 241,1168, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
# 16 ASN HA 16 ASN HD22 5.07 
 &rst
  ixpk= 0, nxpk= 0, iat= 234, 241, r1= 1.30, r2= 1.80, r3= 5.07, r4= 5.57,  &end
#
# 16 ASN HD22 75 ASP HA 5.46 
 &rst
  ixpk= 0, nxpk= 0, iat= 241,1151, r1= 1.30, r2= 1.80, r3= 5.46, r4= 5.96,  &end
#
# 16 ASN HD22 77 LYS QE 5.50 
 &rst
  ixpk= 0, nxpk= 0, iat= 241,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=1181,1182,
 &end
#
# 16 ASN HD22 75 ASP HB3 4.08 
 &rst
  ixpk= 0, nxpk= 0, iat= 241,1154, r1= 1.30, r2= 1.80, r3= 4.08, r4= 4.58,  &end
#
# 16 ASN HB2 16 ASN HD22 3.91 
 &rst
  ixpk= 0, nxpk= 0, iat= 236, 241, r1= 1.30, r2= 1.80, r3= 3.91, r4= 4.41,  &end
#
# 16 ASN HD22 75 ASP HB2 4.48 
 &rst
  ixpk= 0, nxpk= 0, iat= 241,1153, r1= 1.30, r2= 1.80, r3= 4.48, r4= 4.98,  &end
#
# 16 ASN HD22 18 GLU HB2 4.88 
 &rst
  ixpk= 0, nxpk= 0, iat= 241, 264, r1= 1.30, r2= 1.80, r3= 4.88, r4= 5.38,  &end
#
# 16 ASN HD22 77 LYS HG2 4.94 
 &rst
  ixpk= 0, nxpk= 0, iat= 241,1175, r1= 1.30, r2= 1.80, r3= 4.94, r4= 5.44,  &end
#
# 16 ASN HA 16 ASN HD21 5.31 
 &rst
  ixpk= 0, nxpk= 0, iat= 234, 242, r1= 1.30, r2= 1.80, r3= 5.31, r4= 5.81,  &end
#
# 16 ASN HD21 75 ASP HB3 4.35 
 &rst
  ixpk= 0, nxpk= 0, iat= 242,1154, r1= 1.30, r2= 1.80, r3= 4.35, r4= 4.85,  &end
#
# 16 ASN HD21 75 ASP HB2 4.84 
 &rst
  ixpk= 0, nxpk= 0, iat= 242,1153, r1= 1.30, r2= 1.80, r3= 4.84, r4= 5.34,  &end
#
# 16 ASN HD21 18 GLU HB2 4.82 
 &rst
  ixpk= 0, nxpk= 0, iat= 242, 264, r1= 1.30, r2= 1.80, r3= 4.82, r4= 5.32,  &end
#
# 16 ASN HD21 77 LYS HG2 5.18 
 &rst
  ixpk= 0, nxpk= 0, iat= 242,1175, r1= 1.30, r2= 1.80, r3= 5.18, r4= 5.68,  &end
#
# 73 SER H 74 LEU H 4.68 
 &rst
  ixpk= 0, nxpk= 0, iat=1119,1130, r1= 1.30, r2= 1.80, r3= 4.68, r4= 5.18,  &end
#
# 73 SER H 79 ILE H 5.21 
 &rst
  ixpk= 0, nxpk= 0, iat=1119,1200, r1= 1.30, r2= 1.80, r3= 5.21, r4= 5.71,  &end
#
# 72 LYS H 73 SER H 4.51 
 &rst
  ixpk= 0, nxpk= 0, iat=1097,1119, r1= 1.30, r2= 1.80, r3= 4.51, r4= 5.01,  &end
#
# 73 SER H 78 ALA HA 4.53 
 &rst
  ixpk= 0, nxpk= 0, iat=1119,1192, r1= 1.30, r2= 1.80, r3= 4.53, r4= 5.03,  &end
#
# 73 SER H 73 SER QB 3.22 
 &rst
  ixpk= 0, nxpk= 0, iat=1119,  -1, r1= 1.30, r2= 1.80, r3= 3.61, r4= 4.11,
 igr2=1123,1124,
 &end
#
# 72 LYS HB2 73 SER H 3.34 
 &rst
  ixpk= 0, nxpk= 0, iat=1101,1119, r1= 1.30, r2= 1.80, r3= 3.34, r4= 3.84,  &end
#
# 73 SER H 79 ILE QG1 5.50 
 &rst
  ixpk= 0, nxpk= 0, iat=1119,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=1210,1211,
 &end
#
# 72 LYS HG2 73 SER H 4.74 
 &rst
  ixpk= 0, nxpk= 0, iat=1104,1119, r1= 1.30, r2= 1.80, r3= 4.74, r4= 5.24,  &end
#
# 35 VAL QG2 58 SER H 5.50 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 912, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr1= 540, 541, 542,
 &end
#
# 56 PHE QR 58 SER H 5.08 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 912, r1= 1.30, r2= 1.80, r3= 6.40, r4= 6.90,
 igr1= 885, 893, 887, 891,
 &end
#
# 56 PHE HA 58 SER H 4.89 
 &rst
  ixpk= 0, nxpk= 0, iat= 879, 912, r1= 1.30, r2= 1.80, r3= 4.89, r4= 5.39,  &end
#
# 58 SER H 58 SER QB 3.25 
 &rst
  ixpk= 0, nxpk= 0, iat= 912,  -1, r1= 1.30, r2= 1.80, r3= 3.65, r4= 4.15,
 igr2= 916, 917,
 &end
#
# 56 PHE HB3 58 SER H 4.10 
 &rst
  ixpk= 0, nxpk= 0, iat= 882, 912, r1= 1.30, r2= 1.80, r3= 4.10, r4= 4.60,  &end
#
# 58 SER H 61 ASP HB3 4.14 
 &rst
  ixpk= 0, nxpk= 0, iat= 912, 952, r1= 1.30, r2= 1.80, r3= 4.14, r4= 4.64,  &end
#
# 58 SER H 61 ASP HB2 5.33 
 &rst
  ixpk= 0, nxpk= 0, iat= 912, 951, r1= 1.30, r2= 1.80, r3= 5.33, r4= 5.83,  &end
#
# 57 GLU HB3 58 SER H 3.73 
 &rst
  ixpk= 0, nxpk= 0, iat= 902, 912, r1= 1.30, r2= 1.80, r3= 3.73, r4= 4.23,  &end
#
# 57 GLU HB2 58 SER H 4.25 
 &rst
  ixpk= 0, nxpk= 0, iat= 901, 912, r1= 1.30, r2= 1.80, r3= 4.25, r4= 4.75,  &end
#
# 58 SER H 62 ALA QB 5.50 
 &rst
  ixpk= 0, nxpk= 0, iat= 912,  -1, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr2= 963, 964, 965,
 &end
#
# 46 ASN HA 46 ASN HD22 5.50 
 &rst
  ixpk= 0, nxpk= 0, iat= 721, 728, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
# 50 GLY H 51 PHE H 3.44 
 &rst
  ixpk= 0, nxpk= 0, iat= 790, 797, r1= 1.30, r2= 1.80, r3= 3.44, r4= 3.94,  &end
#
# 49 ARG H 51 PHE H 4.34 
 &rst
  ixpk= 0, nxpk= 0, iat= 766, 797, r1= 1.30, r2= 1.80, r3= 4.34, r4= 4.84,  &end
#
# 51 PHE H 52 ALA H 4.71 
 &rst
  ixpk= 0, nxpk= 0, iat= 797, 817, r1= 1.30, r2= 1.80, r3= 4.71, r4= 5.21,  &end
#
# 40 MET H 51 PHE H 5.07 
 &rst
  ixpk= 0, nxpk= 0, iat= 615, 797, r1= 1.30, r2= 1.80, r3= 5.07, r4= 5.57,  &end
#
# 51 PHE H 51 PHE QE 5.38 
 &rst
  ixpk= 0, nxpk= 0, iat= 797,  -1, r1= 1.30, r2= 1.80, r3= 6.04, r4= 6.54,
 igr2= 807, 811,
 &end
#
# 51 PHE H 52 ALA HA 5.50 
 &rst
  ixpk= 0, nxpk= 0, iat= 797, 819, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
# 49 ARG HB3 51 PHE H 4.53 
 &rst
  ixpk= 0, nxpk= 0, iat= 771, 797, r1= 1.30, r2= 1.80, r3= 4.53, r4= 5.03,  &end
#
# 40 MET HB3 51 PHE H 5.10 
 &rst
  ixpk= 0, nxpk= 0, iat= 620, 797, r1= 1.30, r2= 1.80, r3= 5.10, r4= 5.60,  &end
#
# 49 ARG HB2 51 PHE H 4.51 
 &rst
  ixpk= 0, nxpk= 0, iat= 770, 797, r1= 1.30, r2= 1.80, r3= 4.51, r4= 5.01,  &end
#
# 51 PHE H 52 ALA QB 5.31 
 &rst
  ixpk= 0, nxpk= 0, iat= 797,  -1, r1= 1.30, r2= 1.80, r3= 6.38, r4= 6.88,
 igr2= 821, 822, 823,
 &end
#
# 39 LEU QD2 51 PHE H 4.50 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 797, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr1= 609, 610, 611,
 &end
#
# 15 LEU QD1 51 PHE H 4.55 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 797, r1= 1.30, r2= 1.80, r3= 5.46, r4= 5.96,
 igr1= 222, 223, 224,
 &end
#
# 68 ASP H 69 MET H 3.20 
 &rst
  ixpk= 0, nxpk= 0, iat=1047,1059, r1= 1.30, r2= 1.80, r3= 3.20, r4= 3.70,  &end
#
# 69 MET H 70 ASN H 3.38 
 &rst
  ixpk= 0, nxpk= 0, iat=1059,1076, r1= 1.30, r2= 1.80, r3= 3.38, r4= 3.88,  &end
#
# 69 MET H 70 ASN HA 5.50 
 &rst
  ixpk= 0, nxpk= 0, iat=1059,1078, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
# 67 ARG HA 69 MET H 5.24 
 &rst
  ixpk= 0, nxpk= 0, iat=1025,1059, r1= 1.30, r2= 1.80, r3= 5.24, r4= 5.74,  &end
#
# 66 ALA HA 69 MET H 4.33 
 &rst
  ixpk= 0, nxpk= 0, iat=1015,1059, r1= 1.30, r2= 1.80, r3= 4.33, r4= 4.83,  &end
#
# 69 MET H 70 ASN HB3 4.85 
 &rst
  ixpk= 0, nxpk= 0, iat=1059,1081, r1= 1.30, r2= 1.80, r3= 4.85, r4= 5.35,  &end
#
# 69 MET H 70 ASN HB2 5.11 
 &rst
  ixpk= 0, nxpk= 0, iat=1059,1080, r1= 1.30, r2= 1.80, r3= 5.11, r4= 5.61,  &end
#
# 68 ASP HB3 69 MET H 3.95 
 &rst
  ixpk= 0, nxpk= 0, iat=1052,1059, r1= 1.30, r2= 1.80, r3= 3.95, r4= 4.45,  &end
#
# 68 ASP HB2 69 MET H 3.80 
 &rst
  ixpk= 0, nxpk= 0, iat=1051,1059, r1= 1.30, r2= 1.80, r3= 3.80, r4= 4.30,  &end
#
# 69 MET H 69 MET QG 3.91 
 &rst
  ixpk= 0, nxpk= 0, iat=1059,  -1, r1= 1.30, r2= 1.80, r3= 4.39, r4= 4.89,
 igr2=1066,1067,
 &end
#
# 65 ALA HA 69 MET H 4.70 
 &rst
  ixpk= 0, nxpk= 0, iat=1005,1059, r1= 1.30, r2= 1.80, r3= 4.70, r4= 5.20,  &end
#
# 69 MET H 69 MET HB3 3.34 
 &rst
  ixpk= 0, nxpk= 0, iat=1059,1064, r1= 1.30, r2= 1.80, r3= 3.34, r4= 3.84,  &end
#
# 69 MET H 69 MET HB2 3.72 
 &rst
  ixpk= 0, nxpk= 0, iat=1059,1063, r1= 1.30, r2= 1.80, r3= 3.72, r4= 4.22,  &end
#
# 66 ALA QB 69 MET H 5.50 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1059, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr1=1017,1018,1019,
 &end
#
# 69 MET H 81 VAL QG2 4.67 
 &rst
  ixpk= 0, nxpk= 0, iat=1059,  -1, r1= 1.30, r2= 1.80, r3= 5.61, r4= 6.11,
 igr2=1251,1252,1253,
 &end
#
# 69 MET H 81 VAL QG1 5.00 
 &rst
  ixpk= 0, nxpk= 0, iat=1059,  -1, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,
 igr2=1247,1248,1249,
 &end
#
# 69 MET H 79 ILE QD1 5.50 
 &rst
  ixpk= 0, nxpk= 0, iat=1059,  -1, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr2=1213,1214,1215,
 &end
#
# 20 ASN HD22 21 GLU H 5.46 
 &rst
  ixpk= 0, nxpk= 0, iat= 298, 303, r1= 1.30, r2= 1.80, r3= 5.46, r4= 5.96,  &end
#
# 20 ASN HD22 23 ALA H 5.39 
 &rst
  ixpk= 0, nxpk= 0, iat= 298, 340, r1= 1.30, r2= 1.80, r3= 5.39, r4= 5.89,  &end
#
# 20 ASN HA 20 ASN HD22 5.09 
 &rst
  ixpk= 0, nxpk= 0, iat= 291, 298, r1= 1.30, r2= 1.80, r3= 5.09, r4= 5.59,  &end
#
# 20 ASN HB2 20 ASN HD22 4.06 
 &rst
  ixpk= 0, nxpk= 0, iat= 293, 298, r1= 1.30, r2= 1.80, r3= 4.06, r4= 4.56,  &end
#
# 20 ASN HD22 22 LYS HB3 5.50 
 &rst
  ixpk= 0, nxpk= 0, iat= 298, 323, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
# 20 ASN HA 20 ASN HD21 5.50 
 &rst
  ixpk= 0, nxpk= 0, iat= 291, 299, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
# 20 ASN HD21 22 LYS HB3 5.50 
 &rst
  ixpk= 0, nxpk= 0, iat= 299, 323, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
# 20 ASN HD21 22 LYS HG3 5.50 
 &rst
  ixpk= 0, nxpk= 0, iat= 299, 326, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
# 13 GLY H 80 LYS HA 5.50 
 &rst
  ixpk= 0, nxpk= 0, iat= 199,1221, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
# 12 ILE HA 13 GLY H 3.35 
 &rst
  ixpk= 0, nxpk= 0, iat= 182, 199, r1= 1.30, r2= 1.80, r3= 3.35, r4= 3.85,  &end
#
# 13 GLY H 79 ILE HB 5.17 
 &rst
  ixpk= 0, nxpk= 0, iat= 199,1204, r1= 1.30, r2= 1.80, r3= 5.17, r4= 5.67,  &end
#
# 13 GLY H 80 LYS QD 5.50 
 &rst
  ixpk= 0, nxpk= 0, iat= 199,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=1229,1230,
 &end
#
# 12 ILE HB 13 GLY H 4.86 
 &rst
  ixpk= 0, nxpk= 0, iat= 184, 199, r1= 1.30, r2= 1.80, r3= 4.86, r4= 5.36,  &end
#
# 13 GLY H 81 VAL QG2 5.50 
 &rst
  ixpk= 0, nxpk= 0, iat= 199,  -1, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr2=1251,1252,1253,
 &end
#
# 13 GLY H 14 GLY H 5.15 
 &rst
  ixpk= 0, nxpk= 0, iat= 199, 206, r1= 1.30, r2= 1.80, r3= 5.15, r4= 5.65,  &end
#
# 12 ILE H 13 GLY H 5.50 
 &rst
  ixpk= 0, nxpk= 0, iat= 180, 199, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
# 11 PHE QD 13 GLY H 5.50 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 199, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 168, 176,
 &end
#
# 13 GLY H 81 VAL HA 4.52 
 &rst
  ixpk= 0, nxpk= 0, iat= 199,1243, r1= 1.30, r2= 1.80, r3= 4.52, r4= 5.02,  &end
#
# 13 GLY H 80 LYS HB2 4.28 
 &rst
  ixpk= 0, nxpk= 0, iat= 199,1223, r1= 1.30, r2= 1.80, r3= 4.28, r4= 4.78,  &end
#
# 13 GLY H 79 ILE QG2 5.28 
 &rst
  ixpk= 0, nxpk= 0, iat= 199,  -1, r1= 1.30, r2= 1.80, r3= 6.34, r4= 6.84,
 igr2=1206,1207,1208,
 &end
#
# 92 GLY H 93 ARG H 5.48 
 &rst
  ixpk= 0, nxpk= 0, iat=1406,1413, r1= 1.30, r2= 1.80, r3= 5.48, r4= 5.98,  &end
#
# 91 SER QB 92 GLY H 5.45 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1406, r1= 1.30, r2= 1.80, r3= 6.12, r4= 6.62,
 igr1=1399,1400,
 &end
#
# 8 GLY H 83 GLN HE22 5.50 
 &rst
  ixpk= 0, nxpk= 0, iat= 112,1284, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
# 8 GLY H 83 GLN HE21 5.46 
 &rst
  ixpk= 0, nxpk= 0, iat= 112,1285, r1= 1.30, r2= 1.80, r3= 5.46, r4= 5.96,  &end
#
# 8 GLY H 9 LYS HB3 5.00 
 &rst
  ixpk= 0, nxpk= 0, iat= 112, 124, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50,  &end
#
# 8 GLY H 10 LEU HG 4.80 
 &rst
  ixpk= 0, nxpk= 0, iat= 112, 148, r1= 1.30, r2= 1.80, r3= 4.80, r4= 5.30,  &end
#
# 8 GLY H 9 LYS HB2 5.50 
 &rst
  ixpk= 0, nxpk= 0, iat= 112, 123, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
# 8 GLY H 62 ALA QB 4.96 
 &rst
  ixpk= 0, nxpk= 0, iat= 112,  -1, r1= 1.30, r2= 1.80, r3= 5.96, r4= 6.46,
 igr2= 963, 964, 965,
 &end
#
# 26 ALA H 29 GLY H 5.50 
 &rst
  ixpk= 0, nxpk= 0, iat= 384, 430, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
# 29 GLY H 31 TYR H 4.88 
 &rst
  ixpk= 0, nxpk= 0, iat= 430, 459, r1= 1.30, r2= 1.80, r3= 4.88, r4= 5.38,  &end
#
# 28 PHE QD 29 GLY H 5.05 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 430, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1= 418, 426,
 &end
#
# 29 GLY H 31 TYR QD 5.50 
 &rst
  ixpk= 0, nxpk= 0, iat= 430,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2= 467, 476,
 &end
#
# 27 VAL HA 29 GLY H 4.88 
 &rst
  ixpk= 0, nxpk= 0, iat= 396, 430, r1= 1.30, r2= 1.80, r3= 4.88, r4= 5.38,  &end
#
# 25 GLU HA 29 GLY H 4.16 
 &rst
  ixpk= 0, nxpk= 0, iat= 371, 430, r1= 1.30, r2= 1.80, r3= 4.16, r4= 4.66,  &end
#
# 28 PHE HB3 29 GLY H 4.44 
 &rst
  ixpk= 0, nxpk= 0, iat= 415, 430, r1= 1.30, r2= 1.80, r3= 4.44, r4= 4.94,  &end
#
# 28 PHE HB2 29 GLY H 4.09 
 &rst
  ixpk= 0, nxpk= 0, iat= 414, 430, r1= 1.30, r2= 1.80, r3= 4.09, r4= 4.59,  &end
#
# 27 VAL HB 29 GLY H 5.11 
 &rst
  ixpk= 0, nxpk= 0, iat= 398, 430, r1= 1.30, r2= 1.80, r3= 5.11, r4= 5.61,  &end
#
# 29 GLY H 34 ILE HG13 4.45 
 &rst
  ixpk= 0, nxpk= 0, iat= 430, 522, r1= 1.30, r2= 1.80, r3= 4.45, r4= 4.95,  &end
#
# 29 GLY H 30 LYS HB2 5.43 
 &rst
  ixpk= 0, nxpk= 0, iat= 430, 441, r1= 1.30, r2= 1.80, r3= 5.43, r4= 5.93,  &end
#
# 27 VAL QG1 29 GLY H 5.50 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 430, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr1= 400, 401, 402,
 &end
#
# 27 VAL QG2 29 GLY H 5.50 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 430, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr1= 404, 405, 406,
 &end
#
# 29 GLY H 34 ILE QD1 4.00 
 &rst
  ixpk= 0, nxpk= 0, iat= 430,  -1, r1= 1.30, r2= 1.80, r3= 4.80, r4= 5.30,
 igr2= 524, 525, 526,
 &end
#
# 29 GLY H 34 ILE HG12 5.50 
 &rst
  ixpk= 0, nxpk= 0, iat= 430, 521, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
# 43 ARG HA 45 THR H 5.21 
 &rst
  ixpk= 0, nxpk= 0, iat= 668, 705, r1= 1.30, r2= 1.80, r3= 5.21, r4= 5.71,  &end
#
# 42 ASP HB3 45 THR H 4.20 
 &rst
  ixpk= 0, nxpk= 0, iat= 659, 705, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,  &end
#
# 45 THR H 46 ASN HB2 5.50 
 &rst
  ixpk= 0, nxpk= 0, iat= 705, 723, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
# 42 ASP HB2 45 THR H 4.65 
 &rst
  ixpk= 0, nxpk= 0, iat= 658, 705, r1= 1.30, r2= 1.80, r3= 4.65, r4= 5.15,  &end
#
# 44 GLU QB 45 THR H 3.48 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 705, r1= 1.30, r2= 1.80, r3= 3.91, r4= 4.41,
 igr1= 694, 695,
 &end
#
# 43 ARG QB 45 THR H 5.41 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 705, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr1= 670, 671,
 &end
#
# 14 GLY H 15 LEU H 3.50 
 &rst
  ixpk= 0, nxpk= 0, iat= 206, 213, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
# 14 GLY H 51 PHE HA 4.92 
 &rst
  ixpk= 0, nxpk= 0, iat= 206, 799, r1= 1.30, r2= 1.80, r3= 4.92, r4= 5.42,  &end
#
# 14 GLY H 51 PHE HB3 5.13 
 &rst
  ixpk= 0, nxpk= 0, iat= 206, 802, r1= 1.30, r2= 1.80, r3= 5.13, r4= 5.63,  &end
#
# 14 GLY H 51 PHE HB2 5.36 
 &rst
  ixpk= 0, nxpk= 0, iat= 206, 801, r1= 1.30, r2= 1.80, r3= 5.36, r4= 5.86,  &end
#
# 14 GLY H 15 LEU HB3 5.50 
 &rst
  ixpk= 0, nxpk= 0, iat= 206, 218, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
# 14 GLY H 15 LEU HB2 5.25 
 &rst
  ixpk= 0, nxpk= 0, iat= 206, 217, r1= 1.30, r2= 1.80, r3= 5.25, r4= 5.75,  &end
#
# 14 GLY H 15 LEU QD2 5.50 
 &rst
  ixpk= 0, nxpk= 0, iat= 206,  -1, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr2= 226, 227, 228,
 &end
#
# 11 PHE HZ 14 GLY H 5.47 
 &rst
  ixpk= 0, nxpk= 0, iat= 172, 206, r1= 1.30, r2= 1.80, r3= 5.47, r4= 5.97,  &end
#
# 11 PHE QE 14 GLY H 5.46 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 206, r1= 1.30, r2= 1.80, r3= 6.13, r4= 6.63,
 igr1= 170, 174,
 &end
#
# 14 GLY H 15 LEU QD1 5.50 
 &rst
  ixpk= 0, nxpk= 0, iat= 206,  -1, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr2= 222, 223, 224,
 &end
#
# 50 GLY H 51 PHE QD 5.50 
 &rst
  ixpk= 0, nxpk= 0, iat= 790,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2= 805, 813,
 &end
#
# 41 LYS HA 50 GLY H 5.47 
 &rst
  ixpk= 0, nxpk= 0, iat= 634, 790, r1= 1.30, r2= 1.80, r3= 5.47, r4= 5.97,  &end
#
# 48 SER HA 50 GLY H 4.26 
 &rst
  ixpk= 0, nxpk= 0, iat= 757, 790, r1= 1.30, r2= 1.80, r3= 4.26, r4= 4.76,  &end
#
# 17 THR HA 50 GLY H 5.19 
 &rst
  ixpk= 0, nxpk= 0, iat= 248, 790, r1= 1.30, r2= 1.80, r3= 5.19, r4= 5.69,  &end
#
# 39 LEU QD2 50 GLY H 5.40 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 790, r1= 1.30, r2= 1.80, r3= 6.49, r4= 6.99,
 igr1= 609, 610, 611,
 &end
#
# 49 ARG HG3 50 GLY H 5.50 
 &rst
  ixpk= 0, nxpk= 0, iat= 774, 790, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
# 15 LEU H 50 GLY H 5.50 
 &rst
  ixpk= 0, nxpk= 0, iat= 213, 790, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
# 48 SER HB2 50 GLY H 4.63 
 &rst
  ixpk= 0, nxpk= 0, iat= 759, 790, r1= 1.30, r2= 1.80, r3= 4.63, r4= 5.13,  &end
#
# 49 ARG HB3 50 GLY H 5.08 
 &rst
  ixpk= 0, nxpk= 0, iat= 771, 790, r1= 1.30, r2= 1.80, r3= 5.08, r4= 5.58,  &end
#
# 41 LYS HB3 50 GLY H 5.49 
 &rst
  ixpk= 0, nxpk= 0, iat= 637, 790, r1= 1.30, r2= 1.80, r3= 5.49, r4= 5.99,  &end
#
# 17 THR QG2 50 GLY H 4.87 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 790, r1= 1.30, r2= 1.80, r3= 5.85, r4= 6.35,
 igr1= 252, 253, 254,
 &end
#
# 49 ARG HB2 50 GLY H 4.29 
 &rst
  ixpk= 0, nxpk= 0, iat= 770, 790, r1= 1.30, r2= 1.80, r3= 4.29, r4= 4.79,  &end
#
# 15 LEU QD1 50 GLY H 5.50 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 790, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr1= 222, 223, 224,
 &end
#
# 29 GLY H 32 GLY H 5.50 
 &rst
  ixpk= 0, nxpk= 0, iat= 430, 480, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
# 32 GLY H 33 ARG H 4.36 
 &rst
  ixpk= 0, nxpk= 0, iat= 480, 487, r1= 1.30, r2= 1.80, r3= 4.36, r4= 4.86,  &end
#
# 31 TYR H 32 GLY H 3.23 
 &rst
  ixpk= 0, nxpk= 0, iat= 459, 480, r1= 1.30, r2= 1.80, r3= 3.23, r4= 3.73,  &end
#
# 31 TYR QD 32 GLY H 4.48 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 480, r1= 1.30, r2= 1.80, r3= 5.03, r4= 5.53,
 igr1= 467, 476,
 &end
#
# 32 GLY H 56 PHE QR 4.03 
 &rst
  ixpk= 0, nxpk= 0, iat= 480,  -1, r1= 1.30, r2= 1.80, r3= 5.08, r4= 5.58,
 igr2= 885, 893, 887, 891,
 &end
#
# 30 LYS H 32 GLY H 5.27 
 &rst
  ixpk= 0, nxpk= 0, iat= 437, 480, r1= 1.30, r2= 1.80, r3= 5.27, r4= 5.77,  &end
#
# 29 GLY HA3 32 GLY H 4.42 
 &rst
  ixpk= 0, nxpk= 0, iat= 433, 480, r1= 1.30, r2= 1.80, r3= 4.42, r4= 4.92,  &end
#
# 30 LYS HA 32 GLY H 4.25 
 &rst
  ixpk= 0, nxpk= 0, iat= 439, 480, r1= 1.30, r2= 1.80, r3= 4.25, r4= 4.75,  &end
#
# 31 TYR HB3 32 GLY H 4.47 
 &rst
  ixpk= 0, nxpk= 0, iat= 464, 480, r1= 1.30, r2= 1.80, r3= 4.47, r4= 4.97,  &end
#
# 31 TYR HB2 32 GLY H 4.14 
 &rst
  ixpk= 0, nxpk= 0, iat= 463, 480, r1= 1.30, r2= 1.80, r3= 4.14, r4= 4.64,  &end
#
# 32 GLY H 61 ASP HB2 5.22 
 &rst
  ixpk= 0, nxpk= 0, iat= 480, 951, r1= 1.30, r2= 1.80, r3= 5.22, r4= 5.72,  &end
#
# 30 LYS HB2 32 GLY H 5.50 
 &rst
  ixpk= 0, nxpk= 0, iat= 441, 480, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
# 32 GLY H 65 ALA QB 5.50 
 &rst
  ixpk= 0, nxpk= 0, iat= 480,  -1, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr2=1007,1008,1009,
 &end
#
# 32 GLY H 34 ILE QD1 5.50 
 &rst
  ixpk= 0, nxpk= 0, iat= 480,  -1, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr2= 524, 525, 526,
 &end
#
# 75 ASP H 76 GLY H 3.83 
 &rst
  ixpk= 0, nxpk= 0, iat=1149,1161, r1= 1.30, r2= 1.80, r3= 3.83, r4= 4.33,  &end
#
# 74 LEU H 76 GLY H 4.90 
 &rst
  ixpk= 0, nxpk= 0, iat=1130,1161, r1= 1.30, r2= 1.80, r3= 4.90, r4= 5.40,  &end
#
# 76 GLY H 77 LYS H 3.58 
 &rst
  ixpk= 0, nxpk= 0, iat=1161,1168, r1= 1.30, r2= 1.80, r3= 3.58, r4= 4.08,  &end
#
# 73 SER HA 76 GLY H 5.50 
 &rst
  ixpk= 0, nxpk= 0, iat=1121,1161, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
# 76 GLY H 77 LYS HA 5.05 
 &rst
  ixpk= 0, nxpk= 0, iat=1161,1170, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,  &end
#
# 74 LEU HA 76 GLY H 4.80 
 &rst
  ixpk= 0, nxpk= 0, iat=1132,1161, r1= 1.30, r2= 1.80, r3= 4.80, r4= 5.30,  &end
#
# 75 ASP HA 76 GLY H 3.50 
 &rst
  ixpk= 0, nxpk= 0, iat=1151,1161, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
# 75 ASP HB3 76 GLY H 4.92 
 &rst
  ixpk= 0, nxpk= 0, iat=1154,1161, r1= 1.30, r2= 1.80, r3= 4.92, r4= 5.42,  &end
#
# 75 ASP HB2 76 GLY H 5.23 
 &rst
  ixpk= 0, nxpk= 0, iat=1153,1161, r1= 1.30, r2= 1.80, r3= 5.23, r4= 5.73,  &end
#
# 76 GLY H 77 LYS HB2 5.28 
 &rst
  ixpk= 0, nxpk= 0, iat=1161,1172, r1= 1.30, r2= 1.80, r3= 5.28, r4= 5.78,  &end
#
# 74 LEU QD2 76 GLY H 5.50 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1161, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr1=1143,1144,1145,
 &end
#
# 45 THR HB 46 ASN H 4.49 
 &rst
  ixpk= 0, nxpk= 0, iat= 709, 719, r1= 1.30, r2= 1.80, r3= 4.49, r4= 4.99,  &end
#
# 45 THR HB 47 LYS H 4.41 
 &rst
  ixpk= 0, nxpk= 0, iat= 709, 733, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,  &end
#
# 45 THR HB 47 LYS HG3 4.18 
 &rst
  ixpk= 0, nxpk= 0, iat= 709, 741, r1= 1.30, r2= 1.80, r3= 4.18, r4= 4.68,  &end
#
# 45 THR HB 47 LYS HG2 3.70 
 &rst
  ixpk= 0, nxpk= 0, iat= 709, 740, r1= 1.30, r2= 1.80, r3= 3.70, r4= 4.20,  &end
#
# 5 ASP H 85 THR HB 4.97 
 &rst
  ixpk= 0, nxpk= 0, iat=  62,1303, r1= 1.30, r2= 1.80, r3= 4.97, r4= 5.47,  &end
#
# 36 GLU HG3 55 THR HB 4.98 
 &rst
  ixpk= 0, nxpk= 0, iat= 554, 867, r1= 1.30, r2= 1.80, r3= 4.98, r4= 5.48,  &end
#
# 36 GLU HB3 55 THR HB 4.06 
 &rst
  ixpk= 0, nxpk= 0, iat= 551, 867, r1= 1.30, r2= 1.80, r3= 4.06, r4= 4.56,  &end
#
# 35 VAL QG1 55 THR HB 5.00 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 867, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,
 igr1= 536, 537, 538,
 &end
#
# 35 VAL QG2 55 THR HB 4.10 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 867, r1= 1.30, r2= 1.80, r3= 4.92, r4= 5.42,
 igr1= 540, 541, 542,
 &end
#
# 17 THR HB 47 LYS QD 5.40 
 &rst
  ixpk= 0, nxpk= 0, iat= 250,  -1, r1= 1.30, r2= 1.80, r3= 6.06, r4= 6.56,
 igr2= 743, 744,
 &end
#
# 15 LEU HB3 19 THR HB 4.42 
 &rst
  ixpk= 0, nxpk= 0, iat= 218, 279, r1= 1.30, r2= 1.80, r3= 4.42, r4= 4.92,  &end
#
# 17 THR HB 48 SER HB2 4.39 
 &rst
  ixpk= 0, nxpk= 0, iat= 250, 759, r1= 1.30, r2= 1.80, r3= 4.39, r4= 4.89,  &end
#
# 17 THR HB 47 LYS HG2 5.34 
 &rst
  ixpk= 0, nxpk= 0, iat= 250, 740, r1= 1.30, r2= 1.80, r3= 5.34, r4= 5.84,  &end
#
# 15 LEU QD2 19 THR HB 4.56 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 279, r1= 1.30, r2= 1.80, r3= 5.48, r4= 5.98,
 igr1= 226, 227, 228,
 &end
#
# 15 LEU QD1 19 THR HB 4.97 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 279, r1= 1.30, r2= 1.80, r3= 5.97, r4= 6.47,
 igr1= 222, 223, 224,
 &end
#
# 16 ASN HA 17 THR HA 4.88 
 &rst
  ixpk= 0, nxpk= 0, iat= 234, 248, r1= 1.30, r2= 1.80, r3= 4.88, r4= 5.38,  &end
#
# 17 THR HA 48 SER HB3 3.95 
 &rst
  ixpk= 0, nxpk= 0, iat= 248, 760, r1= 1.30, r2= 1.80, r3= 3.95, r4= 4.45,  &end
#
# 17 THR HA 17 THR QG2 3.51 
 &rst
  ixpk= 0, nxpk= 0, iat= 248,  -1, r1= 1.30, r2= 1.80, r3= 4.22, r4= 4.72,
 igr2= 252, 253, 254,
 &end
#
# 7 PRO HA 59 PRO HA 5.50 
 &rst
  ixpk= 0, nxpk= 0, iat= 108, 933, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
# 26 ALA H 27 VAL HA 5.03 
 &rst
  ixpk= 0, nxpk= 0, iat= 384, 396, r1= 1.30, r2= 1.80, r3= 5.03, r4= 5.53,  &end
#
# 27 VAL HA 30 LYS QE 5.34 
 &rst
  ixpk= 0, nxpk= 0, iat= 396,  -1, r1= 1.30, r2= 1.80, r3= 5.99, r4= 6.49,
 igr2= 450, 451,
 &end
#
# 26 ALA QB 27 VAL HA 4.54 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 396, r1= 1.30, r2= 1.80, r3= 5.45, r4= 5.95,
 igr1= 388, 389, 390,
 &end
#
# 27 VAL HA 28 PHE QD 5.50 
 &rst
  ixpk= 0, nxpk= 0, iat= 396,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2= 418, 426,
 &end
#
# 17 THR HA 50 GLY HA2 5.48 
 &rst
  ixpk= 0, nxpk= 0, iat= 248, 792, r1= 1.30, r2= 1.80, r3= 5.48, r4= 5.98,  &end
#
# 8 GLY H 59 PRO HA 4.98 
 &rst
  ixpk= 0, nxpk= 0, iat= 112, 933, r1= 1.30, r2= 1.80, r3= 4.98, r4= 5.48,  &end
#
# 59 PRO HA 63 LYS H 5.24 
 &rst
  ixpk= 0, nxpk= 0, iat= 933, 969, r1= 1.30, r2= 1.80, r3= 5.24, r4= 5.74,  &end
#
# 8 GLY HA2 59 PRO HA 3.78 
 &rst
  ixpk= 0, nxpk= 0, iat= 114, 933, r1= 1.30, r2= 1.80, r3= 3.78, r4= 4.28,  &end
#
# 27 VAL HA 74 LEU QD2 4.99 
 &rst
  ixpk= 0, nxpk= 0, iat= 396,  -1, r1= 1.30, r2= 1.80, r3= 5.99, r4= 6.49,
 igr2=1143,1144,1145,
 &end
#
# 27 VAL HA 74 LEU QD1 5.50 
 &rst
  ixpk= 0, nxpk= 0, iat= 396,  -1, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr2=1139,1140,1141,
 &end
#
# 39 LEU QD2 48 SER HB3 5.12 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 760, r1= 1.30, r2= 1.80, r3= 6.15, r4= 6.65,
 igr1= 609, 610, 611,
 &end
#
# 19 THR HA 23 ALA H 5.16 
 &rst
  ixpk= 0, nxpk= 0, iat= 277, 340, r1= 1.30, r2= 1.80, r3= 5.16, r4= 5.66,  &end
#
# 39 LEU QD1 48 SER HB3 4.38 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 760, r1= 1.30, r2= 1.80, r3= 5.26, r4= 5.76,
 igr1= 605, 606, 607,
 &end
#
# 57 GLU H 58 SER QB 5.11 
 &rst
  ixpk= 0, nxpk= 0, iat= 897,  -1, r1= 1.30, r2= 1.80, r3= 5.74, r4= 6.24,
 igr2= 916, 917,
 &end
#
# 57 GLU HB3 58 SER QB 4.13 
 &rst
  ixpk= 0, nxpk= 0, iat= 902,  -1, r1= 1.30, r2= 1.80, r3= 4.64, r4= 5.14,
 igr2= 916, 917,
 &end
#
# 57 GLU HB2 58 SER QB 4.63 
 &rst
  ixpk= 0, nxpk= 0, iat= 901,  -1, r1= 1.30, r2= 1.80, r3= 5.20, r4= 5.70,
 igr2= 916, 917,
 &end
#
# 58 SER QB 60 ALA QB 5.50 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1= 916, 917,
 igr2= 941, 942, 943,
 &end
#
# 56 PHE HB3 58 SER QB 5.05 
 &rst
  ixpk= 0, nxpk= 0, iat= 882,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr2= 916, 917,
 &end
#
# 48 SER HB2 49 ARG H 4.92 
 &rst
  ixpk= 0, nxpk= 0, iat= 759, 766, r1= 1.30, r2= 1.80, r3= 4.92, r4= 5.42,  &end
#
# 47 LYS HB3 48 SER HB2 5.23 
 &rst
  ixpk= 0, nxpk= 0, iat= 738, 759, r1= 1.30, r2= 1.80, r3= 5.23, r4= 5.73,  &end
#
# 17 THR QG2 48 SER HB2 4.84 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 759, r1= 1.30, r2= 1.80, r3= 5.81, r4= 6.31,
 igr1= 252, 253, 254,
 &end
#
# 39 LEU QD1 48 SER HB2 4.84 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 759, r1= 1.30, r2= 1.80, r3= 5.81, r4= 6.31,
 igr1= 605, 606, 607,
 &end
#
# 73 SER HB3 77 LYS H 5.17 
 &rst
  ixpk= 0, nxpk= 0, iat=1124,1168, r1= 1.30, r2= 1.80, r3= 5.17, r4= 5.67,  &end
#
# 73 SER HB2 78 ALA H 5.50 
 &rst
  ixpk= 0, nxpk= 0, iat=1123,1190, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
# 73 SER HB2 77 LYS H 4.95 
 &rst
  ixpk= 0, nxpk= 0, iat=1123,1168, r1= 1.30, r2= 1.80, r3= 4.95, r4= 5.45,  &end
#
# 73 SER HB2 79 ILE QG2 5.50 
 &rst
  ixpk= 0, nxpk= 0, iat=1123,  -1, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr2=1206,1207,1208,
 &end
#
# 56 PHE QR 58 SER QB 5.50 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.78, r4= 8.28,
 igr1= 885, 893, 887, 891,
 igr2= 916, 917,
 &end
#
# 58 SER QB 62 ALA H 4.91 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 959, r1= 1.30, r2= 1.80, r3= 5.51, r4= 6.01,
 igr1= 916, 917,
 &end
#
# 58 SER QB 61 ASP HA 4.25 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 949, r1= 1.30, r2= 1.80, r3= 4.77, r4= 5.27,
 igr1= 916, 917,
 &end
#
# 41 LYS HA 48 SER HB2 5.50 
 &rst
  ixpk= 0, nxpk= 0, iat= 634, 759, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
# 47 LYS QD 48 SER HB2 5.50 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 759, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 743, 744,
 &end
#
# 73 SER HB3 74 LEU H 4.05 
 &rst
  ixpk= 0, nxpk= 0, iat=1124,1130, r1= 1.30, r2= 1.80, r3= 4.05, r4= 4.55,  &end
#
# 73 SER H 73 SER HB3 3.30 
 &rst
  ixpk= 0, nxpk= 0, iat=1119,1124, r1= 1.30, r2= 1.80, r3= 3.30, r4= 3.80,  &end
#
# 73 SER HB3 78 ALA HA 4.45 
 &rst
  ixpk= 0, nxpk= 0, iat=1124,1192, r1= 1.30, r2= 1.80, r3= 4.45, r4= 4.95,  &end
#
# 72 LYS HA 73 SER HB3 4.51 
 &rst
  ixpk= 0, nxpk= 0, iat=1099,1124, r1= 1.30, r2= 1.80, r3= 4.51, r4= 5.01,  &end
#
# 73 SER HB3 78 ALA QB 5.01 
 &rst
  ixpk= 0, nxpk= 0, iat=1124,  -1, r1= 1.30, r2= 1.80, r3= 6.02, r4= 6.52,
 igr2=1194,1195,1196,
 &end
#
# 73 SER HB2 77 LYS HA 5.39 
 &rst
  ixpk= 0, nxpk= 0, iat=1123,1170, r1= 1.30, r2= 1.80, r3= 5.39, r4= 5.89,  &end
#
# 73 SER HB2 74 LEU H 3.98 
 &rst
  ixpk= 0, nxpk= 0, iat=1123,1130, r1= 1.30, r2= 1.80, r3= 3.98, r4= 4.48,  &end
#
# 73 SER HB2 76 GLY H 5.48 
 &rst
  ixpk= 0, nxpk= 0, iat=1123,1161, r1= 1.30, r2= 1.80, r3= 5.48, r4= 5.98,  &end
#
# 73 SER H 73 SER HB2 3.34 
 &rst
  ixpk= 0, nxpk= 0, iat=1119,1123, r1= 1.30, r2= 1.80, r3= 3.34, r4= 3.84,  &end
#
# 72 LYS HA 73 SER HB2 4.71 
 &rst
  ixpk= 0, nxpk= 0, iat=1099,1123, r1= 1.30, r2= 1.80, r3= 4.71, r4= 5.21,  &end
#
# 7 PRO HA 8 GLY H 3.40 
 &rst
  ixpk= 0, nxpk= 0, iat= 108, 112, r1= 1.30, r2= 1.80, r3= 3.40, r4= 3.90,  &end
#
# 90 GLU QG 91 SER HB3 5.50 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1400, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=1387,1388,
 &end
#
# 90 GLU HA 91 SER HB2 3.99 
 &rst
  ixpk= 0, nxpk= 0, iat=1382,1399, r1= 1.30, r2= 1.80, r3= 3.99, r4= 4.49,  &end
#
# 87 PRO HA 88 SER H 3.45 
 &rst
  ixpk= 0, nxpk= 0, iat=1345,1349, r1= 1.30, r2= 1.80, r3= 3.45, r4= 3.95,  &end
#
# 28 PHE HA 31 TYR QE 4.42 
 &rst
  ixpk= 0, nxpk= 0, iat= 412,  -1, r1= 1.30, r2= 1.80, r3= 4.96, r4= 5.46,
 igr2= 469, 474,
 &end
#
# 28 PHE HA 30 LYS H 4.59 
 &rst
  ixpk= 0, nxpk= 0, iat= 412, 437, r1= 1.30, r2= 1.80, r3= 4.59, r4= 5.09,  &end
#
# 87 PRO HA 88 SER HA 4.32 
 &rst
  ixpk= 0, nxpk= 0, iat=1345,1351, r1= 1.30, r2= 1.80, r3= 4.32, r4= 4.82,  &end
#
# 28 PHE HA 65 ALA QB 4.83 
 &rst
  ixpk= 0, nxpk= 0, iat= 412,  -1, r1= 1.30, r2= 1.80, r3= 5.80, r4= 6.30,
 igr2=1007,1008,1009,
 &end
#
# 37 VAL HA 54 VAL HA 3.71 
 &rst
  ixpk= 0, nxpk= 0, iat= 563, 849, r1= 1.30, r2= 1.80, r3= 3.71, r4= 4.21,  &end
#
# 36 GLU HA 37 VAL HA 4.44 
 &rst
  ixpk= 0, nxpk= 0, iat= 548, 563, r1= 1.30, r2= 1.80, r3= 4.44, r4= 4.94,  &end
#
# 35 VAL HA 55 THR QG2 5.33 
 &rst
  ixpk= 0, nxpk= 0, iat= 532,  -1, r1= 1.30, r2= 1.80, r3= 6.40, r4= 6.90,
 igr2= 869, 870, 871,
 &end
#
# 35 VAL HA 35 VAL QG1 3.43 
 &rst
  ixpk= 0, nxpk= 0, iat= 532,  -1, r1= 1.30, r2= 1.80, r3= 4.12, r4= 4.62,
 igr2= 536, 537, 538,
 &end
#
# 34 ILE QG2 35 VAL HA 4.67 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 532, r1= 1.30, r2= 1.80, r3= 5.61, r4= 6.11,
 igr1= 517, 518, 519,
 &end
#
# 10 LEU H 55 THR HA 3.99 
 &rst
  ixpk= 0, nxpk= 0, iat= 141, 865, r1= 1.30, r2= 1.80, r3= 3.99, r4= 4.49,  &end
#
# 54 VAL HA 55 THR HA 5.05 
 &rst
  ixpk= 0, nxpk= 0, iat= 849, 865, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,  &end
#
# 55 THR HA 56 PHE HB2 4.82 
 &rst
  ixpk= 0, nxpk= 0, iat= 865, 881, r1= 1.30, r2= 1.80, r3= 4.82, r4= 5.32,  &end
#
# 54 VAL QG2 55 THR HA 4.98 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 865, r1= 1.30, r2= 1.80, r3= 5.98, r4= 6.48,
 igr1= 857, 858, 859,
 &end
#
# 55 THR HA 56 PHE H 3.25 
 &rst
  ixpk= 0, nxpk= 0, iat= 865, 877, r1= 1.30, r2= 1.80, r3= 3.25, r4= 3.75,  &end
#
# 54 VAL H 55 THR HA 5.50 
 &rst
  ixpk= 0, nxpk= 0, iat= 847, 865, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
# 55 THR HA 56 PHE QR 4.69 
 &rst
  ixpk= 0, nxpk= 0, iat= 865,  -1, r1= 1.30, r2= 1.80, r3= 5.91, r4= 6.41,
 igr2= 885, 893, 887, 891,
 &end
#
# 35 VAL QG2 55 THR HA 5.31 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 865, r1= 1.30, r2= 1.80, r3= 6.38, r4= 6.88,
 igr1= 540, 541, 542,
 &end
#
# 44 GLU QB 45 THR HA 4.60 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 707, r1= 1.30, r2= 1.80, r3= 5.16, r4= 5.66,
 igr1= 694, 695,
 &end
#
# 45 THR HA 47 LYS HG2 4.74 
 &rst
  ixpk= 0, nxpk= 0, iat= 707, 740, r1= 1.30, r2= 1.80, r3= 4.74, r4= 5.24,  &end
#
# 45 THR HA 45 THR QG2 3.21 
 &rst
  ixpk= 0, nxpk= 0, iat= 707,  -1, r1= 1.30, r2= 1.80, r3= 3.86, r4= 4.36,
 igr2= 711, 712, 713,
 &end
#
# 45 THR HA 46 ASN HB2 4.16 
 &rst
  ixpk= 0, nxpk= 0, iat= 707, 723, r1= 1.30, r2= 1.80, r3= 4.16, r4= 4.66,  &end
#
# 2 VAL HA 3 GLU H 2.98 
 &rst
  ixpk= 0, nxpk= 0, iat=  23,  37, r1= 1.30, r2= 1.80, r3= 2.98, r4= 3.48,  &end
#
# 1 MET HA 2 VAL HA 4.57 
 &rst
  ixpk= 0, nxpk= 0, iat=   6,  23, r1= 1.30, r2= 1.80, r3= 4.57, r4= 5.07,  &end
#
# 2 VAL HA 2 VAL QG1 3.37 
 &rst
  ixpk= 0, nxpk= 0, iat=  23,  -1, r1= 1.30, r2= 1.80, r3= 4.05, r4= 4.55,
 igr2=  27,  28,  29,
 &end
#
# 21 GLU HA 25 GLU H 4.74 
 &rst
  ixpk= 0, nxpk= 0, iat= 305, 369, r1= 1.30, r2= 1.80, r3= 4.74, r4= 5.24,  &end
#
# 21 GLU HA 24 LEU H 3.95 
 &rst
  ixpk= 0, nxpk= 0, iat= 305, 350, r1= 1.30, r2= 1.80, r3= 3.95, r4= 4.45,  &end
#
# 20 ASN HA 21 GLU HA 4.95 
 &rst
  ixpk= 0, nxpk= 0, iat= 291, 305, r1= 1.30, r2= 1.80, r3= 4.95, r4= 5.45,  &end
#
# 21 GLU HA 21 GLU HG3 3.89 
 &rst
  ixpk= 0, nxpk= 0, iat= 305, 311, r1= 1.30, r2= 1.80, r3= 3.89, r4= 4.39,  &end
#
# 21 GLU HA 24 LEU QD1 3.80 
 &rst
  ixpk= 0, nxpk= 0, iat= 305,  -1, r1= 1.30, r2= 1.80, r3= 4.56, r4= 5.06,
 igr2= 359, 360, 361,
 &end
#
# 20 ASN HB2 21 GLU HA 5.34 
 &rst
  ixpk= 0, nxpk= 0, iat= 293, 305, r1= 1.30, r2= 1.80, r3= 5.34, r4= 5.84,  &end
#
# 81 VAL HA 82 GLU H 3.09 
 &rst
  ixpk= 0, nxpk= 0, iat=1243,1257, r1= 1.30, r2= 1.80, r3= 3.09, r4= 3.59,  &end
#
# 12 ILE HA 81 VAL HA 4.06 
 &rst
  ixpk= 0, nxpk= 0, iat= 182,1243, r1= 1.30, r2= 1.80, r3= 4.06, r4= 4.56,  &end
#
# 81 VAL HA 82 GLU HB3 5.07 
 &rst
  ixpk= 0, nxpk= 0, iat=1243,1262, r1= 1.30, r2= 1.80, r3= 5.07, r4= 5.57,  &end
#
# 81 VAL HA 81 VAL QG1 3.54 
 &rst
  ixpk= 0, nxpk= 0, iat=1243,  -1, r1= 1.30, r2= 1.80, r3= 4.25, r4= 4.75,
 igr2=1247,1248,1249,
 &end
#
# 12 ILE QG2 81 VAL HA 4.69 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1243, r1= 1.30, r2= 1.80, r3= 5.63, r4= 6.13,
 igr1= 186, 187, 188,
 &end
#
# 78 ALA QB 79 ILE HA 4.41 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1202, r1= 1.30, r2= 1.80, r3= 5.30, r4= 5.80,
 igr1=1194,1195,1196,
 &end
#
# 79 ILE HA 79 ILE QG1 3.98 
 &rst
  ixpk= 0, nxpk= 0, iat=1202,  -1, r1= 1.30, r2= 1.80, r3= 4.47, r4= 4.97,
 igr2=1210,1211,
 &end
#
# 79 ILE HA 80 LYS H 3.13 
 &rst
  ixpk= 0, nxpk= 0, iat=1202,1219, r1= 1.30, r2= 1.80, r3= 3.13, r4= 3.63,  &end
#
# 79 ILE HA 80 LYS HA 4.48 
 &rst
  ixpk= 0, nxpk= 0, iat=1202,1221, r1= 1.30, r2= 1.80, r3= 4.48, r4= 4.98,  &end
#
# 79 ILE HA 79 ILE QG2 3.41 
 &rst
  ixpk= 0, nxpk= 0, iat=1202,  -1, r1= 1.30, r2= 1.80, r3= 4.10, r4= 4.60,
 igr2=1206,1207,1208,
 &end
#
# 34 ILE HA 35 VAL H 3.07 
 &rst
  ixpk= 0, nxpk= 0, iat= 513, 530, r1= 1.30, r2= 1.80, r3= 3.07, r4= 3.57,  &end
#
# 34 ILE HA 36 GLU H 3.84 
 &rst
  ixpk= 0, nxpk= 0, iat= 513, 546, r1= 1.30, r2= 1.80, r3= 3.84, r4= 4.34,  &end
#
# 34 ILE HA 35 VAL HA 4.41 
 &rst
  ixpk= 0, nxpk= 0, iat= 513, 532, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,  &end
#
# 34 ILE HA 34 ILE HG13 3.87 
 &rst
  ixpk= 0, nxpk= 0, iat= 513, 522, r1= 1.30, r2= 1.80, r3= 3.87, r4= 4.37,  &end
#
# 34 ILE HA 35 VAL QG1 4.98 
 &rst
  ixpk= 0, nxpk= 0, iat= 513,  -1, r1= 1.30, r2= 1.80, r3= 5.98, r4= 6.48,
 igr2= 536, 537, 538,
 &end
#
# 34 ILE HA 35 VAL QG2 4.37 
 &rst
  ixpk= 0, nxpk= 0, iat= 513,  -1, r1= 1.30, r2= 1.80, r3= 5.25, r4= 5.75,
 igr2= 540, 541, 542,
 &end
#
# 34 ILE HA 34 ILE HG12 3.84 
 &rst
  ixpk= 0, nxpk= 0, iat= 513, 521, r1= 1.30, r2= 1.80, r3= 3.84, r4= 4.34,  &end
#
# 34 ILE HA 55 THR HB 5.27 
 &rst
  ixpk= 0, nxpk= 0, iat= 513, 867, r1= 1.30, r2= 1.80, r3= 5.27, r4= 5.77,  &end
#
# 34 ILE HA 34 ILE QG2 3.74 
 &rst
  ixpk= 0, nxpk= 0, iat= 513,  -1, r1= 1.30, r2= 1.80, r3= 4.49, r4= 4.99,
 igr2= 517, 518, 519,
 &end
#
# 34 ILE HA 34 ILE QD1 4.45 
 &rst
  ixpk= 0, nxpk= 0, iat= 513,  -1, r1= 1.30, r2= 1.80, r3= 5.34, r4= 5.84,
 igr2= 524, 525, 526,
 &end
#
# 25 GLU HA 28 PHE QD 5.36 
 &rst
  ixpk= 0, nxpk= 0, iat= 371,  -1, r1= 1.30, r2= 1.80, r3= 6.02, r4= 6.52,
 igr2= 418, 426,
 &end
#
# 24 LEU HA 25 GLU HA 4.89 
 &rst
  ixpk= 0, nxpk= 0, iat= 352, 371, r1= 1.30, r2= 1.80, r3= 4.89, r4= 5.39,  &end
#
# 25 GLU HA 28 PHE HB2 4.49 
 &rst
  ixpk= 0, nxpk= 0, iat= 371, 414, r1= 1.30, r2= 1.80, r3= 4.49, r4= 4.99,  &end
#
# 25 GLU HA 25 GLU HG3 3.83 
 &rst
  ixpk= 0, nxpk= 0, iat= 371, 377, r1= 1.30, r2= 1.80, r3= 3.83, r4= 4.33,  &end
#
# 25 GLU HA 25 GLU QB 2.95 
 &rst
  ixpk= 0, nxpk= 0, iat= 371,  -1, r1= 1.30, r2= 1.80, r3= 3.31, r4= 3.81,
 igr2= 373, 374,
 &end
#
# 25 GLU HA 26 ALA QB 5.00 
 &rst
  ixpk= 0, nxpk= 0, iat= 371,  -1, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,
 igr2= 388, 389, 390,
 &end
#
# 25 GLU HA 34 ILE QD1 3.64 
 &rst
  ixpk= 0, nxpk= 0, iat= 371,  -1, r1= 1.30, r2= 1.80, r3= 4.37, r4= 4.87,
 igr2= 524, 525, 526,
 &end
#
# 24 LEU H 25 GLU HA 4.82 
 &rst
  ixpk= 0, nxpk= 0, iat= 350, 371, r1= 1.30, r2= 1.80, r3= 4.82, r4= 5.32,  &end
#
# 25 GLU HA 29 GLY HA3 5.36 
 &rst
  ixpk= 0, nxpk= 0, iat= 371, 433, r1= 1.30, r2= 1.80, r3= 5.36, r4= 5.86,  &end
#
# 30 LYS HA 31 TYR HA 5.32 
 &rst
  ixpk= 0, nxpk= 0, iat= 439, 461, r1= 1.30, r2= 1.80, r3= 5.32, r4= 5.82,  &end
#
# 63 LYS HA 67 ARG H 4.30 
 &rst
  ixpk= 0, nxpk= 0, iat= 971,1023, r1= 1.30, r2= 1.80, r3= 4.30, r4= 4.80,  &end
#
# 63 LYS HA 63 LYS QB 2.92 
 &rst
  ixpk= 0, nxpk= 0, iat= 971,  -1, r1= 1.30, r2= 1.80, r3= 3.28, r4= 3.78,
 igr2= 973, 974,
 &end
#
# 63 LYS HA 66 ALA QB 3.61 
 &rst
  ixpk= 0, nxpk= 0, iat= 971,  -1, r1= 1.30, r2= 1.80, r3= 4.34, r4= 4.84,
 igr2=1017,1018,1019,
 &end
#
# 55 THR QG2 57 GLU HA 4.90 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 899, r1= 1.30, r2= 1.80, r3= 5.88, r4= 6.38,
 igr1= 869, 870, 871,
 &end
#
# 35 VAL H 57 GLU HA 5.16 
 &rst
  ixpk= 0, nxpk= 0, iat= 530, 899, r1= 1.30, r2= 1.80, r3= 5.16, r4= 5.66,  &end
#
# 56 PHE HA 57 GLU HA 5.00 
 &rst
  ixpk= 0, nxpk= 0, iat= 879, 899, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50,  &end
#
# 56 PHE HB3 57 GLU HA 4.91 
 &rst
  ixpk= 0, nxpk= 0, iat= 882, 899, r1= 1.30, r2= 1.80, r3= 4.91, r4= 5.41,  &end
#
# 57 GLU HA 57 GLU HB3 3.00 
 &rst
  ixpk= 0, nxpk= 0, iat= 899, 902, r1= 1.30, r2= 1.80, r3= 3.00, r4= 3.50,  &end
#
# 35 VAL QG1 57 GLU HA 4.03 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 899, r1= 1.30, r2= 1.80, r3= 4.84, r4= 5.34,
 igr1= 536, 537, 538,
 &end
#
# 88 SER HA 90 GLU HB3 5.29 
 &rst
  ixpk= 0, nxpk= 0, iat=1351,1385, r1= 1.30, r2= 1.80, r3= 5.29, r4= 5.79,  &end
#
# 87 PRO QG 88 SER HA 5.50 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1351, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=1339,1340,
 &end
#
# 67 ARG HA 67 ARG QB 2.85 
 &rst
  ixpk= 0, nxpk= 0, iat=1025,  -1, r1= 1.30, r2= 1.80, r3= 3.20, r4= 3.70,
 igr2=1027,1028,
 &end
#
# 67 ARG HA 67 ARG HG3 3.50 
 &rst
  ixpk= 0, nxpk= 0, iat=1025,1031, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
# 67 ARG HA 67 ARG HG2 3.81 
 &rst
  ixpk= 0, nxpk= 0, iat=1025,1030, r1= 1.30, r2= 1.80, r3= 3.81, r4= 4.31,  &end
#
# 44 GLU HA 44 GLU QB 2.95 
 &rst
  ixpk= 0, nxpk= 0, iat= 692,  -1, r1= 1.30, r2= 1.80, r3= 3.31, r4= 3.81,
 igr2= 694, 695,
 &end
#
# 22 LYS HA 25 GLU HG3 4.51 
 &rst
  ixpk= 0, nxpk= 0, iat= 320, 377, r1= 1.30, r2= 1.80, r3= 4.51, r4= 5.01,  &end
#
# 22 LYS HA 25 GLU QB 3.13 
 &rst
  ixpk= 0, nxpk= 0, iat= 320,  -1, r1= 1.30, r2= 1.80, r3= 3.51, r4= 4.01,
 igr2= 373, 374,
 &end
#
# 22 LYS HA 22 LYS HG3 3.82 
 &rst
  ixpk= 0, nxpk= 0, iat= 320, 326, r1= 1.30, r2= 1.80, r3= 3.82, r4= 4.32,  &end
#
# 43 ARG HA 43 ARG QD 4.41 
 &rst
  ixpk= 0, nxpk= 0, iat= 668,  -1, r1= 1.30, r2= 1.80, r3= 4.95, r4= 5.45,
 igr2= 676, 677,
 &end
#
# 43 ARG HA 43 ARG QB 2.65 
 &rst
  ixpk= 0, nxpk= 0, iat= 668,  -1, r1= 1.30, r2= 1.80, r3= 2.97, r4= 3.47,
 igr2= 670, 671,
 &end
#
# 22 LYS HA 22 LYS QD 3.26 
 &rst
  ixpk= 0, nxpk= 0, iat= 320,  -1, r1= 1.30, r2= 1.80, r3= 3.66, r4= 4.16,
 igr2= 328, 329,
 &end
#
# 67 ARG HA 67 ARG HD2 4.81 
 &rst
  ixpk= 0, nxpk= 0, iat=1025,1033, r1= 1.30, r2= 1.80, r3= 4.81, r4= 5.31,  &end
#
# 34 ILE HA 56 PHE HA 3.39 
 &rst
  ixpk= 0, nxpk= 0, iat= 513, 879, r1= 1.30, r2= 1.80, r3= 3.39, r4= 3.89,  &end
#
# 56 PHE HA 62 ALA QB 4.85 
 &rst
  ixpk= 0, nxpk= 0, iat= 879,  -1, r1= 1.30, r2= 1.80, r3= 5.82, r4= 6.32,
 igr2= 963, 964, 965,
 &end
#
# 41 LYS HA 48 SER HA 3.52 
 &rst
  ixpk= 0, nxpk= 0, iat= 634, 757, r1= 1.30, r2= 1.80, r3= 3.52, r4= 4.02,  &end
#
# 41 LYS HG2 48 SER HA 3.71 
 &rst
  ixpk= 0, nxpk= 0, iat= 639, 757, r1= 1.30, r2= 1.80, r3= 3.71, r4= 4.21,  &end
#
# 21 GLU HA 22 LYS HA 4.78 
 &rst
  ixpk= 0, nxpk= 0, iat= 305, 320, r1= 1.30, r2= 1.80, r3= 4.78, r4= 5.28,  &end
#
# 41 LYS HB3 48 SER HA 4.78 
 &rst
  ixpk= 0, nxpk= 0, iat= 637, 757, r1= 1.30, r2= 1.80, r3= 4.78, r4= 5.28,  &end
#
# 41 LYS HG3 48 SER HA 4.78 
 &rst
  ixpk= 0, nxpk= 0, iat= 640, 757, r1= 1.30, r2= 1.80, r3= 4.78, r4= 5.28,  &end
#
# 29 GLY HA3 30 LYS HA 4.93 
 &rst
  ixpk= 0, nxpk= 0, iat= 433, 439, r1= 1.30, r2= 1.80, r3= 4.93, r4= 5.43,  &end
#
# 33 ARG HA 34 ILE H 2.81 
 &rst
  ixpk= 0, nxpk= 0, iat= 489, 511, r1= 1.30, r2= 1.80, r3= 2.81, r4= 3.31,  &end
#
# 29 GLY HA2 33 ARG HA 4.33 
 &rst
  ixpk= 0, nxpk= 0, iat= 432, 489, r1= 1.30, r2= 1.80, r3= 4.33, r4= 4.83,  &end
#
# 33 ARG HA 33 ARG QD 4.47 
 &rst
  ixpk= 0, nxpk= 0, iat= 489,  -1, r1= 1.30, r2= 1.80, r3= 5.02, r4= 5.52,
 igr2= 497, 498,
 &end
#
# 33 ARG HA 33 ARG HG3 3.68 
 &rst
  ixpk= 0, nxpk= 0, iat= 489, 495, r1= 1.30, r2= 1.80, r3= 3.68, r4= 4.18,  &end
#
# 33 ARG HA 34 ILE HG12 5.00 
 &rst
  ixpk= 0, nxpk= 0, iat= 489, 521, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50,  &end
#
# 30 LYS HA 30 LYS HG3 4.00 
 &rst
  ixpk= 0, nxpk= 0, iat= 439, 445, r1= 1.30, r2= 1.80, r3= 4.00, r4= 4.50,  &end
#
# 73 SER HA 74 LEU H 3.04 
 &rst
  ixpk= 0, nxpk= 0, iat=1121,1130, r1= 1.30, r2= 1.80, r3= 3.04, r4= 3.54,  &end
#
# 73 SER HA 79 ILE H 3.70 
 &rst
  ixpk= 0, nxpk= 0, iat=1121,1200, r1= 1.30, r2= 1.80, r3= 3.70, r4= 4.20,  &end
#
# 73 SER HA 77 LYS H 4.39 
 &rst
  ixpk= 0, nxpk= 0, iat=1121,1168, r1= 1.30, r2= 1.80, r3= 4.39, r4= 4.89,  &end
#
# 73 SER HA 79 ILE HA 5.12 
 &rst
  ixpk= 0, nxpk= 0, iat=1121,1202, r1= 1.30, r2= 1.80, r3= 5.12, r4= 5.62,  &end
#
# 73 SER HA 79 ILE QG1 4.67 
 &rst
  ixpk= 0, nxpk= 0, iat=1121,  -1, r1= 1.30, r2= 1.80, r3= 5.24, r4= 5.74,
 igr2=1210,1211,
 &end
#
# 73 SER HA 78 ALA QB 3.97 
 &rst
  ixpk= 0, nxpk= 0, iat=1121,  -1, r1= 1.30, r2= 1.80, r3= 4.77, r4= 5.27,
 igr2=1194,1195,1196,
 &end
#
# 73 SER HA 79 ILE QG2 4.86 
 &rst
  ixpk= 0, nxpk= 0, iat=1121,  -1, r1= 1.30, r2= 1.80, r3= 5.84, r4= 6.34,
 igr2=1206,1207,1208,
 &end
#
# 64 ASP HA 66 ALA H 4.97 
 &rst
  ixpk= 0, nxpk= 0, iat= 993,1013, r1= 1.30, r2= 1.80, r3= 4.97, r4= 5.47,  &end
#
# 33 ARG HA 33 ARG HG2 3.81 
 &rst
  ixpk= 0, nxpk= 0, iat= 489, 494, r1= 1.30, r2= 1.80, r3= 3.81, r4= 4.31,  &end
#
# 30 LYS HA 30 LYS HG2 4.15 
 &rst
  ixpk= 0, nxpk= 0, iat= 439, 444, r1= 1.30, r2= 1.80, r3= 4.15, r4= 4.65,  &end
#
# 89 PHE HA 89 PHE QB 2.82 
 &rst
  ixpk= 0, nxpk= 0, iat=1362,  -1, r1= 1.30, r2= 1.80, r3= 3.17, r4= 3.67,
 igr2=1364,1365,
 &end
#
# 64 ASP HA 67 ARG H 3.51 
 &rst
  ixpk= 0, nxpk= 0, iat= 993,1023, r1= 1.30, r2= 1.80, r3= 3.51, r4= 4.01,  &end
#
# 64 ASP HA 67 ARG QB 3.39 
 &rst
  ixpk= 0, nxpk= 0, iat= 993,  -1, r1= 1.30, r2= 1.80, r3= 3.81, r4= 4.31,
 igr2=1027,1028,
 &end
#
# 83 GLN HA 83 GLN HE22 4.83 
 &rst
  ixpk= 0, nxpk= 0, iat=1274,1284, r1= 1.30, r2= 1.80, r3= 4.83, r4= 5.33,  &end
#
# 83 GLN HA 84 ALA H 3.24 
 &rst
  ixpk= 0, nxpk= 0, iat=1274,1289, r1= 1.30, r2= 1.80, r3= 3.24, r4= 3.74,  &end
#
# 83 GLN HA 83 GLN HE21 5.50 
 &rst
  ixpk= 0, nxpk= 0, iat=1274,1285, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
# 10 LEU QD2 83 GLN HA 3.52 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1274, r1= 1.30, r2= 1.80, r3= 4.23, r4= 4.73,
 igr1= 154, 155, 156,
 &end
#
# 11 PHE HA 12 ILE H 3.54 
 &rst
  ixpk= 0, nxpk= 0, iat= 162, 180, r1= 1.30, r2= 1.80, r3= 3.54, r4= 4.04,  &end
#
# 10 LEU HA 83 GLN HA 3.64 
 &rst
  ixpk= 0, nxpk= 0, iat= 143,1274, r1= 1.30, r2= 1.80, r3= 3.64, r4= 4.14,  &end
#
# 36 GLU HA 55 THR HB 4.48 
 &rst
  ixpk= 0, nxpk= 0, iat= 548, 867, r1= 1.30, r2= 1.80, r3= 4.48, r4= 4.98,  &end
#
# 70 ASN HA 71 GLY H 3.15 
 &rst
  ixpk= 0, nxpk= 0, iat=1078,1090, r1= 1.30, r2= 1.80, r3= 3.15, r4= 3.65,  &end
#
# 70 ASN HA 81 VAL H 3.59 
 &rst
  ixpk= 0, nxpk= 0, iat=1078,1241, r1= 1.30, r2= 1.80, r3= 3.59, r4= 4.09,  &end
#
# 70 ASN HA 81 VAL HB 3.67 
 &rst
  ixpk= 0, nxpk= 0, iat=1078,1245, r1= 1.30, r2= 1.80, r3= 3.67, r4= 4.17,  &end
#
# 70 ASN HA 81 VAL QG1 4.71 
 &rst
  ixpk= 0, nxpk= 0, iat=1078,  -1, r1= 1.30, r2= 1.80, r3= 5.66, r4= 6.16,
 igr2=1247,1248,1249,
 &end
#
# 66 ALA HA 70 ASN HA 4.90 
 &rst
  ixpk= 0, nxpk= 0, iat=1015,1078, r1= 1.30, r2= 1.80, r3= 4.90, r4= 5.40,  &end
#
# 61 ASP HA 65 ALA H 5.50 
 &rst
  ixpk= 0, nxpk= 0, iat= 949,1003, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
# 61 ASP HA 64 ASP H 3.95 
 &rst
  ixpk= 0, nxpk= 0, iat= 949, 991, r1= 1.30, r2= 1.80, r3= 3.95, r4= 4.45,  &end
#
# 61 ASP HA 64 ASP HB3 3.78 
 &rst
  ixpk= 0, nxpk= 0, iat= 949, 996, r1= 1.30, r2= 1.80, r3= 3.78, r4= 4.28,  &end
#
# 36 GLU HA 37 VAL H 2.87 
 &rst
  ixpk= 0, nxpk= 0, iat= 548, 561, r1= 1.30, r2= 1.80, r3= 2.87, r4= 3.37,  &end
#
# 36 GLU HA 36 GLU HG3 3.47 
 &rst
  ixpk= 0, nxpk= 0, iat= 548, 554, r1= 1.30, r2= 1.80, r3= 3.47, r4= 3.97,  &end
#
# 34 ILE QG2 36 GLU HA 4.64 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 548, r1= 1.30, r2= 1.80, r3= 5.57, r4= 6.07,
 igr1= 517, 518, 519,
 &end
#
# 70 ASN HA 81 VAL QG2 3.65 
 &rst
  ixpk= 0, nxpk= 0, iat=1078,  -1, r1= 1.30, r2= 1.80, r3= 4.38, r4= 4.88,
 igr2=1251,1252,1253,
 &end
#
# 90 GLU HA 90 GLU QG 3.55 
 &rst
  ixpk= 0, nxpk= 0, iat=1382,  -1, r1= 1.30, r2= 1.80, r3= 3.98, r4= 4.48,
 igr2=1387,1388,
 &end
#
# 18 GLU HA 18 GLU HG3 3.88 
 &rst
  ixpk= 0, nxpk= 0, iat= 262, 268, r1= 1.30, r2= 1.80, r3= 3.88, r4= 4.38,  &end
#
# 10 LEU H 53 PHE HA 5.16 
 &rst
  ixpk= 0, nxpk= 0, iat= 141, 829, r1= 1.30, r2= 1.80, r3= 5.16, r4= 5.66,  &end
#
# 38 LEU H 53 PHE HA 5.35 
 &rst
  ixpk= 0, nxpk= 0, iat= 577, 829, r1= 1.30, r2= 1.80, r3= 5.35, r4= 5.85,  &end
#
# 12 ILE H 53 PHE HA 4.75 
 &rst
  ixpk= 0, nxpk= 0, iat= 180, 829, r1= 1.30, r2= 1.80, r3= 4.75, r4= 5.25,  &end
#
# 11 PHE HA 53 PHE HA 4.24 
 &rst
  ixpk= 0, nxpk= 0, iat= 162, 829, r1= 1.30, r2= 1.80, r3= 4.24, r4= 4.74,  &end
#
# 38 LEU HB3 53 PHE HA 5.39 
 &rst
  ixpk= 0, nxpk= 0, iat= 582, 829, r1= 1.30, r2= 1.80, r3= 5.39, r4= 5.89,  &end
#
# 12 ILE HG12 53 PHE HA 5.01 
 &rst
  ixpk= 0, nxpk= 0, iat= 190, 829, r1= 1.30, r2= 1.80, r3= 5.01, r4= 5.51,  &end
#
# 53 PHE HA 54 VAL H 3.21 
 &rst
  ixpk= 0, nxpk= 0, iat= 829, 847, r1= 1.30, r2= 1.80, r3= 3.21, r4= 3.71,  &end
#
# 53 PHE HA 53 PHE QE 5.50 
 &rst
  ixpk= 0, nxpk= 0, iat= 829,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2= 837, 841,
 &end
#
# 93 ARG HA 93 ARG QG 4.21 
 &rst
  ixpk= 0, nxpk= 0, iat=1415,  -1, r1= 1.30, r2= 1.80, r3= 4.73, r4= 5.23,
 igr2=1420,1421,
 &end
#
# 53 PHE HA 54 VAL QG1 4.93 
 &rst
  ixpk= 0, nxpk= 0, iat= 829,  -1, r1= 1.30, r2= 1.80, r3= 5.92, r4= 6.42,
 igr2= 853, 854, 855,
 &end
#
# 9 LYS HA 56 PHE H 4.18 
 &rst
  ixpk= 0, nxpk= 0, iat= 121, 877, r1= 1.30, r2= 1.80, r3= 4.18, r4= 4.68,  &end
#
# 9 LYS HA 9 LYS HE2 5.29 
 &rst
  ixpk= 0, nxpk= 0, iat= 121, 132, r1= 1.30, r2= 1.80, r3= 5.29, r4= 5.79,  &end
#
# 9 LYS HA 55 THR QG2 4.56 
 &rst
  ixpk= 0, nxpk= 0, iat= 121,  -1, r1= 1.30, r2= 1.80, r3= 5.48, r4= 5.98,
 igr2= 869, 870, 871,
 &end
#
# 3 GLU HA 4 ALA H 3.00 
 &rst
  ixpk= 0, nxpk= 0, iat=  39,  52, r1= 1.30, r2= 1.80, r3= 3.00, r4= 3.50,  &end
#
# 3 GLU HA 3 GLU QG 3.63 
 &rst
  ixpk= 0, nxpk= 0, iat=  39,  -1, r1= 1.30, r2= 1.80, r3= 4.07, r4= 4.57,
 igr2=  44,  45,
 &end
#
# 74 LEU QD2 75 ASP HA 5.43 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1151, r1= 1.30, r2= 1.80, r3= 6.52, r4= 7.02,
 igr1=1143,1144,1145,
 &end
#
# 1 MET HA 2 VAL H 2.89 
 &rst
  ixpk= 0, nxpk= 0, iat=   6,  21, r1= 1.30, r2= 1.80, r3= 2.89, r4= 3.39,  &end
#
# 1 MET HA 2 VAL QG2 5.50 
 &rst
  ixpk= 0, nxpk= 0, iat=   6,  -1, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr2=  31,  32,  33,
 &end
#
# 47 LYS HA 47 LYS HG2 3.41 
 &rst
  ixpk= 0, nxpk= 0, iat= 735, 740, r1= 1.30, r2= 1.80, r3= 3.41, r4= 3.91,  &end
#
# 72 LYS HA 72 LYS HB2 2.99 
 &rst
  ixpk= 0, nxpk= 0, iat=1099,1101, r1= 1.30, r2= 1.80, r3= 2.99, r4= 3.49,  &end
#
# 47 LYS HA 47 LYS QD 3.22 
 &rst
  ixpk= 0, nxpk= 0, iat= 735,  -1, r1= 1.30, r2= 1.80, r3= 3.61, r4= 4.11,
 igr2= 743, 744,
 &end
#
# 72 LYS HA 73 SER H 2.76 
 &rst
  ixpk= 0, nxpk= 0, iat=1099,1119, r1= 1.30, r2= 1.80, r3= 2.76, r4= 3.26,  &end
#
# 2 VAL QG2 3 GLU HA 3.89 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  39, r1= 1.30, r2= 1.80, r3= 4.67, r4= 5.17,
 igr1=  31,  32,  33,
 &end
#
# 60 ALA HA 64 ASP H 4.88 
 &rst
  ixpk= 0, nxpk= 0, iat= 939, 991, r1= 1.30, r2= 1.80, r3= 4.88, r4= 5.38,  &end
#
# 60 ALA HA 63 LYS QB 3.33 
 &rst
  ixpk= 0, nxpk= 0, iat= 939,  -1, r1= 1.30, r2= 1.80, r3= 3.74, r4= 4.24,
 igr2= 973, 974,
 &end
#
# 66 ALA HA 70 ASN HB3 4.76 
 &rst
  ixpk= 0, nxpk= 0, iat=1015,1081, r1= 1.30, r2= 1.80, r3= 4.76, r4= 5.26,  &end
#
# 66 ALA HA 81 VAL HB 3.56 
 &rst
  ixpk= 0, nxpk= 0, iat=1015,1245, r1= 1.30, r2= 1.80, r3= 3.56, r4= 4.06,  &end
#
# 66 ALA HA 81 VAL QG2 4.06 
 &rst
  ixpk= 0, nxpk= 0, iat=1015,  -1, r1= 1.30, r2= 1.80, r3= 4.88, r4= 5.38,
 igr2=1251,1252,1253,
 &end
#
# 66 ALA HA 81 VAL QG1 3.20 
 &rst
  ixpk= 0, nxpk= 0, iat=1015,  -1, r1= 1.30, r2= 1.80, r3= 3.84, r4= 4.34,
 igr2=1247,1248,1249,
 &end
#
# 10 LEU QD2 66 ALA HA 4.76 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1015, r1= 1.30, r2= 1.80, r3= 5.72, r4= 6.22,
 igr1= 154, 155, 156,
 &end
#
# 51 PHE HA 52 ALA H 3.36 
 &rst
  ixpk= 0, nxpk= 0, iat= 799, 817, r1= 1.30, r2= 1.80, r3= 3.36, r4= 3.86,  &end
#
# 51 PHE HA 51 PHE QD 4.30 
 &rst
  ixpk= 0, nxpk= 0, iat= 799,  -1, r1= 1.30, r2= 1.80, r3= 4.83, r4= 5.33,
 igr2= 805, 813,
 &end
#
# 11 PHE QE 51 PHE HA 5.08 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 799, r1= 1.30, r2= 1.80, r3= 5.70, r4= 6.20,
 igr1= 170, 174,
 &end
#
# 15 LEU HG 51 PHE HA 5.06 
 &rst
  ixpk= 0, nxpk= 0, iat= 220, 799, r1= 1.30, r2= 1.80, r3= 5.06, r4= 5.56,  &end
#
# 51 PHE HA 52 ALA QB 4.63 
 &rst
  ixpk= 0, nxpk= 0, iat= 799,  -1, r1= 1.30, r2= 1.80, r3= 5.56, r4= 6.06,
 igr2= 821, 822, 823,
 &end
#
# 15 LEU QD1 51 PHE HA 3.93 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 799, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,
 igr1= 222, 223, 224,
 &end
#
# 44 GLU H 46 ASN HA 5.16 
 &rst
  ixpk= 0, nxpk= 0, iat= 690, 721, r1= 1.30, r2= 1.80, r3= 5.16, r4= 5.66,  &end
#
# 45 THR H 46 ASN HA 4.06 
 &rst
  ixpk= 0, nxpk= 0, iat= 705, 721, r1= 1.30, r2= 1.80, r3= 4.06, r4= 4.56,  &end
#
# 26 ALA HA 29 GLY H 4.95 
 &rst
  ixpk= 0, nxpk= 0, iat= 386, 430, r1= 1.30, r2= 1.80, r3= 4.95, r4= 5.45,  &end
#
# 25 GLU QB 26 ALA HA 4.64 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 386, r1= 1.30, r2= 1.80, r3= 5.21, r4= 5.71,
 igr1= 373, 374,
 &end
#
# 22 LYS QD 26 ALA HA 4.80 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 386, r1= 1.30, r2= 1.80, r3= 5.39, r4= 5.89,
 igr1= 328, 329,
 &end
#
# 60 ALA HA 62 ALA H 4.94 
 &rst
  ixpk= 0, nxpk= 0, iat= 939, 959, r1= 1.30, r2= 1.80, r3= 4.94, r4= 5.44,  &end
#
# 60 ALA HA 63 LYS QD 4.00 
 &rst
  ixpk= 0, nxpk= 0, iat= 939,  -1, r1= 1.30, r2= 1.80, r3= 4.49, r4= 4.99,
 igr2= 979, 980,
 &end
#
# 66 ALA HA 81 VAL HA 5.26 
 &rst
  ixpk= 0, nxpk= 0, iat=1015,1243, r1= 1.30, r2= 1.80, r3= 5.26, r4= 5.76,  &end
#
# 66 ALA HA 67 ARG HA 4.99 
 &rst
  ixpk= 0, nxpk= 0, iat=1015,1025, r1= 1.30, r2= 1.80, r3= 4.99, r4= 5.49,  &end
#
# 66 ALA HA 69 MET HB3 4.59 
 &rst
  ixpk= 0, nxpk= 0, iat=1015,1064, r1= 1.30, r2= 1.80, r3= 4.59, r4= 5.09,  &end
#
# 12 ILE HA 51 PHE HA 5.32 
 &rst
  ixpk= 0, nxpk= 0, iat= 182, 799, r1= 1.30, r2= 1.80, r3= 5.32, r4= 5.82,  &end
#
# 13 GLY H 51 PHE HA 5.50 
 &rst
  ixpk= 0, nxpk= 0, iat= 199, 799, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
# 74 LEU HA 75 ASP H 3.50 
 &rst
  ixpk= 0, nxpk= 0, iat=1132,1149, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
# 43 ARG HA 46 ASN HA 4.47 
 &rst
  ixpk= 0, nxpk= 0, iat= 668, 721, r1= 1.30, r2= 1.80, r3= 4.47, r4= 4.97,  &end
#
# 41 LYS HB2 46 ASN HA 4.02 
 &rst
  ixpk= 0, nxpk= 0, iat= 636, 721, r1= 1.30, r2= 1.80, r3= 4.02, r4= 4.52,  &end
#
# 41 LYS HA 46 ASN HA 5.37 
 &rst
  ixpk= 0, nxpk= 0, iat= 634, 721, r1= 1.30, r2= 1.80, r3= 5.37, r4= 5.87,  &end
#
# 23 ALA HA 25 GLU H 5.01 
 &rst
  ixpk= 0, nxpk= 0, iat= 342, 369, r1= 1.30, r2= 1.80, r3= 5.01, r4= 5.51,  &end
#
# 23 ALA HA 27 VAL QG1 5.21 
 &rst
  ixpk= 0, nxpk= 0, iat= 342,  -1, r1= 1.30, r2= 1.80, r3= 6.26, r4= 6.76,
 igr2= 400, 401, 402,
 &end
#
# 26 ALA HA 27 VAL HA 4.93 
 &rst
  ixpk= 0, nxpk= 0, iat= 386, 396, r1= 1.30, r2= 1.80, r3= 4.93, r4= 5.43,  &end
#
# 41 LYS HA 42 ASP H 3.21 
 &rst
  ixpk= 0, nxpk= 0, iat= 634, 654, r1= 1.30, r2= 1.80, r3= 3.21, r4= 3.71,  &end
#
# 41 LYS HA 41 LYS HG2 3.73 
 &rst
  ixpk= 0, nxpk= 0, iat= 634, 639, r1= 1.30, r2= 1.80, r3= 3.73, r4= 4.23,  &end
#
# 40 MET HA 41 LYS H 2.99 
 &rst
  ixpk= 0, nxpk= 0, iat= 617, 632, r1= 1.30, r2= 1.80, r3= 2.99, r4= 3.49,  &end
#
# 74 LEU HA 75 ASP HA 4.49 
 &rst
  ixpk= 0, nxpk= 0, iat=1132,1151, r1= 1.30, r2= 1.80, r3= 4.49, r4= 4.99,  &end
#
# 74 LEU HA 74 LEU HG 4.02 
 &rst
  ixpk= 0, nxpk= 0, iat=1132,1137, r1= 1.30, r2= 1.80, r3= 4.02, r4= 4.52,  &end
#
# 74 LEU HA 74 LEU QD2 3.74 
 &rst
  ixpk= 0, nxpk= 0, iat=1132,  -1, r1= 1.30, r2= 1.80, r3= 4.49, r4= 4.99,
 igr2=1143,1144,1145,
 &end
#
# 15 LEU HA 16 ASN H 3.39 
 &rst
  ixpk= 0, nxpk= 0, iat= 215, 232, r1= 1.30, r2= 1.80, r3= 3.39, r4= 3.89,  &end
#
# 14 GLY HA3 15 LEU HA 5.21 
 &rst
  ixpk= 0, nxpk= 0, iat= 209, 215, r1= 1.30, r2= 1.80, r3= 5.21, r4= 5.71,  &end
#
# 15 LEU HA 16 ASN HB3 5.12 
 &rst
  ixpk= 0, nxpk= 0, iat= 215, 237, r1= 1.30, r2= 1.80, r3= 5.12, r4= 5.62,  &end
#
# 15 LEU HA 77 LYS HB2 4.98 
 &rst
  ixpk= 0, nxpk= 0, iat= 215,1172, r1= 1.30, r2= 1.80, r3= 4.98, r4= 5.48,  &end
#
# 15 LEU HA 15 LEU HG 4.06 
 &rst
  ixpk= 0, nxpk= 0, iat= 215, 220, r1= 1.30, r2= 1.80, r3= 4.06, r4= 4.56,  &end
#
# 15 LEU HA 16 ASN HA 5.10 
 &rst
  ixpk= 0, nxpk= 0, iat= 215, 234, r1= 1.30, r2= 1.80, r3= 5.10, r4= 5.60,  &end
#
# 12 ILE QG2 15 LEU HA 5.20 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 215, r1= 1.30, r2= 1.80, r3= 6.24, r4= 6.74,
 igr1= 186, 187, 188,
 &end
#
# 15 LEU HA 15 LEU QD1 4.74 
 &rst
  ixpk= 0, nxpk= 0, iat= 215,  -1, r1= 1.30, r2= 1.80, r3= 5.69, r4= 6.19,
 igr2= 222, 223, 224,
 &end
#
# 80 LYS HA 81 VAL H 3.03 
 &rst
  ixpk= 0, nxpk= 0, iat=1221,1241, r1= 1.30, r2= 1.80, r3= 3.03, r4= 3.53,  &end
#
# 70 ASN HA 80 LYS HA 4.05 
 &rst
  ixpk= 0, nxpk= 0, iat=1078,1221, r1= 1.30, r2= 1.80, r3= 4.05, r4= 4.55,  &end
#
# 40 MET HA 40 MET QE 4.27 
 &rst
  ixpk= 0, nxpk= 0, iat= 617,  -1, r1= 1.30, r2= 1.80, r3= 5.13, r4= 5.63,
 igr2= 626, 627, 628,
 &end
#
# 62 ALA HA 66 ALA H 4.59 
 &rst
  ixpk= 0, nxpk= 0, iat= 961,1013, r1= 1.30, r2= 1.80, r3= 4.59, r4= 5.09,  &end
#
# 56 PHE QR 62 ALA HA 3.92 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 961, r1= 1.30, r2= 1.80, r3= 4.94, r4= 5.44,
 igr1= 885, 893, 887, 891,
 &end
#
# 56 PHE HB2 62 ALA HA 4.65 
 &rst
  ixpk= 0, nxpk= 0, iat= 881, 961, r1= 1.30, r2= 1.80, r3= 4.65, r4= 5.15,  &end
#
# 62 ALA HA 66 ALA QB 5.12 
 &rst
  ixpk= 0, nxpk= 0, iat= 961,  -1, r1= 1.30, r2= 1.80, r3= 6.15, r4= 6.65,
 igr2=1017,1018,1019,
 &end
#
# 62 ALA HA 65 ALA QB 3.66 
 &rst
  ixpk= 0, nxpk= 0, iat= 961,  -1, r1= 1.30, r2= 1.80, r3= 4.40, r4= 4.90,
 igr2=1007,1008,1009,
 &end
#
# 10 LEU QD1 62 ALA HA 3.79 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 961, r1= 1.30, r2= 1.80, r3= 4.55, r4= 5.05,
 igr1= 150, 151, 152,
 &end
#
# 10 LEU QD2 62 ALA HA 4.60 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 961, r1= 1.30, r2= 1.80, r3= 5.52, r4= 6.02,
 igr1= 154, 155, 156,
 &end
#
# 65 ALA HA 68 ASP HA 5.50 
 &rst
  ixpk= 0, nxpk= 0, iat=1005,1049, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
# 31 TYR QE 65 ALA HA 4.40 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1005, r1= 1.30, r2= 1.80, r3= 4.94, r4= 5.44,
 igr1= 469, 474,
 &end
#
# 64 ASP HA 65 ALA HA 5.12 
 &rst
  ixpk= 0, nxpk= 0, iat= 993,1005, r1= 1.30, r2= 1.80, r3= 5.12, r4= 5.62,  &end
#
# 31 TYR HB3 65 ALA HA 4.81 
 &rst
  ixpk= 0, nxpk= 0, iat= 464,1005, r1= 1.30, r2= 1.80, r3= 4.81, r4= 5.31,  &end
#
# 31 TYR HB2 65 ALA HA 4.53 
 &rst
  ixpk= 0, nxpk= 0, iat= 463,1005, r1= 1.30, r2= 1.80, r3= 4.53, r4= 5.03,  &end
#
# 65 ALA HA 68 ASP HB3 4.18 
 &rst
  ixpk= 0, nxpk= 0, iat=1005,1052, r1= 1.30, r2= 1.80, r3= 4.18, r4= 4.68,  &end
#
# 65 ALA HA 68 ASP HB2 4.19 
 &rst
  ixpk= 0, nxpk= 0, iat=1005,1051, r1= 1.30, r2= 1.80, r3= 4.19, r4= 4.69,  &end
#
# 65 ALA HA 69 MET QG 3.95 
 &rst
  ixpk= 0, nxpk= 0, iat=1005,  -1, r1= 1.30, r2= 1.80, r3= 4.43, r4= 4.93,
 igr2=1066,1067,
 &end
#
# 65 ALA HA 67 ARG QB 5.41 
 &rst
  ixpk= 0, nxpk= 0, iat=1005,  -1, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr2=1027,1028,
 &end
#
# 65 ALA HA 66 ALA QB 5.50 
 &rst
  ixpk= 0, nxpk= 0, iat=1005,  -1, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr2=1017,1018,1019,
 &end
#
# 10 LEU QD1 65 ALA HA 4.95 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1005, r1= 1.30, r2= 1.80, r3= 5.94, r4= 6.44,
 igr1= 150, 151, 152,
 &end
#
# 28 PHE QE 65 ALA HA 5.50 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1005, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 420, 424,
 &end
#
# 71 GLY H 80 LYS HA 3.99 
 &rst
  ixpk= 0, nxpk= 0, iat=1090,1221, r1= 1.30, r2= 1.80, r3= 3.99, r4= 4.49,  &end
#
# 80 LYS HA 80 LYS HG3 3.75 
 &rst
  ixpk= 0, nxpk= 0, iat=1221,1227, r1= 1.30, r2= 1.80, r3= 3.75, r4= 4.25,  &end
#
# 80 LYS HA 81 VAL QG2 4.81 
 &rst
  ixpk= 0, nxpk= 0, iat=1221,  -1, r1= 1.30, r2= 1.80, r3= 5.78, r4= 6.28,
 igr2=1251,1252,1253,
 &end
#
# 40 MET HA 41 LYS HA 4.79 
 &rst
  ixpk= 0, nxpk= 0, iat= 617, 634, r1= 1.30, r2= 1.80, r3= 4.79, r4= 5.29,  &end
#
# 39 LEU HA 40 MET QE 5.50 
 &rst
  ixpk= 0, nxpk= 0, iat= 598,  -1, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr2= 626, 627, 628,
 &end
#
# 62 ALA HA 64 ASP HB3 5.10 
 &rst
  ixpk= 0, nxpk= 0, iat= 961, 996, r1= 1.30, r2= 1.80, r3= 5.10, r4= 5.60,  &end
#
# 39 LEU HA 40 MET H 3.35 
 &rst
  ixpk= 0, nxpk= 0, iat= 598, 615, r1= 1.30, r2= 1.80, r3= 3.35, r4= 3.85,  &end
#
# 39 LEU HA 40 MET HG2 4.88 
 &rst
  ixpk= 0, nxpk= 0, iat= 598, 622, r1= 1.30, r2= 1.80, r3= 4.88, r4= 5.38,  &end
#
# 39 LEU HA 52 ALA QB 3.32 
 &rst
  ixpk= 0, nxpk= 0, iat= 598,  -1, r1= 1.30, r2= 1.80, r3= 3.99, r4= 4.49,
 igr2= 821, 822, 823,
 &end
#
# 69 MET HA 72 LYS HG3 3.83 
 &rst
  ixpk= 0, nxpk= 0, iat=1061,1105, r1= 1.30, r2= 1.80, r3= 3.83, r4= 4.33,  &end
#
# 69 MET HA 72 LYS H 4.54 
 &rst
  ixpk= 0, nxpk= 0, iat=1061,1097, r1= 1.30, r2= 1.80, r3= 4.54, r4= 5.04,  &end
#
# 3 GLU HA 4 ALA HA 4.45 
 &rst
  ixpk= 0, nxpk= 0, iat=  39,  54, r1= 1.30, r2= 1.80, r3= 4.45, r4= 4.95,  &end
#
# 4 ALA HA 84 ALA QB 5.27 
 &rst
  ixpk= 0, nxpk= 0, iat=  54,  -1, r1= 1.30, r2= 1.80, r3= 6.33, r4= 6.83,
 igr2=1293,1294,1295,
 &end
#
# 10 LEU HA 81 VAL QG1 4.41 
 &rst
  ixpk= 0, nxpk= 0, iat= 143,  -1, r1= 1.30, r2= 1.80, r3= 5.30, r4= 5.80,
 igr2=1247,1248,1249,
 &end
#
# 38 LEU HA 39 LEU H 2.87 
 &rst
  ixpk= 0, nxpk= 0, iat= 579, 596, r1= 1.30, r2= 1.80, r3= 2.87, r4= 3.37,  &end
#
# 38 LEU HA 38 LEU QD2 3.48 
 &rst
  ixpk= 0, nxpk= 0, iat= 579,  -1, r1= 1.30, r2= 1.80, r3= 4.18, r4= 4.68,
 igr2= 590, 591, 592,
 &end
#
# 4 ALA HA 5 ASP HB2 4.66 
 &rst
  ixpk= 0, nxpk= 0, iat=  54,  66, r1= 1.30, r2= 1.80, r3= 4.66, r4= 5.16,  &end
#
# 58 SER HA 59 PRO HD3 3.12 
 &rst
  ixpk= 0, nxpk= 0, iat= 914, 925, r1= 1.30, r2= 1.80, r3= 3.12, r4= 3.62,  &end
#
# 58 SER HA 59 PRO HD2 2.95 
 &rst
  ixpk= 0, nxpk= 0, iat= 914, 924, r1= 1.30, r2= 1.80, r3= 2.95, r4= 3.45,  &end
#
# 58 SER HA 59 PRO HG2 4.41 
 &rst
  ixpk= 0, nxpk= 0, iat= 914, 927, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,  &end
#
# 74 LEU H 78 ALA HA 3.73 
 &rst
  ixpk= 0, nxpk= 0, iat=1130,1192, r1= 1.30, r2= 1.80, r3= 3.73, r4= 4.23,  &end
#
# 78 ALA HA 79 ILE H 2.92 
 &rst
  ixpk= 0, nxpk= 0, iat=1192,1200, r1= 1.30, r2= 1.80, r3= 2.92, r4= 3.42,  &end
#
# 73 SER HA 78 ALA HA 3.14 
 &rst
  ixpk= 0, nxpk= 0, iat=1121,1192, r1= 1.30, r2= 1.80, r3= 3.14, r4= 3.64,  &end
#
# 73 SER HB2 78 ALA HA 3.84 
 &rst
  ixpk= 0, nxpk= 0, iat=1123,1192, r1= 1.30, r2= 1.80, r3= 3.84, r4= 4.34,  &end
#
# 78 ALA HA 79 ILE QG1 3.99 
 &rst
  ixpk= 0, nxpk= 0, iat=1192,  -1, r1= 1.30, r2= 1.80, r3= 4.48, r4= 4.98,
 igr2=1210,1211,
 &end
#
# 78 ALA HA 79 ILE QG2 4.44 
 &rst
  ixpk= 0, nxpk= 0, iat=1192,  -1, r1= 1.30, r2= 1.80, r3= 5.33, r4= 5.83,
 igr2=1206,1207,1208,
 &end
#
# 59 PRO HD3 60 ALA H 5.04 
 &rst
  ixpk= 0, nxpk= 0, iat= 925, 937, r1= 1.30, r2= 1.80, r3= 5.04, r4= 5.54,  &end
#
# 59 PRO HD2 60 ALA H 4.78 
 &rst
  ixpk= 0, nxpk= 0, iat= 924, 937, r1= 1.30, r2= 1.80, r3= 4.78, r4= 5.28,  &end
#
# 59 PRO HD2 60 ALA QB 5.50 
 &rst
  ixpk= 0, nxpk= 0, iat= 924,  -1, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr2= 941, 942, 943,
 &end
#
# 20 ASN HA 39 LEU QD2 5.09 
 &rst
  ixpk= 0, nxpk= 0, iat= 291,  -1, r1= 1.30, r2= 1.80, r3= 6.11, r4= 6.61,
 igr2= 609, 610, 611,
 &end
#
# 7 PRO HD2 8 GLY H 5.50 
 &rst
  ixpk= 0, nxpk= 0, iat=  99, 112, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
# 20 ASN HA 21 GLU H 3.30 
 &rst
  ixpk= 0, nxpk= 0, iat= 291, 303, r1= 1.30, r2= 1.80, r3= 3.30, r4= 3.80,  &end
#
# 20 ASN HA 39 LEU QD1 3.43 
 &rst
  ixpk= 0, nxpk= 0, iat= 291,  -1, r1= 1.30, r2= 1.80, r3= 4.12, r4= 4.62,
 igr2= 605, 606, 607,
 &end
#
# 86 LYS H 87 PRO HD2 5.50 
 &rst
  ixpk= 0, nxpk= 0, iat=1313,1336, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
# 86 LYS HA 87 PRO HD3 3.86 
 &rst
  ixpk= 0, nxpk= 0, iat=1315,1337, r1= 1.30, r2= 1.80, r3= 3.86, r4= 4.36,  &end
#
# 86 LYS HA 87 PRO HD2 3.69 
 &rst
  ixpk= 0, nxpk= 0, iat=1315,1336, r1= 1.30, r2= 1.80, r3= 3.69, r4= 4.19,  &end
#
# 52 ALA HA 53 PHE H 3.22 
 &rst
  ixpk= 0, nxpk= 0, iat= 819, 827, r1= 1.30, r2= 1.80, r3= 3.22, r4= 3.72,  &end
#
# 40 MET H 52 ALA HA 4.07 
 &rst
  ixpk= 0, nxpk= 0, iat= 615, 819, r1= 1.30, r2= 1.80, r3= 4.07, r4= 4.57,  &end
#
# 51 PHE QE 52 ALA HA 5.00 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 819, r1= 1.30, r2= 1.80, r3= 5.61, r4= 6.11,
 igr1= 807, 811,
 &end
#
# 39 LEU HA 52 ALA HA 3.46 
 &rst
  ixpk= 0, nxpk= 0, iat= 598, 819, r1= 1.30, r2= 1.80, r3= 3.46, r4= 3.96,  &end
#
# 28 PHE H 29 GLY HA2 5.09 
 &rst
  ixpk= 0, nxpk= 0, iat= 410, 432, r1= 1.30, r2= 1.80, r3= 5.09, r4= 5.59,  &end
#
# 29 GLY HA3 34 ILE HG13 4.38 
 &rst
  ixpk= 0, nxpk= 0, iat= 433, 522, r1= 1.30, r2= 1.80, r3= 4.38, r4= 4.88,  &end
#
# 29 GLY HA3 34 ILE QD1 3.90 
 &rst
  ixpk= 0, nxpk= 0, iat= 433,  -1, r1= 1.30, r2= 1.80, r3= 4.68, r4= 5.18,
 igr2= 524, 525, 526,
 &end
#
# 29 GLY HA2 32 GLY H 5.14 
 &rst
  ixpk= 0, nxpk= 0, iat= 432, 480, r1= 1.30, r2= 1.80, r3= 5.14, r4= 5.64,  &end
#
# 29 GLY HA2 34 ILE HG13 4.44 
 &rst
  ixpk= 0, nxpk= 0, iat= 432, 522, r1= 1.30, r2= 1.80, r3= 4.44, r4= 4.94,  &end
#
# 29 GLY HA2 34 ILE QD1 3.95 
 &rst
  ixpk= 0, nxpk= 0, iat= 432,  -1, r1= 1.30, r2= 1.80, r3= 4.74, r4= 5.24,
 igr2= 524, 525, 526,
 &end
#
# 29 GLY HA2 34 ILE HG12 5.11 
 &rst
  ixpk= 0, nxpk= 0, iat= 432, 521, r1= 1.30, r2= 1.80, r3= 5.11, r4= 5.61,  &end
#
# 13 GLY HA3 14 GLY HA2 4.92 
 &rst
  ixpk= 0, nxpk= 0, iat= 202, 208, r1= 1.30, r2= 1.80, r3= 4.92, r4= 5.42,  &end
#
# 50 GLY HA3 51 PHE QD 5.50 
 &rst
  ixpk= 0, nxpk= 0, iat= 793,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2= 805, 813,
 &end
#
# 17 THR QG2 50 GLY HA3 5.39 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 793, r1= 1.30, r2= 1.80, r3= 6.47, r4= 6.97,
 igr1= 252, 253, 254,
 &end
#
# 15 LEU HB2 50 GLY HA3 4.38 
 &rst
  ixpk= 0, nxpk= 0, iat= 217, 793, r1= 1.30, r2= 1.80, r3= 4.38, r4= 4.88,  &end
#
# 15 LEU QD1 50 GLY HA3 5.50 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 793, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr1= 222, 223, 224,
 &end
#
# 14 GLY HA3 79 ILE HA 4.48 
 &rst
  ixpk= 0, nxpk= 0, iat= 209,1202, r1= 1.30, r2= 1.80, r3= 4.48, r4= 4.98,  &end
#
# 14 GLY HA3 79 ILE QG2 5.15 
 &rst
  ixpk= 0, nxpk= 0, iat= 209,  -1, r1= 1.30, r2= 1.80, r3= 6.18, r4= 6.68,
 igr2=1206,1207,1208,
 &end
#
# 74 LEU H 76 GLY HA3 5.50 
 &rst
  ixpk= 0, nxpk= 0, iat=1130,1164, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
# 14 GLY HA2 79 ILE HA 4.81 
 &rst
  ixpk= 0, nxpk= 0, iat= 208,1202, r1= 1.30, r2= 1.80, r3= 4.81, r4= 5.31,  &end
#
# 14 GLY HA2 79 ILE QG2 5.49 
 &rst
  ixpk= 0, nxpk= 0, iat= 208,  -1, r1= 1.30, r2= 1.80, r3= 6.59, r4= 7.09,
 igr2=1206,1207,1208,
 &end
#
# 75 ASP HA 76 GLY HA2 4.32 
 &rst
  ixpk= 0, nxpk= 0, iat=1151,1163, r1= 1.30, r2= 1.80, r3= 4.32, r4= 4.82,  &end
#
# 15 LEU HB3 50 GLY HA2 4.37 
 &rst
  ixpk= 0, nxpk= 0, iat= 218, 792, r1= 1.30, r2= 1.80, r3= 4.37, r4= 4.87,  &end
#
# 15 LEU HB2 50 GLY HA2 4.06 
 &rst
  ixpk= 0, nxpk= 0, iat= 217, 792, r1= 1.30, r2= 1.80, r3= 4.06, r4= 4.56,  &end
#
# 15 LEU QD1 50 GLY HA2 4.89 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 792, r1= 1.30, r2= 1.80, r3= 5.87, r4= 6.37,
 igr1= 222, 223, 224,
 &end
#
# 15 LEU HG 50 GLY HA2 5.28 
 &rst
  ixpk= 0, nxpk= 0, iat= 220, 792, r1= 1.30, r2= 1.80, r3= 5.28, r4= 5.78,  &end
#
# 76 GLY HA3 77 LYS HG2 5.50 
 &rst
  ixpk= 0, nxpk= 0, iat=1164,1175, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
# 8 GLY HA2 10 LEU HG 4.96 
 &rst
  ixpk= 0, nxpk= 0, iat= 114, 148, r1= 1.30, r2= 1.80, r3= 4.96, r4= 5.46,  &end
#
# 48 SER HB2 50 GLY HA2 5.17 
 &rst
  ixpk= 0, nxpk= 0, iat= 759, 792, r1= 1.30, r2= 1.80, r3= 5.17, r4= 5.67,  &end
#
# 8 GLY HA3 59 PRO HB3 4.76 
 &rst
  ixpk= 0, nxpk= 0, iat= 115, 931, r1= 1.30, r2= 1.80, r3= 4.76, r4= 5.26,  &end
#
# 8 GLY HA3 62 ALA QB 4.05 
 &rst
  ixpk= 0, nxpk= 0, iat= 115,  -1, r1= 1.30, r2= 1.80, r3= 4.86, r4= 5.36,
 igr2= 963, 964, 965,
 &end
#
# 7 PRO HA 8 GLY HA2 5.12 
 &rst
  ixpk= 0, nxpk= 0, iat= 108, 114, r1= 1.30, r2= 1.80, r3= 5.12, r4= 5.62,  &end
#
# 8 GLY HA2 59 PRO HB3 4.83 
 &rst
  ixpk= 0, nxpk= 0, iat= 114, 931, r1= 1.30, r2= 1.80, r3= 4.83, r4= 5.33,  &end
#
# 8 GLY HA2 62 ALA QB 3.90 
 &rst
  ixpk= 0, nxpk= 0, iat= 114,  -1, r1= 1.30, r2= 1.80, r3= 4.68, r4= 5.18,
 igr2= 963, 964, 965,
 &end
#
# 32 GLY HA2 34 ILE H 5.50 
 &rst
  ixpk= 0, nxpk= 0, iat= 482, 511, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
# 73 SER HA 74 LEU HB3 4.77 
 &rst
  ixpk= 0, nxpk= 0, iat=1121,1135, r1= 1.30, r2= 1.80, r3= 4.77, r4= 5.27,  &end
#
# 69 MET QE 74 LEU HB3 4.98 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1135, r1= 1.30, r2= 1.80, r3= 5.98, r4= 6.48,
 igr1=1070,1071,1072,
 &end
#
# 27 VAL QG1 74 LEU HB3 5.34 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1135, r1= 1.30, r2= 1.80, r3= 6.41, r4= 6.91,
 igr1= 400, 401, 402,
 &end
#
# 74 LEU HB3 79 ILE QG2 3.63 
 &rst
  ixpk= 0, nxpk= 0, iat=1135,  -1, r1= 1.30, r2= 1.80, r3= 4.36, r4= 4.86,
 igr2=1206,1207,1208,
 &end
#
# 15 LEU QD1 74 LEU HB3 5.50 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1135, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr1= 222, 223, 224,
 &end
#
# 74 LEU HB2 79 ILE QD1 3.75 
 &rst
  ixpk= 0, nxpk= 0, iat=1134,  -1, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,
 igr2=1213,1214,1215,
 &end
#
# 31 TYR HB3 32 GLY HA3 5.34 
 &rst
  ixpk= 0, nxpk= 0, iat= 464, 483, r1= 1.30, r2= 1.80, r3= 5.34, r4= 5.84,  &end
#
# 32 GLY HA3 61 ASP HB3 4.87 
 &rst
  ixpk= 0, nxpk= 0, iat= 483, 952, r1= 1.30, r2= 1.80, r3= 4.87, r4= 5.37,  &end
#
# 32 GLY HA2 33 ARG QB 4.45 
 &rst
  ixpk= 0, nxpk= 0, iat= 482,  -1, r1= 1.30, r2= 1.80, r3= 4.99, r4= 5.49,
 igr2= 491, 492,
 &end
#
# 32 GLY HA2 56 PHE QR 4.56 
 &rst
  ixpk= 0, nxpk= 0, iat= 482,  -1, r1= 1.30, r2= 1.80, r3= 5.75, r4= 6.25,
 igr2= 885, 893, 887, 891,
 &end
#
# 32 GLY HA2 61 ASP HB2 4.52 
 &rst
  ixpk= 0, nxpk= 0, iat= 482, 951, r1= 1.30, r2= 1.80, r3= 4.52, r4= 5.02,  &end
#
# 42 ASP HA 49 ARG HD3 3.98 
 &rst
  ixpk= 0, nxpk= 0, iat= 656, 777, r1= 1.30, r2= 1.80, r3= 3.98, r4= 4.48,  &end
#
# 42 ASP HB2 49 ARG HD3 5.04 
 &rst
  ixpk= 0, nxpk= 0, iat= 658, 777, r1= 1.30, r2= 1.80, r3= 5.04, r4= 5.54,  &end
#
# 42 ASP H 49 ARG HD3 5.08 
 &rst
  ixpk= 0, nxpk= 0, iat= 654, 777, r1= 1.30, r2= 1.80, r3= 5.08, r4= 5.58,  &end
#
# 41 LYS H 49 ARG HD3 5.50 
 &rst
  ixpk= 0, nxpk= 0, iat= 632, 777, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
# 49 ARG HA 49 ARG HD3 5.50 
 &rst
  ixpk= 0, nxpk= 0, iat= 768, 777, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
# 40 MET HB3 49 ARG HD3 5.12 
 &rst
  ixpk= 0, nxpk= 0, iat= 620, 777, r1= 1.30, r2= 1.80, r3= 5.12, r4= 5.62,  &end
#
# 42 ASP H 49 ARG HD2 5.50 
 &rst
  ixpk= 0, nxpk= 0, iat= 654, 776, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
# 42 ASP HA 49 ARG HD2 4.54 
 &rst
  ixpk= 0, nxpk= 0, iat= 656, 776, r1= 1.30, r2= 1.80, r3= 4.54, r4= 5.04,  &end
#
# 41 LYS HA 49 ARG HD2 5.50 
 &rst
  ixpk= 0, nxpk= 0, iat= 634, 776, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
# 38 LEU HB3 53 PHE HB2 3.87 
 &rst
  ixpk= 0, nxpk= 0, iat= 582, 831, r1= 1.30, r2= 1.80, r3= 3.87, r4= 4.37,  &end
#
# 38 LEU HB3 53 PHE H 4.32 
 &rst
  ixpk= 0, nxpk= 0, iat= 582, 827, r1= 1.30, r2= 1.80, r3= 4.32, r4= 4.82,  &end
#
# 38 LEU HB3 53 PHE HB3 4.32 
 &rst
  ixpk= 0, nxpk= 0, iat= 582, 832, r1= 1.30, r2= 1.80, r3= 4.32, r4= 4.82,  &end
#
# 39 LEU HB3 41 LYS HG2 5.47 
 &rst
  ixpk= 0, nxpk= 0, iat= 601, 639, r1= 1.30, r2= 1.80, r3= 5.47, r4= 5.97,  &end
#
# 10 LEU HB3 53 PHE HA 5.35 
 &rst
  ixpk= 0, nxpk= 0, iat= 146, 829, r1= 1.30, r2= 1.80, r3= 5.35, r4= 5.85,  &end
#
# 10 LEU HB3 65 ALA QB 5.50 
 &rst
  ixpk= 0, nxpk= 0, iat= 146,  -1, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr2=1007,1008,1009,
 &end
#
# 10 LEU HB3 10 LEU QD2 4.16 
 &rst
  ixpk= 0, nxpk= 0, iat= 146,  -1, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50,
 igr2= 154, 155, 156,
 &end
#
# 10 LEU HB3 11 PHE H 4.39 
 &rst
  ixpk= 0, nxpk= 0, iat= 146, 160, r1= 1.30, r2= 1.80, r3= 4.39, r4= 4.89,  &end
#
# 10 LEU HB3 82 GLU H 5.50 
 &rst
  ixpk= 0, nxpk= 0, iat= 146,1257, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
# 38 LEU H 38 LEU HB2 3.73 
 &rst
  ixpk= 0, nxpk= 0, iat= 577, 581, r1= 1.30, r2= 1.80, r3= 3.73, r4= 4.23,  &end
#
# 38 LEU HB2 39 LEU HA 4.65 
 &rst
  ixpk= 0, nxpk= 0, iat= 581, 598, r1= 1.30, r2= 1.80, r3= 4.65, r4= 5.15,  &end
#
# 38 LEU HB2 38 LEU QD2 3.53 
 &rst
  ixpk= 0, nxpk= 0, iat= 581,  -1, r1= 1.30, r2= 1.80, r3= 4.24, r4= 4.74,
 igr2= 590, 591, 592,
 &end
#
# 10 LEU HB2 54 VAL H 5.27 
 &rst
  ixpk= 0, nxpk= 0, iat= 145, 847, r1= 1.30, r2= 1.80, r3= 5.27, r4= 5.77,  &end
#
# 10 LEU H 10 LEU HB2 4.19 
 &rst
  ixpk= 0, nxpk= 0, iat= 141, 145, r1= 1.30, r2= 1.80, r3= 4.19, r4= 4.69,  &end
#
# 15 LEU HB3 74 LEU HB2 4.16 
 &rst
  ixpk= 0, nxpk= 0, iat= 218,1134, r1= 1.30, r2= 1.80, r3= 4.16, r4= 4.66,  &end
#
# 10 LEU HB2 83 GLN HA 5.27 
 &rst
  ixpk= 0, nxpk= 0, iat= 145,1274, r1= 1.30, r2= 1.80, r3= 5.27, r4= 5.77,  &end
#
# 21 GLU HA 39 LEU HB3 5.06 
 &rst
  ixpk= 0, nxpk= 0, iat= 305, 601, r1= 1.30, r2= 1.80, r3= 5.06, r4= 5.56,  &end
#
# 39 LEU HB3 41 LYS QE 4.48 
 &rst
  ixpk= 0, nxpk= 0, iat= 601,  -1, r1= 1.30, r2= 1.80, r3= 5.03, r4= 5.53,
 igr2= 645, 646,
 &end
#
# 21 GLU HG2 39 LEU HB3 3.97 
 &rst
  ixpk= 0, nxpk= 0, iat= 310, 601, r1= 1.30, r2= 1.80, r3= 3.97, r4= 4.47,  &end
#
# 39 LEU HB3 39 LEU QD2 4.21 
 &rst
  ixpk= 0, nxpk= 0, iat= 601,  -1, r1= 1.30, r2= 1.80, r3= 5.06, r4= 5.56,
 igr2= 609, 610, 611,
 &end
#
# 39 LEU H 39 LEU HB3 3.37 
 &rst
  ixpk= 0, nxpk= 0, iat= 596, 601, r1= 1.30, r2= 1.80, r3= 3.37, r4= 3.87,  &end
#
# 37 VAL QG1 38 LEU HB2 5.50 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 581, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr1= 567, 568, 569,
 &end
#
# 39 LEU HB2 40 MET H 4.92 
 &rst
  ixpk= 0, nxpk= 0, iat= 600, 615, r1= 1.30, r2= 1.80, r3= 4.92, r4= 5.42,  &end
#
# 21 GLU HA 39 LEU HB2 5.03 
 &rst
  ixpk= 0, nxpk= 0, iat= 305, 600, r1= 1.30, r2= 1.80, r3= 5.03, r4= 5.53,  &end
#
# 39 LEU HB2 41 LYS QE 5.50 
 &rst
  ixpk= 0, nxpk= 0, iat= 600,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2= 645, 646,
 &end
#
# 21 GLU HG3 39 LEU HB2 4.74 
 &rst
  ixpk= 0, nxpk= 0, iat= 311, 600, r1= 1.30, r2= 1.80, r3= 4.74, r4= 5.24,  &end
#
# 21 GLU HG2 39 LEU HB2 4.07 
 &rst
  ixpk= 0, nxpk= 0, iat= 310, 600, r1= 1.30, r2= 1.80, r3= 4.07, r4= 4.57,  &end
#
# 39 LEU HB2 39 LEU QD2 4.17 
 &rst
  ixpk= 0, nxpk= 0, iat= 600,  -1, r1= 1.30, r2= 1.80, r3= 5.01, r4= 5.51,
 igr2= 609, 610, 611,
 &end
#
# 38 LEU HA 39 LEU HB2 5.12 
 &rst
  ixpk= 0, nxpk= 0, iat= 579, 600, r1= 1.30, r2= 1.80, r3= 5.12, r4= 5.62,  &end
#
# 13 GLY HA3 51 PHE HA 3.93 
 &rst
  ixpk= 0, nxpk= 0, iat= 202, 799, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,  &end
#
# 13 GLY HA2 51 PHE HA 5.38 
 &rst
  ixpk= 0, nxpk= 0, iat= 201, 799, r1= 1.30, r2= 1.80, r3= 5.38, r4= 5.88,  &end
#
# 13 GLY HA3 51 PHE HB2 4.15 
 &rst
  ixpk= 0, nxpk= 0, iat= 202, 801, r1= 1.30, r2= 1.80, r3= 4.15, r4= 4.65,  &end
#
# 13 GLY HA3 15 LEU H 4.58 
 &rst
  ixpk= 0, nxpk= 0, iat= 202, 213, r1= 1.30, r2= 1.80, r3= 4.58, r4= 5.08,  &end
#
# 67 ARG H 67 ARG HD3 4.96 
 &rst
  ixpk= 0, nxpk= 0, iat=1023,1034, r1= 1.30, r2= 1.80, r3= 4.96, r4= 5.46,  &end
#
# 64 ASP HA 67 ARG HD3 4.96 
 &rst
  ixpk= 0, nxpk= 0, iat= 993,1034, r1= 1.30, r2= 1.80, r3= 4.96, r4= 5.46,  &end
#
# 67 ARG QB 67 ARG HD3 3.62 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1034, r1= 1.30, r2= 1.80, r3= 4.06, r4= 4.56,
 igr1=1027,1028,
 &end
#
# 67 ARG HA 67 ARG HD3 4.85 
 &rst
  ixpk= 0, nxpk= 0, iat=1025,1034, r1= 1.30, r2= 1.80, r3= 4.85, r4= 5.35,  &end
#
# 63 LYS HA 67 ARG HD3 4.94 
 &rst
  ixpk= 0, nxpk= 0, iat= 971,1034, r1= 1.30, r2= 1.80, r3= 4.94, r4= 5.44,  &end
#
# 33 ARG H 33 ARG QD 4.85 
 &rst
  ixpk= 0, nxpk= 0, iat= 487,  -1, r1= 1.30, r2= 1.80, r3= 5.44, r4= 5.94,
 igr2= 497, 498,
 &end
#
# 67 ARG H 67 ARG HD2 4.89 
 &rst
  ixpk= 0, nxpk= 0, iat=1023,1033, r1= 1.30, r2= 1.80, r3= 4.89, r4= 5.39,  &end
#
# 64 ASP HA 67 ARG HD2 5.06 
 &rst
  ixpk= 0, nxpk= 0, iat= 993,1033, r1= 1.30, r2= 1.80, r3= 5.06, r4= 5.56,  &end
#
# 33 ARG QD 34 ILE H 5.08 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 511, r1= 1.30, r2= 1.80, r3= 5.70, r4= 6.20,
 igr1= 497, 498,
 &end
#
# 43 ARG QB 43 ARG QD 3.46 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.36, r4= 4.86,
 igr1= 670, 671,
 igr2= 676, 677,
 &end
#
# 43 ARG QG 43 ARG QD 2.97 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 3.74, r4= 4.24,
 igr1= 673, 674,
 igr2= 676, 677,
 &end
#
# 15 LEU HB2 51 PHE H 5.50 
 &rst
  ixpk= 0, nxpk= 0, iat= 217, 797, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
# 42 ASP HB3 43 ARG H 4.89 
 &rst
  ixpk= 0, nxpk= 0, iat= 659, 666, r1= 1.30, r2= 1.80, r3= 4.89, r4= 5.39,  &end
#
# 42 ASP H 42 ASP HB3 3.52 
 &rst
  ixpk= 0, nxpk= 0, iat= 654, 659, r1= 1.30, r2= 1.80, r3= 3.52, r4= 4.02,  &end
#
# 42 ASP HB3 45 THR HA 5.08 
 &rst
  ixpk= 0, nxpk= 0, iat= 659, 707, r1= 1.30, r2= 1.80, r3= 5.08, r4= 5.58,  &end
#
# 41 LYS HA 42 ASP HB3 5.50 
 &rst
  ixpk= 0, nxpk= 0, iat= 634, 659, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
# 42 ASP HB2 43 ARG H 4.52 
 &rst
  ixpk= 0, nxpk= 0, iat= 658, 666, r1= 1.30, r2= 1.80, r3= 4.52, r4= 5.02,  &end
#
# 42 ASP H 42 ASP HB2 3.45 
 &rst
  ixpk= 0, nxpk= 0, iat= 654, 658, r1= 1.30, r2= 1.80, r3= 3.45, r4= 3.95,  &end
#
# 41 LYS HA 42 ASP HB2 4.71 
 &rst
  ixpk= 0, nxpk= 0, iat= 634, 658, r1= 1.30, r2= 1.80, r3= 4.71, r4= 5.21,  &end
#
# 41 LYS HB3 42 ASP HB2 5.44 
 &rst
  ixpk= 0, nxpk= 0, iat= 637, 658, r1= 1.30, r2= 1.80, r3= 5.44, r4= 5.94,  &end
#
# 72 LYS HA 72 LYS HE3 5.21 
 &rst
  ixpk= 0, nxpk= 0, iat=1099,1111, r1= 1.30, r2= 1.80, r3= 5.21, r4= 5.71,  &end
#
# 72 LYS HG3 72 LYS HE3 3.50 
 &rst
  ixpk= 0, nxpk= 0, iat=1105,1111, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
# 72 LYS H 72 LYS HE3 5.50 
 &rst
  ixpk= 0, nxpk= 0, iat=1097,1111, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
# 72 LYS HG2 72 LYS HE2 4.21 
 &rst
  ixpk= 0, nxpk= 0, iat=1104,1110, r1= 1.30, r2= 1.80, r3= 4.21, r4= 4.71,  &end
#
# 67 ARG QB 68 ASP HB3 5.48 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1052, r1= 1.30, r2= 1.80, r3= 6.15, r4= 6.65,
 igr1=1027,1028,
 &end
#
# 9 LYS QD 53 PHE HB3 4.81 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 832, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr1= 129, 130,
 &end
#
# 38 LEU HB2 53 PHE HB3 4.40 
 &rst
  ixpk= 0, nxpk= 0, iat= 581, 832, r1= 1.30, r2= 1.80, r3= 4.40, r4= 4.90,  &end
#
# 38 LEU H 53 PHE HB3 4.94 
 &rst
  ixpk= 0, nxpk= 0, iat= 577, 832, r1= 1.30, r2= 1.80, r3= 4.94, r4= 5.44,  &end
#
# 38 LEU HB2 53 PHE HB2 4.16 
 &rst
  ixpk= 0, nxpk= 0, iat= 581, 831, r1= 1.30, r2= 1.80, r3= 4.16, r4= 4.66,  &end
#
# 38 LEU QD1 53 PHE HB2 4.88 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 831, r1= 1.30, r2= 1.80, r3= 5.86, r4= 6.36,
 igr1= 586, 587, 588,
 &end
#
# 68 ASP H 68 ASP HB2 3.34 
 &rst
  ixpk= 0, nxpk= 0, iat=1047,1051, r1= 1.30, r2= 1.80, r3= 3.34, r4= 3.84,  &end
#
# 31 TYR QE 68 ASP HB2 4.10 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1051, r1= 1.30, r2= 1.80, r3= 4.60, r4= 5.10,
 igr1= 469, 474,
 &end
#
# 68 ASP HB2 69 MET QG 4.52 
 &rst
  ixpk= 0, nxpk= 0, iat=1051,  -1, r1= 1.30, r2= 1.80, r3= 5.07, r4= 5.57,
 igr2=1066,1067,
 &end
#
# 68 ASP HB2 69 MET HB3 5.30 
 &rst
  ixpk= 0, nxpk= 0, iat=1051,1064, r1= 1.30, r2= 1.80, r3= 5.30, r4= 5.80,  &end
#
# 67 ARG QB 68 ASP HB2 5.15 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1051, r1= 1.30, r2= 1.80, r3= 5.78, r4= 6.28,
 igr1=1027,1028,
 &end
#
# 5 ASP HB2 83 GLN HE22 5.50 
 &rst
  ixpk= 0, nxpk= 0, iat=  66,1284, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
# 16 ASN HD21 77 LYS QE 5.50 
 &rst
  ixpk= 0, nxpk= 0, iat= 242,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=1181,1182,
 &end
#
# 16 ASN HA 77 LYS QE 5.10 
 &rst
  ixpk= 0, nxpk= 0, iat= 234,  -1, r1= 1.30, r2= 1.80, r3= 5.72, r4= 6.22,
 igr2=1181,1182,
 &end
#
# 39 LEU H 41 LYS QE 5.34 
 &rst
  ixpk= 0, nxpk= 0, iat= 596,  -1, r1= 1.30, r2= 1.80, r3= 5.99, r4= 6.49,
 igr2= 645, 646,
 &end
#
# 41 LYS QE 46 ASN HA 5.50 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 721, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 645, 646,
 &end
#
# 41 LYS QE 48 SER HA 5.50 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 757, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 645, 646,
 &end
#
# 41 LYS HA 41 LYS QE 5.50 
 &rst
  ixpk= 0, nxpk= 0, iat= 634,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2= 645, 646,
 &end
#
# 11 PHE HA 53 PHE HB3 5.33 
 &rst
  ixpk= 0, nxpk= 0, iat= 162, 832, r1= 1.30, r2= 1.80, r3= 5.33, r4= 5.83,  &end
#
# 9 LYS HG2 53 PHE HB3 4.52 
 &rst
  ixpk= 0, nxpk= 0, iat= 126, 832, r1= 1.30, r2= 1.80, r3= 4.52, r4= 5.02,  &end
#
# 24 LEU HB3 28 PHE QD 5.46 
 &rst
  ixpk= 0, nxpk= 0, iat= 355,  -1, r1= 1.30, r2= 1.80, r3= 6.13, r4= 6.63,
 igr2= 418, 426,
 &end
#
# 23 ALA H 24 LEU HB3 5.00 
 &rst
  ixpk= 0, nxpk= 0, iat= 340, 355, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50,  &end
#
# 21 GLU HA 24 LEU HB3 3.91 
 &rst
  ixpk= 0, nxpk= 0, iat= 305, 355, r1= 1.30, r2= 1.80, r3= 3.91, r4= 4.41,  &end
#
# 21 GLU HG3 24 LEU HB3 5.50 
 &rst
  ixpk= 0, nxpk= 0, iat= 311, 355, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
# 24 LEU HB2 28 PHE QE 5.50 
 &rst
  ixpk= 0, nxpk= 0, iat= 354,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2= 420, 424,
 &end
#
# 21 GLU HA 24 LEU HB2 4.19 
 &rst
  ixpk= 0, nxpk= 0, iat= 305, 354, r1= 1.30, r2= 1.80, r3= 4.19, r4= 4.69,  &end
#
# 24 LEU HB2 24 LEU QD1 3.76 
 &rst
  ixpk= 0, nxpk= 0, iat= 354,  -1, r1= 1.30, r2= 1.80, r3= 4.52, r4= 5.02,
 igr2= 359, 360, 361,
 &end
#
# 11 PHE QD 80 LYS QE 5.50 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1= 168, 176,
 igr2=1232,1233,
 &end
#
# 80 LYS QE 82 GLU QG 4.12 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.19, r4= 5.69,
 igr1=1232,1233,
 igr2=1264,1265,
 &end
#
# 80 LYS QE 82 GLU HB3 3.85 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1262, r1= 1.30, r2= 1.80, r3= 4.32, r4= 4.82,
 igr1=1232,1233,
 &end
#
# 80 LYS HG2 80 LYS QE 4.18 
 &rst
  ixpk= 0, nxpk= 0, iat=1226,  -1, r1= 1.30, r2= 1.80, r3= 4.69, r4= 5.19,
 igr2=1232,1233,
 &end
#
# 45 THR HB 47 LYS QE 4.51 
 &rst
  ixpk= 0, nxpk= 0, iat= 709,  -1, r1= 1.30, r2= 1.80, r3= 5.06, r4= 5.56,
 igr2= 746, 747,
 &end
#
# 63 LYS HG2 63 LYS QE 3.79 
 &rst
  ixpk= 0, nxpk= 0, iat= 976,  -1, r1= 1.30, r2= 1.80, r3= 4.25, r4= 4.75,
 igr2= 982, 983,
 &end
#
# 76 GLY HA3 77 LYS QE 5.50 
 &rst
  ixpk= 0, nxpk= 0, iat=1164,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=1181,1182,
 &end
#
# 60 ALA HA 63 LYS QE 4.37 
 &rst
  ixpk= 0, nxpk= 0, iat= 939,  -1, r1= 1.30, r2= 1.80, r3= 4.91, r4= 5.41,
 igr2= 982, 983,
 &end
#
# 76 GLY HA2 77 LYS QE 4.65 
 &rst
  ixpk= 0, nxpk= 0, iat=1163,  -1, r1= 1.30, r2= 1.80, r3= 5.22, r4= 5.72,
 igr2=1181,1182,
 &end
#
# 63 LYS QE 67 ARG HD3 3.66 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1034, r1= 1.30, r2= 1.80, r3= 4.11, r4= 4.61,
 igr1= 982, 983,
 &end
#
# 77 LYS HB3 77 LYS QE 4.60 
 &rst
  ixpk= 0, nxpk= 0, iat=1173,  -1, r1= 1.30, r2= 1.80, r3= 5.16, r4= 5.66,
 igr2=1181,1182,
 &end
#
# 63 LYS QB 63 LYS QE 3.91 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.93, r4= 5.43,
 igr1= 973, 974,
 igr2= 982, 983,
 &end
#
# 5 ASP H 86 LYS QE 5.50 
 &rst
  ixpk= 0, nxpk= 0, iat=  62,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=1326,1327,
 &end
#
# 5 ASP HB3 86 LYS QE 3.83 
 &rst
  ixpk= 0, nxpk= 0, iat=  67,  -1, r1= 1.30, r2= 1.80, r3= 4.30, r4= 4.80,
 igr2=1326,1327,
 &end
#
# 3 GLU QG 86 LYS QE 3.82 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.81, r4= 5.31,
 igr1=  44,  45,
 igr2=1326,1327,
 &end
#
# 3 GLU HB3 86 LYS QE 3.68 
 &rst
  ixpk= 0, nxpk= 0, iat=  42,  -1, r1= 1.30, r2= 1.80, r3= 4.13, r4= 4.63,
 igr2=1326,1327,
 &end
#
# 86 LYS QD 86 LYS QE 2.98 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 3.75, r4= 4.25,
 igr1=1323,1324,
 igr2=1326,1327,
 &end
#
# 86 LYS HG3 86 LYS QE 3.58 
 &rst
  ixpk= 0, nxpk= 0, iat=1321,  -1, r1= 1.30, r2= 1.80, r3= 4.02, r4= 4.52,
 igr2=1326,1327,
 &end
#
# 3 GLU HB2 86 LYS QE 3.77 
 &rst
  ixpk= 0, nxpk= 0, iat=  41,  -1, r1= 1.30, r2= 1.80, r3= 4.23, r4= 4.73,
 igr2=1326,1327,
 &end
#
# 30 LYS QE 31 TYR QE 5.09 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.41, r4= 6.91,
 igr1= 450, 451,
 igr2= 469, 474,
 &end
#
# 30 LYS QE 31 TYR QD 5.50 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1= 450, 451,
 igr2= 467, 476,
 &end
#
# 9 LYS HA 9 LYS HE3 5.38 
 &rst
  ixpk= 0, nxpk= 0, iat= 121, 133, r1= 1.30, r2= 1.80, r3= 5.38, r4= 5.88,  &end
#
# 9 LYS HB3 9 LYS HE3 5.16 
 &rst
  ixpk= 0, nxpk= 0, iat= 124, 133, r1= 1.30, r2= 1.80, r3= 5.16, r4= 5.66,  &end
#
# 51 PHE HB2 52 ALA H 3.94 
 &rst
  ixpk= 0, nxpk= 0, iat= 801, 817, r1= 1.30, r2= 1.80, r3= 3.94, r4= 4.44,  &end
#
# 51 PHE HB2 52 ALA HA 5.50 
 &rst
  ixpk= 0, nxpk= 0, iat= 801, 819, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
# 51 PHE HB2 52 ALA QB 5.50 
 &rst
  ixpk= 0, nxpk= 0, iat= 801,  -1, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr2= 821, 822, 823,
 &end
#
# 9 LYS HG3 9 LYS HE2 3.95 
 &rst
  ixpk= 0, nxpk= 0, iat= 127, 132, r1= 1.30, r2= 1.80, r3= 3.95, r4= 4.45,  &end
#
# 9 LYS HG2 9 LYS HE2 3.80 
 &rst
  ixpk= 0, nxpk= 0, iat= 126, 132, r1= 1.30, r2= 1.80, r3= 3.80, r4= 4.30,  &end
#
# 13 GLY HA3 51 PHE HB3 5.11 
 &rst
  ixpk= 0, nxpk= 0, iat= 202, 802, r1= 1.30, r2= 1.80, r3= 5.11, r4= 5.61,  &end
#
# 13 GLY H 51 PHE HB2 5.50 
 &rst
  ixpk= 0, nxpk= 0, iat= 199, 801, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
# 11 PHE QB 12 ILE H 4.89 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 180, r1= 1.30, r2= 1.80, r3= 5.49, r4= 5.99,
 igr1= 164, 165,
 &end
#
# 11 PHE QB 53 PHE QE 4.65 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.86, r4= 6.36,
 igr1= 164, 165,
 igr2= 837, 841,
 &end
#
# 11 PHE QB 53 PHE HA 5.36 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 829, r1= 1.30, r2= 1.80, r3= 6.02, r4= 6.52,
 igr1= 164, 165,
 &end
#
# 10 LEU HA 11 PHE QB 5.07 
 &rst
  ixpk= 0, nxpk= 0, iat= 143,  -1, r1= 1.30, r2= 1.80, r3= 5.69, r4= 6.19,
 igr2= 164, 165,
 &end
#
# 11 PHE QB 82 GLU HB3 4.48 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1262, r1= 1.30, r2= 1.80, r3= 5.03, r4= 5.53,
 igr1= 164, 165,
 &end
#
# 11 PHE QB 53 PHE QD 4.51 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.68, r4= 6.18,
 igr1= 164, 165,
 igr2= 835, 843,
 &end
#
# 56 PHE HB3 62 ALA HA 5.19 
 &rst
  ixpk= 0, nxpk= 0, iat= 882, 961, r1= 1.30, r2= 1.80, r3= 5.19, r4= 5.69,  &end
#
# 56 PHE HB3 62 ALA QB 4.26 
 &rst
  ixpk= 0, nxpk= 0, iat= 882,  -1, r1= 1.30, r2= 1.80, r3= 5.12, r4= 5.62,
 igr2= 963, 964, 965,
 &end
#
# 35 VAL QG2 56 PHE HB2 5.50 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 881, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr1= 540, 541, 542,
 &end
#
# 31 TYR QE 64 ASP HB3 5.39 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 996, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55,
 igr1= 469, 474,
 &end
#
# 64 ASP HB3 65 ALA HA 5.50 
 &rst
  ixpk= 0, nxpk= 0, iat= 996,1005, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
# 63 LYS QB 64 ASP HB3 4.74 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 996, r1= 1.30, r2= 1.80, r3= 5.32, r4= 5.82,
 igr1= 973, 974,
 &end
#
# 64 ASP HB3 65 ALA QB 4.98 
 &rst
  ixpk= 0, nxpk= 0, iat= 996,  -1, r1= 1.30, r2= 1.80, r3= 5.98, r4= 6.48,
 igr2=1007,1008,1009,
 &end
#
# 19 THR HA 20 ASN HB2 5.31 
 &rst
  ixpk= 0, nxpk= 0, iat= 277, 293, r1= 1.30, r2= 1.80, r3= 5.31, r4= 5.81,  &end
#
# 19 THR QG2 20 ASN HB2 5.38 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 293, r1= 1.30, r2= 1.80, r3= 6.46, r4= 6.96,
 igr1= 281, 282, 283,
 &end
#
# 20 ASN HB2 39 LEU QD2 5.50 
 &rst
  ixpk= 0, nxpk= 0, iat= 293,  -1, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr2= 609, 610, 611,
 &end
#
# 20 ASN HB2 39 LEU QD1 4.72 
 &rst
  ixpk= 0, nxpk= 0, iat= 293,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr2= 605, 606, 607,
 &end
#
# 56 PHE HB2 58 SER H 4.50 
 &rst
  ixpk= 0, nxpk= 0, iat= 881, 912, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
# 58 SER QB 61 ASP HB3 4.53 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 952, r1= 1.30, r2= 1.80, r3= 5.08, r4= 5.58,
 igr1= 916, 917,
 &end
#
# 63 LYS H 64 ASP HB2 5.17 
 &rst
  ixpk= 0, nxpk= 0, iat= 969, 995, r1= 1.30, r2= 1.80, r3= 5.17, r4= 5.67,  &end
#
# 64 ASP H 64 ASP HB2 3.34 
 &rst
  ixpk= 0, nxpk= 0, iat= 991, 995, r1= 1.30, r2= 1.80, r3= 3.34, r4= 3.84,  &end
#
# 63 LYS QB 64 ASP HB2 4.92 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 995, r1= 1.30, r2= 1.80, r3= 5.52, r4= 6.02,
 igr1= 973, 974,
 &end
#
# 15 LEU QD1 79 ILE HB 5.50 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1204, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr1= 222, 223, 224,
 &end
#
# 79 ILE HB 81 VAL QG2 4.84 
 &rst
  ixpk= 0, nxpk= 0, iat=1204,  -1, r1= 1.30, r2= 1.80, r3= 5.81, r4= 6.31,
 igr2=1251,1252,1253,
 &end
#
# 79 ILE HB 80 LYS HA 4.95 
 &rst
  ixpk= 0, nxpk= 0, iat=1204,1221, r1= 1.30, r2= 1.80, r3= 4.95, r4= 5.45,  &end
#
# 79 ILE HB 80 LYS HB2 5.00 
 &rst
  ixpk= 0, nxpk= 0, iat=1204,1223, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50,  &end
#
# 20 ASN HB3 39 LEU QD2 5.50 
 &rst
  ixpk= 0, nxpk= 0, iat= 294,  -1, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr2= 609, 610, 611,
 &end
#
# 20 ASN HB3 22 LYS H 4.24 
 &rst
  ixpk= 0, nxpk= 0, iat= 294, 318, r1= 1.30, r2= 1.80, r3= 4.24, r4= 4.74,  &end
#
# 20 ASN HB2 21 GLU H 3.49 
 &rst
  ixpk= 0, nxpk= 0, iat= 293, 303, r1= 1.30, r2= 1.80, r3= 3.49, r4= 3.99,  &end
#
# 20 ASN HB2 22 LYS H 4.44 
 &rst
  ixpk= 0, nxpk= 0, iat= 293, 318, r1= 1.30, r2= 1.80, r3= 4.44, r4= 4.94,  &end
#
# 20 ASN HB2 21 GLU HB3 5.42 
 &rst
  ixpk= 0, nxpk= 0, iat= 293, 308, r1= 1.30, r2= 1.80, r3= 5.42, r4= 5.92,  &end
#
# 32 GLY HA3 61 ASP HB2 4.49 
 &rst
  ixpk= 0, nxpk= 0, iat= 483, 951, r1= 1.30, r2= 1.80, r3= 4.49, r4= 4.99,  &end
#
# 58 SER QB 61 ASP HB2 4.57 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 951, r1= 1.30, r2= 1.80, r3= 5.13, r4= 5.63,
 igr1= 916, 917,
 &end
#
# 56 PHE HB3 61 ASP HB2 4.93 
 &rst
  ixpk= 0, nxpk= 0, iat= 882, 951, r1= 1.30, r2= 1.80, r3= 4.93, r4= 5.43,  &end
#
# 61 ASP HB2 62 ALA HA 5.11 
 &rst
  ixpk= 0, nxpk= 0, iat= 951, 961, r1= 1.30, r2= 1.80, r3= 5.11, r4= 5.61,  &end
#
# 34 ILE HB 36 GLU H 4.85 
 &rst
  ixpk= 0, nxpk= 0, iat= 515, 546, r1= 1.30, r2= 1.80, r3= 4.85, r4= 5.35,  &end
#
# 25 GLU HG2 34 ILE HB 5.31 
 &rst
  ixpk= 0, nxpk= 0, iat= 376, 515, r1= 1.30, r2= 1.80, r3= 5.31, r4= 5.81,  &end
#
# 16 ASN HB3 75 ASP HB3 4.40 
 &rst
  ixpk= 0, nxpk= 0, iat= 237,1154, r1= 1.30, r2= 1.80, r3= 4.40, r4= 4.90,  &end
#
# 16 ASN HB2 75 ASP HB3 4.16 
 &rst
  ixpk= 0, nxpk= 0, iat= 236,1154, r1= 1.30, r2= 1.80, r3= 4.16, r4= 4.66,  &end
#
# 18 GLU HG3 75 ASP HB3 5.50 
 &rst
  ixpk= 0, nxpk= 0, iat= 268,1154, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
# 74 LEU HG 75 ASP HB3 5.50 
 &rst
  ixpk= 0, nxpk= 0, iat=1137,1154, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
# 74 LEU HB2 75 ASP HB3 5.37 
 &rst
  ixpk= 0, nxpk= 0, iat=1134,1154, r1= 1.30, r2= 1.80, r3= 5.37, r4= 5.87,  &end
#
# 16 ASN HB3 75 ASP HB2 4.49 
 &rst
  ixpk= 0, nxpk= 0, iat= 237,1153, r1= 1.30, r2= 1.80, r3= 4.49, r4= 4.99,  &end
#
# 74 LEU HG 75 ASP HB2 4.91 
 &rst
  ixpk= 0, nxpk= 0, iat=1137,1153, r1= 1.30, r2= 1.80, r3= 4.91, r4= 5.41,  &end
#
# 74 LEU HB2 75 ASP HB2 5.31 
 &rst
  ixpk= 0, nxpk= 0, iat=1134,1153, r1= 1.30, r2= 1.80, r3= 5.31, r4= 5.81,  &end
#
# 16 ASN HA 75 ASP HB2 5.50 
 &rst
  ixpk= 0, nxpk= 0, iat= 234,1153, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
# 16 ASN HB2 75 ASP HB2 4.30 
 &rst
  ixpk= 0, nxpk= 0, iat= 236,1153, r1= 1.30, r2= 1.80, r3= 4.30, r4= 4.80,  &end
#
# 74 LEU QD1 75 ASP HB2 5.41 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1153, r1= 1.30, r2= 1.80, r3= 6.50, r4= 7.00,
 igr1=1139,1140,1141,
 &end
#
# 89 PHE H 89 PHE QB 4.14 
 &rst
  ixpk= 0, nxpk= 0, iat=1360,  -1, r1= 1.30, r2= 1.80, r3= 4.65, r4= 5.15,
 igr2=1364,1365,
 &end
#
# 70 ASN H 70 ASN HB3 3.31 
 &rst
  ixpk= 0, nxpk= 0, iat=1076,1081, r1= 1.30, r2= 1.80, r3= 3.31, r4= 3.81,  &end
#
# 67 ARG HA 70 ASN HB3 5.50 
 &rst
  ixpk= 0, nxpk= 0, iat=1025,1081, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
# 70 ASN HB3 81 VAL QG1 4.96 
 &rst
  ixpk= 0, nxpk= 0, iat=1081,  -1, r1= 1.30, r2= 1.80, r3= 5.96, r4= 6.46,
 igr2=1247,1248,1249,
 &end
#
# 66 ALA QB 70 ASN HB3 5.46 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1081, r1= 1.30, r2= 1.80, r3= 6.56, r4= 7.06,
 igr1=1017,1018,1019,
 &end
#
# 16 ASN HB3 18 GLU HB2 5.00 
 &rst
  ixpk= 0, nxpk= 0, iat= 237, 264, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50,  &end
#
# 16 ASN HB3 77 LYS HG2 4.38 
 &rst
  ixpk= 0, nxpk= 0, iat= 237,1175, r1= 1.30, r2= 1.80, r3= 4.38, r4= 4.88,  &end
#
# 31 TYR HB3 61 ASP HB2 5.22 
 &rst
  ixpk= 0, nxpk= 0, iat= 464, 951, r1= 1.30, r2= 1.80, r3= 5.22, r4= 5.72,  &end
#
# 10 LEU QD1 31 TYR HB3 5.50 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 464, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr1= 150, 151, 152,
 &end
#
# 31 TYR HB2 56 PHE QR 4.69 
 &rst
  ixpk= 0, nxpk= 0, iat= 463,  -1, r1= 1.30, r2= 1.80, r3= 5.91, r4= 6.41,
 igr2= 885, 893, 887, 891,
 &end
#
# 70 ASN H 70 ASN HB2 3.09 
 &rst
  ixpk= 0, nxpk= 0, iat=1076,1080, r1= 1.30, r2= 1.80, r3= 3.09, r4= 3.59,  &end
#
# 66 ALA QB 70 ASN HB2 5.01 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1080, r1= 1.30, r2= 1.80, r3= 6.02, r4= 6.52,
 igr1=1017,1018,1019,
 &end
#
# 70 ASN HB2 71 GLY H 4.97 
 &rst
  ixpk= 0, nxpk= 0, iat=1080,1090, r1= 1.30, r2= 1.80, r3= 4.97, r4= 5.47,  &end
#
# 70 ASN HB2 81 VAL H 4.66 
 &rst
  ixpk= 0, nxpk= 0, iat=1080,1241, r1= 1.30, r2= 1.80, r3= 4.66, r4= 5.16,  &end
#
# 70 ASN HB2 81 VAL HB 4.03 
 &rst
  ixpk= 0, nxpk= 0, iat=1080,1245, r1= 1.30, r2= 1.80, r3= 4.03, r4= 4.53,  &end
#
# 70 ASN HB2 81 VAL QG1 5.04 
 &rst
  ixpk= 0, nxpk= 0, iat=1080,  -1, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55,
 igr2=1247,1248,1249,
 &end
#
# 16 ASN HB2 77 LYS HA 4.79 
 &rst
  ixpk= 0, nxpk= 0, iat= 236,1170, r1= 1.30, r2= 1.80, r3= 4.79, r4= 5.29,  &end
#
# 16 ASN HB2 77 LYS QE 5.50 
 &rst
  ixpk= 0, nxpk= 0, iat= 236,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=1181,1182,
 &end
#
# 15 LEU HA 16 ASN HB2 4.74 
 &rst
  ixpk= 0, nxpk= 0, iat= 215, 236, r1= 1.30, r2= 1.80, r3= 4.74, r4= 5.24,  &end
#
# 16 ASN HB2 77 LYS HG2 4.04 
 &rst
  ixpk= 0, nxpk= 0, iat= 236,1175, r1= 1.30, r2= 1.80, r3= 4.04, r4= 4.54,  &end
#
# 12 ILE H 12 ILE HB 3.95 
 &rst
  ixpk= 0, nxpk= 0, iat= 180, 184, r1= 1.30, r2= 1.80, r3= 3.95, r4= 4.45,  &end
#
# 12 ILE HB 28 PHE QE 5.50 
 &rst
  ixpk= 0, nxpk= 0, iat= 184,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2= 420, 424,
 &end
#
# 12 ILE HB 51 PHE HA 5.07 
 &rst
  ixpk= 0, nxpk= 0, iat= 184, 799, r1= 1.30, r2= 1.80, r3= 5.07, r4= 5.57,  &end
#
# 11 PHE HA 12 ILE HB 4.84 
 &rst
  ixpk= 0, nxpk= 0, iat= 162, 184, r1= 1.30, r2= 1.80, r3= 4.84, r4= 5.34,  &end
#
# 12 ILE HB 15 LEU QD1 4.42 
 &rst
  ixpk= 0, nxpk= 0, iat= 184,  -1, r1= 1.30, r2= 1.80, r3= 5.31, r4= 5.81,
 igr2= 222, 223, 224,
 &end
#
# 12 ILE HB 12 ILE QD1 4.17 
 &rst
  ixpk= 0, nxpk= 0, iat= 184,  -1, r1= 1.30, r2= 1.80, r3= 5.01, r4= 5.51,
 igr2= 193, 194, 195,
 &end
#
# 12 ILE HB 52 ALA H 4.07 
 &rst
  ixpk= 0, nxpk= 0, iat= 184, 817, r1= 1.30, r2= 1.80, r3= 4.07, r4= 4.57,  &end
#
# 12 ILE HB 15 LEU HG 4.86 
 &rst
  ixpk= 0, nxpk= 0, iat= 184, 220, r1= 1.30, r2= 1.80, r3= 4.86, r4= 5.36,  &end
#
# 41 LYS HB2 46 ASN HB3 5.26 
 &rst
  ixpk= 0, nxpk= 0, iat= 636, 724, r1= 1.30, r2= 1.80, r3= 5.26, r4= 5.76,  &end
#
# 16 ASN HB2 77 LYS HB2 4.68 
 &rst
  ixpk= 0, nxpk= 0, iat= 236,1172, r1= 1.30, r2= 1.80, r3= 4.68, r4= 5.18,  &end
#
# 28 PHE HB3 65 ALA QB 5.08 
 &rst
  ixpk= 0, nxpk= 0, iat= 415,  -1, r1= 1.30, r2= 1.80, r3= 6.10, r4= 6.60,
 igr2=1007,1008,1009,
 &end
#
# 28 PHE HB3 34 ILE QD1 3.78 
 &rst
  ixpk= 0, nxpk= 0, iat= 415,  -1, r1= 1.30, r2= 1.80, r3= 4.54, r4= 5.04,
 igr2= 524, 525, 526,
 &end
#
# 28 PHE HB2 34 ILE QD1 3.85 
 &rst
  ixpk= 0, nxpk= 0, iat= 414,  -1, r1= 1.30, r2= 1.80, r3= 4.62, r4= 5.12,
 igr2= 524, 525, 526,
 &end
#
# 21 GLU H 21 GLU HG3 4.36 
 &rst
  ixpk= 0, nxpk= 0, iat= 303, 311, r1= 1.30, r2= 1.80, r3= 4.36, r4= 4.86,  &end
#
# 21 GLU HG3 39 LEU QD1 4.12 
 &rst
  ixpk= 0, nxpk= 0, iat= 311,  -1, r1= 1.30, r2= 1.80, r3= 4.95, r4= 5.45,
 igr2= 605, 606, 607,
 &end
#
# 21 GLU HG2 22 LYS H 5.30 
 &rst
  ixpk= 0, nxpk= 0, iat= 310, 318, r1= 1.30, r2= 1.80, r3= 5.30, r4= 5.80,  &end
#
# 21 GLU HA 21 GLU HG2 3.84 
 &rst
  ixpk= 0, nxpk= 0, iat= 305, 310, r1= 1.30, r2= 1.80, r3= 3.84, r4= 4.34,  &end
#
# 20 ASN HB3 21 GLU HG2 5.50 
 &rst
  ixpk= 0, nxpk= 0, iat= 294, 310, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
# 21 GLU HG2 39 LEU QD1 4.25 
 &rst
  ixpk= 0, nxpk= 0, iat= 310,  -1, r1= 1.30, r2= 1.80, r3= 5.10, r4= 5.60,
 igr2= 605, 606, 607,
 &end
#
# 21 GLU HG2 24 LEU QD1 5.50 
 &rst
  ixpk= 0, nxpk= 0, iat= 310,  -1, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr2= 359, 360, 361,
 &end
#
# 21 GLU H 21 GLU HG2 4.23 
 &rst
  ixpk= 0, nxpk= 0, iat= 303, 310, r1= 1.30, r2= 1.80, r3= 4.23, r4= 4.73,  &end
#
# 21 GLU HG2 39 LEU H 4.97 
 &rst
  ixpk= 0, nxpk= 0, iat= 310, 596, r1= 1.30, r2= 1.80, r3= 4.97, r4= 5.47,  &end
#
# 21 GLU HG3 39 LEU H 4.83 
 &rst
  ixpk= 0, nxpk= 0, iat= 311, 596, r1= 1.30, r2= 1.80, r3= 4.83, r4= 5.33,  &end
#
# 20 ASN HA 21 GLU HG2 5.50 
 &rst
  ixpk= 0, nxpk= 0, iat= 291, 310, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
# 36 GLU HG3 37 VAL HA 5.46 
 &rst
  ixpk= 0, nxpk= 0, iat= 554, 563, r1= 1.30, r2= 1.80, r3= 5.46, r4= 5.96,  &end
#
# 36 GLU HG2 37 VAL H 4.11 
 &rst
  ixpk= 0, nxpk= 0, iat= 553, 561, r1= 1.30, r2= 1.80, r3= 4.11, r4= 4.61,  &end
#
# 36 GLU H 36 GLU HG2 5.17 
 &rst
  ixpk= 0, nxpk= 0, iat= 546, 553, r1= 1.30, r2= 1.80, r3= 5.17, r4= 5.67,  &end
#
# 36 GLU HA 36 GLU HG2 3.99 
 &rst
  ixpk= 0, nxpk= 0, iat= 548, 553, r1= 1.30, r2= 1.80, r3= 3.99, r4= 4.49,  &end
#
# 36 GLU HG2 38 LEU HG 4.88 
 &rst
  ixpk= 0, nxpk= 0, iat= 553, 584, r1= 1.30, r2= 1.80, r3= 4.88, r4= 5.38,  &end
#
# 36 GLU HG2 38 LEU QD1 5.10 
 &rst
  ixpk= 0, nxpk= 0, iat= 553,  -1, r1= 1.30, r2= 1.80, r3= 6.12, r4= 6.62,
 igr2= 586, 587, 588,
 &end
#
# 36 GLU HG2 37 VAL HA 5.41 
 &rst
  ixpk= 0, nxpk= 0, iat= 553, 563, r1= 1.30, r2= 1.80, r3= 5.41, r4= 5.91,  &end
#
# 36 GLU HG2 55 THR HB 5.10 
 &rst
  ixpk= 0, nxpk= 0, iat= 553, 867, r1= 1.30, r2= 1.80, r3= 5.10, r4= 5.60,  &end
#
# 36 GLU HG3 38 LEU HG 5.50 
 &rst
  ixpk= 0, nxpk= 0, iat= 554, 584, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
# 34 ILE QG2 36 GLU HG2 5.50 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 553, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr1= 517, 518, 519,
 &end
#
# 44 GLU QG 45 THR H 5.07 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 705, r1= 1.30, r2= 1.80, r3= 5.69, r4= 6.19,
 igr1= 697, 698,
 &end
#
# 44 GLU HA 44 GLU QG 3.51 
 &rst
  ixpk= 0, nxpk= 0, iat= 692,  -1, r1= 1.30, r2= 1.80, r3= 3.94, r4= 4.44,
 igr2= 697, 698,
 &end
#
# 43 ARG QB 44 GLU QG 4.64 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.85, r4= 6.35,
 igr1= 670, 671,
 igr2= 697, 698,
 &end
#
# 44 GLU QG 45 THR QG2 4.97 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.70, r4= 7.20,
 igr1= 697, 698,
 igr2= 711, 712, 713,
 &end
#
# 25 GLU H 25 GLU HG3 3.96 
 &rst
  ixpk= 0, nxpk= 0, iat= 369, 377, r1= 1.30, r2= 1.80, r3= 3.96, r4= 4.46,  &end
#
# 25 GLU HG3 26 ALA H 4.85 
 &rst
  ixpk= 0, nxpk= 0, iat= 377, 384, r1= 1.30, r2= 1.80, r3= 4.85, r4= 5.35,  &end
#
# 25 GLU HG3 37 VAL QG2 4.40 
 &rst
  ixpk= 0, nxpk= 0, iat= 377,  -1, r1= 1.30, r2= 1.80, r3= 5.28, r4= 5.78,
 igr2= 571, 572, 573,
 &end
#
# 35 VAL QG2 57 GLU QG 4.04 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.45, r4= 5.95,
 igr1= 540, 541, 542,
 igr2= 904, 905,
 &end
#
# 18 GLU HG2 19 THR H 5.50 
 &rst
  ixpk= 0, nxpk= 0, iat= 267, 275, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
# 25 GLU H 25 GLU HG2 3.96 
 &rst
  ixpk= 0, nxpk= 0, iat= 369, 376, r1= 1.30, r2= 1.80, r3= 3.96, r4= 4.46,  &end
#
# 25 GLU HG2 26 ALA H 4.70 
 &rst
  ixpk= 0, nxpk= 0, iat= 376, 384, r1= 1.30, r2= 1.80, r3= 4.70, r4= 5.20,  &end
#
# 25 GLU HA 25 GLU HG2 3.88 
 &rst
  ixpk= 0, nxpk= 0, iat= 371, 376, r1= 1.30, r2= 1.80, r3= 3.88, r4= 4.38,  &end
#
# 25 GLU HG2 37 VAL QG2 4.46 
 &rst
  ixpk= 0, nxpk= 0, iat= 376,  -1, r1= 1.30, r2= 1.80, r3= 5.36, r4= 5.86,
 igr2= 571, 572, 573,
 &end
#
# 25 GLU HG2 34 ILE QD1 4.74 
 &rst
  ixpk= 0, nxpk= 0, iat= 376,  -1, r1= 1.30, r2= 1.80, r3= 5.69, r4= 6.19,
 igr2= 524, 525, 526,
 &end
#
# 16 ASN HD21 18 GLU HG3 5.50 
 &rst
  ixpk= 0, nxpk= 0, iat= 242, 268, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
# 57 GLU QG 58 SER H 4.76 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 912, r1= 1.30, r2= 1.80, r3= 5.34, r4= 5.84,
 igr1= 904, 905,
 &end
#
# 57 GLU H 57 GLU QG 4.39 
 &rst
  ixpk= 0, nxpk= 0, iat= 897,  -1, r1= 1.30, r2= 1.80, r3= 4.93, r4= 5.43,
 igr2= 904, 905,
 &end
#
# 2 VAL HA 3 GLU QG 4.57 
 &rst
  ixpk= 0, nxpk= 0, iat=  23,  -1, r1= 1.30, r2= 1.80, r3= 5.13, r4= 5.63,
 igr2=  44,  45,
 &end
#
# 57 GLU QG 58 SER QB 5.47 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.89, r4= 7.39,
 igr1= 904, 905,
 igr2= 916, 917,
 &end
#
# 57 GLU HA 57 GLU QG 3.71 
 &rst
  ixpk= 0, nxpk= 0, iat= 899,  -1, r1= 1.30, r2= 1.80, r3= 4.16, r4= 4.66,
 igr2= 904, 905,
 &end
#
# 33 ARG QD 57 GLU QG 5.50 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1= 497, 498,
 igr2= 904, 905,
 &end
#
# 1 MET QG 3 GLU QG 4.24 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.34, r4= 5.84,
 igr1=  11,  12,
 igr2=  44,  45,
 &end
#
# 3 GLU HB2 3 GLU QG 2.96 
 &rst
  ixpk= 0, nxpk= 0, iat=  41,  -1, r1= 1.30, r2= 1.80, r3= 3.32, r4= 3.82,
 igr2=  44,  45,
 &end
#
# 3 GLU QG 86 LYS QD 4.80 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55,
 igr1=  44,  45,
 igr2=1323,1324,
 &end
#
# 55 THR QG2 57 GLU QG 4.79 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.46, r4= 6.96,
 igr1= 869, 870, 871,
 igr2= 904, 905,
 &end
#
# 35 VAL QG1 57 GLU QG 4.06 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.47, r4= 5.97,
 igr1= 536, 537, 538,
 igr2= 904, 905,
 &end
#
# 16 ASN HB2 18 GLU HG2 4.40 
 &rst
  ixpk= 0, nxpk= 0, iat= 236, 267, r1= 1.30, r2= 1.80, r3= 4.40, r4= 4.90,  &end
#
# 18 GLU H 18 GLU HG2 4.07 
 &rst
  ixpk= 0, nxpk= 0, iat= 260, 267, r1= 1.30, r2= 1.80, r3= 4.07, r4= 4.57,  &end
#
# 41 LYS HB3 41 LYS QE 4.90 
 &rst
  ixpk= 0, nxpk= 0, iat= 637,  -1, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,
 igr2= 645, 646,
 &end
#
# 41 LYS HB2 42 ASP H 4.18 
 &rst
  ixpk= 0, nxpk= 0, iat= 636, 654, r1= 1.30, r2= 1.80, r3= 4.18, r4= 4.68,  &end
#
# 41 LYS HB2 48 SER HA 5.16 
 &rst
  ixpk= 0, nxpk= 0, iat= 636, 757, r1= 1.30, r2= 1.80, r3= 5.16, r4= 5.66,  &end
#
# 41 LYS HB2 41 LYS QE 4.80 
 &rst
  ixpk= 0, nxpk= 0, iat= 636,  -1, r1= 1.30, r2= 1.80, r3= 5.39, r4= 5.89,
 igr2= 645, 646,
 &end
#
# 3 GLU QG 4 ALA H 4.68 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  52, r1= 1.30, r2= 1.80, r3= 5.25, r4= 5.75,
 igr1=  44,  45,
 &end
#
# 3 GLU H 3 GLU QG 3.97 
 &rst
  ixpk= 0, nxpk= 0, iat=  37,  -1, r1= 1.30, r2= 1.80, r3= 4.46, r4= 4.96,
 igr2=  44,  45,
 &end
#
# 89 PHE QE 90 GLU QG 5.27 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.64, r4= 7.14,
 igr1=1370,1374,
 igr2=1387,1388,
 &end
#
# 89 PHE QD 90 GLU QG 5.23 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.59, r4= 7.09,
 igr1=1368,1376,
 igr2=1387,1388,
 &end
#
# 90 GLU QG 91 SER HA 5.21 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1397, r1= 1.30, r2= 1.80, r3= 5.85, r4= 6.35,
 igr1=1387,1388,
 &end
#
# 89 PHE QB 90 GLU QG 5.50 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1=1364,1365,
 igr2=1387,1388,
 &end
#
# 90 GLU HB3 90 GLU QG 2.72 
 &rst
  ixpk= 0, nxpk= 0, iat=1385,  -1, r1= 1.30, r2= 1.80, r3= 3.05, r4= 3.55,
 igr2=1387,1388,
 &end
#
# 82 GLU QG 83 GLN H 4.86 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1272, r1= 1.30, r2= 1.80, r3= 5.46, r4= 5.96,
 igr1=1264,1265,
 &end
#
# 11 PHE QB 82 GLU QG 4.82 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr1= 164, 165,
 igr2=1264,1265,
 &end
#
# 82 GLU HB3 82 GLU QG 2.71 
 &rst
  ixpk= 0, nxpk= 0, iat=1262,  -1, r1= 1.30, r2= 1.80, r3= 3.04, r4= 3.54,
 igr2=1264,1265,
 &end
#
# 80 LYS HG2 82 GLU QG 5.50 
 &rst
  ixpk= 0, nxpk= 0, iat=1226,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=1264,1265,
 &end
#
# 37 VAL HA 54 VAL HB 5.13 
 &rst
  ixpk= 0, nxpk= 0, iat= 563, 851, r1= 1.30, r2= 1.80, r3= 5.13, r4= 5.63,  &end
#
# 10 LEU H 54 VAL HB 4.97 
 &rst
  ixpk= 0, nxpk= 0, iat= 141, 851, r1= 1.30, r2= 1.80, r3= 4.97, r4= 5.47,  &end
#
# 54 VAL HB 55 THR H 4.68 
 &rst
  ixpk= 0, nxpk= 0, iat= 851, 863, r1= 1.30, r2= 1.80, r3= 4.68, r4= 5.18,  &end
#
# 54 VAL H 54 VAL HB 3.62 
 &rst
  ixpk= 0, nxpk= 0, iat= 847, 851, r1= 1.30, r2= 1.80, r3= 3.62, r4= 4.12,  &end
#
# 28 PHE QE 54 VAL HB 5.50 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 851, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 420, 424,
 &end
#
# 53 PHE HA 54 VAL HB 4.69 
 &rst
  ixpk= 0, nxpk= 0, iat= 829, 851, r1= 1.30, r2= 1.80, r3= 4.69, r4= 5.19,  &end
#
# 10 LEU HB3 54 VAL HB 5.50 
 &rst
  ixpk= 0, nxpk= 0, iat= 146, 851, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
# 10 LEU QD1 54 VAL HB 4.63 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 851, r1= 1.30, r2= 1.80, r3= 5.56, r4= 6.06,
 igr1= 150, 151, 152,
 &end
#
# 81 VAL QG1 82 GLU HB3 5.30 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1262, r1= 1.30, r2= 1.80, r3= 6.36, r4= 6.86,
 igr1=1247,1248,1249,
 &end
#
# 9 LYS HB3 10 LEU H 4.98 
 &rst
  ixpk= 0, nxpk= 0, iat= 124, 141, r1= 1.30, r2= 1.80, r3= 4.98, r4= 5.48,  &end
#
# 9 LYS HB3 9 LYS HE2 5.02 
 &rst
  ixpk= 0, nxpk= 0, iat= 124, 132, r1= 1.30, r2= 1.80, r3= 5.02, r4= 5.52,  &end
#
# 9 LYS HB3 55 THR QG2 4.98 
 &rst
  ixpk= 0, nxpk= 0, iat= 124,  -1, r1= 1.30, r2= 1.80, r3= 5.98, r4= 6.48,
 igr2= 869, 870, 871,
 &end
#
# 11 PHE QD 82 GLU HB2 5.50 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1261, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 168, 176,
 &end
#
# 16 ASN HB3 77 LYS HB2 5.38 
 &rst
  ixpk= 0, nxpk= 0, iat= 237,1172, r1= 1.30, r2= 1.80, r3= 5.38, r4= 5.88,  &end
#
# 11 PHE QE 80 LYS HB3 5.50 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1224, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 170, 174,
 &end
#
# 9 LYS HB2 56 PHE H 5.47 
 &rst
  ixpk= 0, nxpk= 0, iat= 123, 877, r1= 1.30, r2= 1.80, r3= 5.47, r4= 5.97,  &end
#
# 9 LYS HB2 9 LYS HE3 5.32 
 &rst
  ixpk= 0, nxpk= 0, iat= 123, 133, r1= 1.30, r2= 1.80, r3= 5.32, r4= 5.82,  &end
#
# 9 LYS HB2 10 LEU H 4.89 
 &rst
  ixpk= 0, nxpk= 0, iat= 123, 141, r1= 1.30, r2= 1.80, r3= 4.89, r4= 5.39,  &end
#
# 9 LYS HB2 9 LYS HE2 5.10 
 &rst
  ixpk= 0, nxpk= 0, iat= 123, 132, r1= 1.30, r2= 1.80, r3= 5.10, r4= 5.60,  &end
#
# 11 PHE H 82 GLU HB2 5.41 
 &rst
  ixpk= 0, nxpk= 0, iat= 160,1261, r1= 1.30, r2= 1.80, r3= 5.41, r4= 5.91,  &end
#
# 82 GLU HB2 83 GLN H 4.02 
 &rst
  ixpk= 0, nxpk= 0, iat=1261,1272, r1= 1.30, r2= 1.80, r3= 4.02, r4= 4.52,  &end
#
# 81 VAL HA 82 GLU HB2 5.04 
 &rst
  ixpk= 0, nxpk= 0, iat=1243,1261, r1= 1.30, r2= 1.80, r3= 5.04, r4= 5.54,  &end
#
# 11 PHE QB 82 GLU HB2 4.63 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1261, r1= 1.30, r2= 1.80, r3= 5.20, r4= 5.70,
 igr1= 164, 165,
 &end
#
# 15 LEU HA 77 LYS HB3 5.23 
 &rst
  ixpk= 0, nxpk= 0, iat= 215,1173, r1= 1.30, r2= 1.80, r3= 5.23, r4= 5.73,  &end
#
# 77 LYS HB2 78 ALA H 4.32 
 &rst
  ixpk= 0, nxpk= 0, iat=1172,1190, r1= 1.30, r2= 1.80, r3= 4.32, r4= 4.82,  &end
#
# 79 ILE HA 80 LYS HB3 5.14 
 &rst
  ixpk= 0, nxpk= 0, iat=1202,1224, r1= 1.30, r2= 1.80, r3= 5.14, r4= 5.64,  &end
#
# 77 LYS HB2 79 ILE QG2 4.83 
 &rst
  ixpk= 0, nxpk= 0, iat=1172,  -1, r1= 1.30, r2= 1.80, r3= 5.80, r4= 6.30,
 igr2=1206,1207,1208,
 &end
#
# 74 LEU H 77 LYS HB2 4.98 
 &rst
  ixpk= 0, nxpk= 0, iat=1130,1172, r1= 1.30, r2= 1.80, r3= 4.98, r4= 5.48,  &end
#
# 80 LYS H 80 LYS HB3 4.10 
 &rst
  ixpk= 0, nxpk= 0, iat=1219,1224, r1= 1.30, r2= 1.80, r3= 4.10, r4= 4.60,  &end
#
# 80 LYS HB3 80 LYS QE 4.60 
 &rst
  ixpk= 0, nxpk= 0, iat=1224,  -1, r1= 1.30, r2= 1.80, r3= 5.16, r4= 5.66,
 igr2=1232,1233,
 &end
#
# 13 GLY H 80 LYS HB3 5.35 
 &rst
  ixpk= 0, nxpk= 0, iat= 199,1224, r1= 1.30, r2= 1.80, r3= 5.35, r4= 5.85,  &end
#
# 80 LYS HB2 80 LYS QE 5.24 
 &rst
  ixpk= 0, nxpk= 0, iat=1223,  -1, r1= 1.30, r2= 1.80, r3= 5.88, r4= 6.38,
 igr2=1232,1233,
 &end
#
# 11 PHE QE 80 LYS HB2 5.50 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1223, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 170, 174,
 &end
#
# 81 VAL HB 82 GLU H 4.39 
 &rst
  ixpk= 0, nxpk= 0, iat=1245,1257, r1= 1.30, r2= 1.80, r3= 4.39, r4= 4.89,  &end
#
# 69 MET H 81 VAL HB 5.05 
 &rst
  ixpk= 0, nxpk= 0, iat=1059,1245, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,  &end
#
# 80 LYS HA 81 VAL HB 4.97 
 &rst
  ixpk= 0, nxpk= 0, iat=1221,1245, r1= 1.30, r2= 1.80, r3= 4.97, r4= 5.47,  &end
#
# 70 ASN HB3 81 VAL HB 3.91 
 &rst
  ixpk= 0, nxpk= 0, iat=1081,1245, r1= 1.30, r2= 1.80, r3= 3.91, r4= 4.41,  &end
#
# 36 GLU HB3 55 THR QG2 5.37 
 &rst
  ixpk= 0, nxpk= 0, iat= 551,  -1, r1= 1.30, r2= 1.80, r3= 6.45, r4= 6.95,
 igr2= 869, 870, 871,
 &end
#
# 36 GLU HB2 37 VAL H 4.49 
 &rst
  ixpk= 0, nxpk= 0, iat= 550, 561, r1= 1.30, r2= 1.80, r3= 4.49, r4= 4.99,  &end
#
# 36 GLU HB2 55 THR HB 3.88 
 &rst
  ixpk= 0, nxpk= 0, iat= 550, 867, r1= 1.30, r2= 1.80, r3= 3.88, r4= 4.38,  &end
#
# 36 GLU HB2 55 THR QG2 4.90 
 &rst
  ixpk= 0, nxpk= 0, iat= 550,  -1, r1= 1.30, r2= 1.80, r3= 5.88, r4= 6.38,
 igr2= 869, 870, 871,
 &end
#
# 35 VAL QG2 36 GLU HB2 5.19 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 550, r1= 1.30, r2= 1.80, r3= 6.23, r4= 6.73,
 igr1= 540, 541, 542,
 &end
#
# 42 ASP HB2 47 LYS HB3 5.13 
 &rst
  ixpk= 0, nxpk= 0, iat= 658, 738, r1= 1.30, r2= 1.80, r3= 5.13, r4= 5.63,  &end
#
# 47 LYS HB2 48 SER H 5.11 
 &rst
  ixpk= 0, nxpk= 0, iat= 737, 755, r1= 1.30, r2= 1.80, r3= 5.11, r4= 5.61,  &end
#
# 47 LYS HB2 47 LYS QE 4.80 
 &rst
  ixpk= 0, nxpk= 0, iat= 737,  -1, r1= 1.30, r2= 1.80, r3= 5.39, r4= 5.89,
 igr2= 746, 747,
 &end
#
# 21 GLU HA 37 VAL HB 4.83 
 &rst
  ixpk= 0, nxpk= 0, iat= 305, 565, r1= 1.30, r2= 1.80, r3= 4.83, r4= 5.33,  &end
#
# 42 ASP HB2 47 LYS HB2 5.14 
 &rst
  ixpk= 0, nxpk= 0, iat= 658, 737, r1= 1.30, r2= 1.80, r3= 5.14, r4= 5.64,  &end
#
# 10 LEU QD2 83 GLN HG3 5.48 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1280, r1= 1.30, r2= 1.80, r3= 6.58, r4= 7.08,
 igr1= 154, 155, 156,
 &end
#
# 83 GLN HG3 84 ALA H 5.07 
 &rst
  ixpk= 0, nxpk= 0, iat=1280,1289, r1= 1.30, r2= 1.80, r3= 5.07, r4= 5.57,  &end
#
# 9 LYS H 83 GLN HG3 5.50 
 &rst
  ixpk= 0, nxpk= 0, iat= 119,1280, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
# 4 ALA QB 83 GLN HG3 4.70 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1280, r1= 1.30, r2= 1.80, r3= 5.64, r4= 6.14,
 igr1=  56,  57,  58,
 &end
#
# 10 LEU QD2 83 GLN HG2 5.50 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1279, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr1= 154, 155, 156,
 &end
#
# 83 GLN HG2 84 ALA H 5.01 
 &rst
  ixpk= 0, nxpk= 0, iat=1279,1289, r1= 1.30, r2= 1.80, r3= 5.01, r4= 5.51,  &end
#
# 83 GLN H 83 GLN HG2 4.43 
 &rst
  ixpk= 0, nxpk= 0, iat=1272,1279, r1= 1.30, r2= 1.80, r3= 4.43, r4= 4.93,  &end
#
# 2 VAL HB 3 GLU H 4.58 
 &rst
  ixpk= 0, nxpk= 0, iat=  25,  37, r1= 1.30, r2= 1.80, r3= 4.58, r4= 5.08,  &end
#
# 72 LYS HB3 73 SER H 3.53 
 &rst
  ixpk= 0, nxpk= 0, iat=1102,1119, r1= 1.30, r2= 1.80, r3= 3.53, r4= 4.03,  &end
#
# 69 MET HA 72 LYS HB3 4.22 
 &rst
  ixpk= 0, nxpk= 0, iat=1061,1102, r1= 1.30, r2= 1.80, r3= 4.22, r4= 4.72,  &end
#
# 35 VAL H 35 VAL HB 3.66 
 &rst
  ixpk= 0, nxpk= 0, iat= 530, 534, r1= 1.30, r2= 1.80, r3= 3.66, r4= 4.16,  &end
#
# 35 VAL HB 36 GLU H 3.72 
 &rst
  ixpk= 0, nxpk= 0, iat= 534, 546, r1= 1.30, r2= 1.80, r3= 3.72, r4= 4.22,  &end
#
# 35 VAL HB 55 THR HB 4.02 
 &rst
  ixpk= 0, nxpk= 0, iat= 534, 867, r1= 1.30, r2= 1.80, r3= 4.02, r4= 4.52,  &end
#
# 35 VAL HB 55 THR QG2 3.85 
 &rst
  ixpk= 0, nxpk= 0, iat= 534,  -1, r1= 1.30, r2= 1.80, r3= 4.62, r4= 5.12,
 igr2= 869, 870, 871,
 &end
#
# 34 ILE QG2 35 VAL HB 5.50 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 534, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr1= 517, 518, 519,
 &end
#
# 69 MET HA 72 LYS HB2 4.25 
 &rst
  ixpk= 0, nxpk= 0, iat=1061,1101, r1= 1.30, r2= 1.80, r3= 4.25, r4= 4.75,  &end
#
# 72 LYS HB2 72 LYS HE2 4.94 
 &rst
  ixpk= 0, nxpk= 0, iat=1101,1110, r1= 1.30, r2= 1.80, r3= 4.94, r4= 5.44,  &end
#
# 72 LYS HB2 73 SER HB2 5.04 
 &rst
  ixpk= 0, nxpk= 0, iat=1101,1123, r1= 1.30, r2= 1.80, r3= 5.04, r4= 5.54,  &end
#
# 38 LEU QD2 40 MET HG2 5.00 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 622, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,
 igr1= 590, 591, 592,
 &end
#
# 27 VAL H 27 VAL HB 3.19 
 &rst
  ixpk= 0, nxpk= 0, iat= 394, 398, r1= 1.30, r2= 1.80, r3= 3.19, r4= 3.69,  &end
#
# 40 MET HG3 41 LYS H 5.50 
 &rst
  ixpk= 0, nxpk= 0, iat= 623, 632, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
# 40 MET HG3 52 ALA HA 5.41 
 &rst
  ixpk= 0, nxpk= 0, iat= 623, 819, r1= 1.30, r2= 1.80, r3= 5.41, r4= 5.91,  &end
#
# 40 MET HG2 51 PHE QE 5.50 
 &rst
  ixpk= 0, nxpk= 0, iat= 622,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2= 807, 811,
 &end
#
# 40 MET H 40 MET HG2 4.03 
 &rst
  ixpk= 0, nxpk= 0, iat= 615, 622, r1= 1.30, r2= 1.80, r3= 4.03, r4= 4.53,  &end
#
# 58 SER HA 59 PRO HB2 5.45 
 &rst
  ixpk= 0, nxpk= 0, iat= 914, 930, r1= 1.30, r2= 1.80, r3= 5.45, r4= 5.95,  &end
#
# 59 PRO HB2 60 ALA QB 5.49 
 &rst
  ixpk= 0, nxpk= 0, iat= 930,  -1, r1= 1.30, r2= 1.80, r3= 6.59, r4= 7.09,
 igr2= 941, 942, 943,
 &end
#
# 27 VAL HB 28 PHE QE 5.39 
 &rst
  ixpk= 0, nxpk= 0, iat= 398,  -1, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55,
 igr2= 420, 424,
 &end
#
# 24 LEU HA 27 VAL HB 3.88 
 &rst
  ixpk= 0, nxpk= 0, iat= 352, 398, r1= 1.30, r2= 1.80, r3= 3.88, r4= 4.38,  &end
#
# 40 MET H 40 MET HG3 4.34 
 &rst
  ixpk= 0, nxpk= 0, iat= 615, 623, r1= 1.30, r2= 1.80, r3= 4.34, r4= 4.84,  &end
#
# 58 SER HA 59 PRO HB3 5.12 
 &rst
  ixpk= 0, nxpk= 0, iat= 914, 931, r1= 1.30, r2= 1.80, r3= 5.12, r4= 5.62,  &end
#
# 7 PRO HB3 59 PRO HB3 3.27 
 &rst
  ixpk= 0, nxpk= 0, iat= 106, 931, r1= 1.30, r2= 1.80, r3= 3.27, r4= 3.77,  &end
#
# 8 GLY H 59 PRO HB3 5.29 
 &rst
  ixpk= 0, nxpk= 0, iat= 112, 931, r1= 1.30, r2= 1.80, r3= 5.29, r4= 5.79,  &end
#
# 59 PRO HB2 63 LYS HG3 5.28 
 &rst
  ixpk= 0, nxpk= 0, iat= 930, 977, r1= 1.30, r2= 1.80, r3= 5.28, r4= 5.78,  &end
#
# 40 MET HG2 52 ALA HA 5.18 
 &rst
  ixpk= 0, nxpk= 0, iat= 622, 819, r1= 1.30, r2= 1.80, r3= 5.18, r4= 5.68,  &end
#
# 85 THR HB 86 LYS HB3 5.31 
 &rst
  ixpk= 0, nxpk= 0, iat=1303,1318, r1= 1.30, r2= 1.80, r3= 5.31, r4= 5.81,  &end
#
# 86 LYS HB3 86 LYS QE 5.04 
 &rst
  ixpk= 0, nxpk= 0, iat=1318,  -1, r1= 1.30, r2= 1.80, r3= 5.66, r4= 6.16,
 igr2=1326,1327,
 &end
#
# 86 LYS HB3 87 PRO HD3 4.48 
 &rst
  ixpk= 0, nxpk= 0, iat=1318,1337, r1= 1.30, r2= 1.80, r3= 4.48, r4= 4.98,  &end
#
# 86 LYS HB3 87 PRO HD2 4.05 
 &rst
  ixpk= 0, nxpk= 0, iat=1318,1336, r1= 1.30, r2= 1.80, r3= 4.05, r4= 4.55,  &end
#
# 86 LYS HB2 87 PRO HD3 4.83 
 &rst
  ixpk= 0, nxpk= 0, iat=1317,1337, r1= 1.30, r2= 1.80, r3= 4.83, r4= 5.33,  &end
#
# 86 LYS HB2 87 PRO HD2 4.25 
 &rst
  ixpk= 0, nxpk= 0, iat=1317,1336, r1= 1.30, r2= 1.80, r3= 4.25, r4= 4.75,  &end
#
# 86 LYS HB2 86 LYS QE 5.12 
 &rst
  ixpk= 0, nxpk= 0, iat=1317,  -1, r1= 1.30, r2= 1.80, r3= 5.75, r4= 6.25,
 igr2=1326,1327,
 &end
#
# 3 GLU HB3 86 LYS HB2 5.04 
 &rst
  ixpk= 0, nxpk= 0, iat=  42,1317, r1= 1.30, r2= 1.80, r3= 5.04, r4= 5.54,  &end
#
# 1 MET QG 2 VAL H 5.50 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  21, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=  11,  12,
 &end
#
# 69 MET QG 81 VAL QG1 5.50 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1=1066,1067,
 igr2=1247,1248,1249,
 &end
#
# 66 ALA HA 69 MET QG 5.50 
 &rst
  ixpk= 0, nxpk= 0, iat=1015,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=1066,1067,
 &end
#
# 69 MET HB3 69 MET QG 3.00 
 &rst
  ixpk= 0, nxpk= 0, iat=1064,  -1, r1= 1.30, r2= 1.80, r3= 3.37, r4= 3.87,
 igr2=1066,1067,
 &end
#
# 68 ASP HB3 69 MET QG 4.31 
 &rst
  ixpk= 0, nxpk= 0, iat=1052,  -1, r1= 1.30, r2= 1.80, r3= 4.84, r4= 5.34,
 igr2=1066,1067,
 &end
#
# 69 MET HB3 81 VAL QG1 4.82 
 &rst
  ixpk= 0, nxpk= 0, iat=1064,  -1, r1= 1.30, r2= 1.80, r3= 5.79, r4= 6.29,
 igr2=1247,1248,1249,
 &end
#
# 31 TYR QE 69 MET HB3 4.46 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1064, r1= 1.30, r2= 1.80, r3= 5.01, r4= 5.51,
 igr1= 469, 474,
 &end
#
# 68 ASP HB3 69 MET HB3 5.07 
 &rst
  ixpk= 0, nxpk= 0, iat=1052,1064, r1= 1.30, r2= 1.80, r3= 5.07, r4= 5.57,  &end
#
# 66 ALA HA 69 MET HB2 5.21 
 &rst
  ixpk= 0, nxpk= 0, iat=1015,1063, r1= 1.30, r2= 1.80, r3= 5.21, r4= 5.71,  &end
#
# 69 MET HB2 69 MET QE 3.31 
 &rst
  ixpk= 0, nxpk= 0, iat=1063,  -1, r1= 1.30, r2= 1.80, r3= 3.98, r4= 4.48,
 igr2=1070,1071,1072,
 &end
#
# 87 PRO HB3 89 PHE H 5.47 
 &rst
  ixpk= 0, nxpk= 0, iat=1343,1360, r1= 1.30, r2= 1.80, r3= 5.47, r4= 5.97,  &end
#
# 5 ASP HB2 86 LYS HB2 5.12 
 &rst
  ixpk= 0, nxpk= 0, iat=  66,1317, r1= 1.30, r2= 1.80, r3= 5.12, r4= 5.62,  &end
#
# 30 LYS HB3 31 TYR QD 5.36 
 &rst
  ixpk= 0, nxpk= 0, iat= 442,  -1, r1= 1.30, r2= 1.80, r3= 6.02, r4= 6.52,
 igr2= 467, 476,
 &end
#
# 30 LYS H 30 LYS HB3 3.49 
 &rst
  ixpk= 0, nxpk= 0, iat= 437, 442, r1= 1.30, r2= 1.80, r3= 3.49, r4= 3.99,  &end
#
# 27 VAL HA 30 LYS HB2 5.50 
 &rst
  ixpk= 0, nxpk= 0, iat= 396, 441, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
# 30 LYS HB2 30 LYS QE 5.19 
 &rst
  ixpk= 0, nxpk= 0, iat= 441,  -1, r1= 1.30, r2= 1.80, r3= 5.83, r4= 6.33,
 igr2= 450, 451,
 &end
#
# 7 PRO HB3 8 GLY H 4.35 
 &rst
  ixpk= 0, nxpk= 0, iat= 106, 112, r1= 1.30, r2= 1.80, r3= 4.35, r4= 4.85,  &end
#
# 49 ARG HB3 51 PHE QD 5.06 
 &rst
  ixpk= 0, nxpk= 0, iat= 771,  -1, r1= 1.30, r2= 1.80, r3= 5.68, r4= 6.18,
 igr2= 805, 813,
 &end
#
# 49 ARG HB3 51 PHE QE 4.42 
 &rst
  ixpk= 0, nxpk= 0, iat= 771,  -1, r1= 1.30, r2= 1.80, r3= 4.96, r4= 5.46,
 igr2= 807, 811,
 &end
#
# 21 GLU H 22 LYS HB3 5.15 
 &rst
  ixpk= 0, nxpk= 0, iat= 303, 323, r1= 1.30, r2= 1.80, r3= 5.15, r4= 5.65,  &end
#
# 30 LYS HB3 30 LYS QE 5.21 
 &rst
  ixpk= 0, nxpk= 0, iat= 442,  -1, r1= 1.30, r2= 1.80, r3= 5.85, r4= 6.35,
 igr2= 450, 451,
 &end
#
# 41 LYS HA 49 ARG HB2 5.38 
 &rst
  ixpk= 0, nxpk= 0, iat= 634, 770, r1= 1.30, r2= 1.80, r3= 5.38, r4= 5.88,  &end
#
# 3 GLU HB3 86 LYS QD 4.36 
 &rst
  ixpk= 0, nxpk= 0, iat=  42,  -1, r1= 1.30, r2= 1.80, r3= 4.89, r4= 5.39,
 igr2=1323,1324,
 &end
#
# 3 GLU HB2 4 ALA H 4.21 
 &rst
  ixpk= 0, nxpk= 0, iat=  41,  52, r1= 1.30, r2= 1.80, r3= 4.21, r4= 4.71,  &end
#
# 22 LYS H 22 LYS HB2 3.09 
 &rst
  ixpk= 0, nxpk= 0, iat= 318, 322, r1= 1.30, r2= 1.80, r3= 3.09, r4= 3.59,  &end
#
# 22 LYS HB2 24 LEU H 5.48 
 &rst
  ixpk= 0, nxpk= 0, iat= 322, 350, r1= 1.30, r2= 1.80, r3= 5.48, r4= 5.98,  &end
#
# 1 MET HA 3 GLU HB3 5.19 
 &rst
  ixpk= 0, nxpk= 0, iat=   6,  42, r1= 1.30, r2= 1.80, r3= 5.19, r4= 5.69,  &end
#
# 93 ARG H 94 ARG QB 5.50 
 &rst
  ixpk= 0, nxpk= 0, iat=1413,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=1441,1442,
 &end
#
# 33 ARG QB 33 ARG HG3 2.65 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 495, r1= 1.30, r2= 1.80, r3= 2.97, r4= 3.47,
 igr1= 491, 492,
 &end
#
# 93 ARG QD 94 ARG QB 4.36 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.49, r4= 5.99,
 igr1=1423,1424,
 igr2=1441,1442,
 &end
#
# 33 ARG QD 57 GLU HB3 5.09 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 902, r1= 1.30, r2= 1.80, r3= 5.71, r4= 6.21,
 igr1= 497, 498,
 &end
#
# 35 VAL QG1 57 GLU HB3 4.62 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 902, r1= 1.30, r2= 1.80, r3= 5.55, r4= 6.05,
 igr1= 536, 537, 538,
 &end
#
# 35 VAL QG2 57 GLU HB2 4.14 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 901, r1= 1.30, r2= 1.80, r3= 4.97, r4= 5.47,
 igr1= 540, 541, 542,
 &end
#
# 57 GLU HB2 58 SER HA 5.31 
 &rst
  ixpk= 0, nxpk= 0, iat= 901, 914, r1= 1.30, r2= 1.80, r3= 5.31, r4= 5.81,  &end
#
# 9 LYS QD 53 PHE QE 5.50 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1= 129, 130,
 igr2= 837, 841,
 &end
#
# 9 LYS H 9 LYS QD 5.24 
 &rst
  ixpk= 0, nxpk= 0, iat= 119,  -1, r1= 1.30, r2= 1.80, r3= 5.88, r4= 6.38,
 igr2= 129, 130,
 &end
#
# 9 LYS HA 9 LYS QD 4.57 
 &rst
  ixpk= 0, nxpk= 0, iat= 121,  -1, r1= 1.30, r2= 1.80, r3= 5.13, r4= 5.63,
 igr2= 129, 130,
 &end
#
# 9 LYS HB3 9 LYS QD 3.90 
 &rst
  ixpk= 0, nxpk= 0, iat= 124,  -1, r1= 1.30, r2= 1.80, r3= 4.38, r4= 4.88,
 igr2= 129, 130,
 &end
#
# 87 PRO QG 90 GLU HB3 5.27 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1385, r1= 1.30, r2= 1.80, r3= 5.92, r4= 6.42,
 igr1=1339,1340,
 &end
#
# 67 ARG QB 68 ASP HA 5.47 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1049, r1= 1.30, r2= 1.80, r3= 6.14, r4= 6.64,
 igr1=1027,1028,
 &end
#
# 43 ARG QB 44 GLU H 3.83 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 690, r1= 1.30, r2= 1.80, r3= 4.30, r4= 4.80,
 igr1= 670, 671,
 &end
#
# 42 ASP HA 43 ARG QB 4.59 
 &rst
  ixpk= 0, nxpk= 0, iat= 656,  -1, r1= 1.30, r2= 1.80, r3= 5.15, r4= 5.65,
 igr2= 670, 671,
 &end
#
# 43 ARG QB 43 ARG QG 2.71 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 3.41, r4= 3.91,
 igr1= 670, 671,
 igr2= 673, 674,
 &end
#
# 44 GLU QB 44 GLU QG 2.73 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 3.44, r4= 3.94,
 igr1= 694, 695,
 igr2= 697, 698,
 &end
#
# 18 GLU HB3 19 THR H 5.03 
 &rst
  ixpk= 0, nxpk= 0, iat= 265, 275, r1= 1.30, r2= 1.80, r3= 5.03, r4= 5.53,  &end
#
# 66 ALA H 67 ARG QB 4.66 
 &rst
  ixpk= 0, nxpk= 0, iat=1013,  -1, r1= 1.30, r2= 1.80, r3= 5.23, r4= 5.73,
 igr2=1027,1028,
 &end
#
# 67 ARG QB 67 ARG HD2 3.64 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1033, r1= 1.30, r2= 1.80, r3= 4.09, r4= 4.59,
 igr1=1027,1028,
 &end
#
# 66 ALA QB 67 ARG QB 4.61 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.21, r4= 6.71,
 igr1=1017,1018,1019,
 igr2=1027,1028,
 &end
#
# 63 LYS HA 67 ARG QB 5.50 
 &rst
  ixpk= 0, nxpk= 0, iat= 971,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=1027,1028,
 &end
#
# 18 GLU H 18 GLU HB3 3.83 
 &rst
  ixpk= 0, nxpk= 0, iat= 260, 265, r1= 1.30, r2= 1.80, r3= 3.83, r4= 4.33,  &end
#
# 16 ASN HD21 18 GLU HB3 5.50 
 &rst
  ixpk= 0, nxpk= 0, iat= 242, 265, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
# 25 GLU QB 37 VAL QG2 4.22 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.69, r4= 6.19,
 igr1= 373, 374,
 igr2= 571, 572, 573,
 &end
#
# 5 ASP HB3 86 LYS QD 5.50 
 &rst
  ixpk= 0, nxpk= 0, iat=  67,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=1323,1324,
 &end
#
# 40 MET HB3 41 LYS H 4.73 
 &rst
  ixpk= 0, nxpk= 0, iat= 620, 632, r1= 1.30, r2= 1.80, r3= 4.73, r4= 5.23,  &end
#
# 40 MET HB3 49 ARG HD2 5.33 
 &rst
  ixpk= 0, nxpk= 0, iat= 620, 776, r1= 1.30, r2= 1.80, r3= 5.33, r4= 5.83,  &end
#
# 40 MET HB2 51 PHE H 5.10 
 &rst
  ixpk= 0, nxpk= 0, iat= 619, 797, r1= 1.30, r2= 1.80, r3= 5.10, r4= 5.60,  &end
#
# 40 MET HB2 41 LYS H 4.99 
 &rst
  ixpk= 0, nxpk= 0, iat= 619, 632, r1= 1.30, r2= 1.80, r3= 4.99, r4= 5.49,  &end
#
# 39 LEU HA 40 MET HB2 5.09 
 &rst
  ixpk= 0, nxpk= 0, iat= 598, 619, r1= 1.30, r2= 1.80, r3= 5.09, r4= 5.59,  &end
#
# 40 MET HB2 49 ARG HD2 5.26 
 &rst
  ixpk= 0, nxpk= 0, iat= 619, 776, r1= 1.30, r2= 1.80, r3= 5.26, r4= 5.76,  &end
#
# 39 LEU QD2 40 MET HB2 5.50 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 619, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr1= 609, 610, 611,
 &end
#
# 40 MET HB2 51 PHE QE 5.50 
 &rst
  ixpk= 0, nxpk= 0, iat= 619,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2= 807, 811,
 &end
#
# 63 LYS H 63 LYS QD 4.34 
 &rst
  ixpk= 0, nxpk= 0, iat= 969,  -1, r1= 1.30, r2= 1.80, r3= 4.87, r4= 5.37,
 igr2= 979, 980,
 &end
#
# 63 LYS HA 63 LYS QD 4.84 
 &rst
  ixpk= 0, nxpk= 0, iat= 971,  -1, r1= 1.30, r2= 1.80, r3= 5.43, r4= 5.93,
 igr2= 979, 980,
 &end
#
# 40 MET HB3 49 ARG HG2 3.86 
 &rst
  ixpk= 0, nxpk= 0, iat= 620, 773, r1= 1.30, r2= 1.80, r3= 3.86, r4= 4.36,  &end
#
# 80 LYS HA 80 LYS QD 4.77 
 &rst
  ixpk= 0, nxpk= 0, iat=1221,  -1, r1= 1.30, r2= 1.80, r3= 5.35, r4= 5.85,
 igr2=1229,1230,
 &end
#
# 80 LYS QD 82 GLU HB2 3.93 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1261, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,
 igr1=1229,1230,
 &end
#
# 41 LYS HA 41 LYS HD3 5.15 
 &rst
  ixpk= 0, nxpk= 0, iat= 634, 643, r1= 1.30, r2= 1.80, r3= 5.15, r4= 5.65,  &end
#
# 41 LYS HD3 48 SER HA 5.50 
 &rst
  ixpk= 0, nxpk= 0, iat= 643, 757, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
# 39 LEU QD1 41 LYS HD3 5.23 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 643, r1= 1.30, r2= 1.80, r3= 6.28, r4= 6.78,
 igr1= 605, 606, 607,
 &end
#
# 41 LYS HD3 47 LYS HA 4.65 
 &rst
  ixpk= 0, nxpk= 0, iat= 643, 735, r1= 1.30, r2= 1.80, r3= 4.65, r4= 5.15,  &end
#
# 41 LYS HD3 46 ASN HB3 5.45 
 &rst
  ixpk= 0, nxpk= 0, iat= 643, 724, r1= 1.30, r2= 1.80, r3= 5.45, r4= 5.95,  &end
#
# 39 LEU QD1 41 LYS HD2 5.27 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 642, r1= 1.30, r2= 1.80, r3= 6.33, r4= 6.83,
 igr1= 605, 606, 607,
 &end
#
# 41 LYS HD2 46 ASN HA 5.30 
 &rst
  ixpk= 0, nxpk= 0, iat= 642, 721, r1= 1.30, r2= 1.80, r3= 5.30, r4= 5.80,  &end
#
# 41 LYS HD2 48 SER HA 5.50 
 &rst
  ixpk= 0, nxpk= 0, iat= 642, 757, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
# 82 GLU HA 83 GLN HB3 5.35 
 &rst
  ixpk= 0, nxpk= 0, iat=1259,1277, r1= 1.30, r2= 1.80, r3= 5.35, r4= 5.85,  &end
#
# 83 GLN HB3 84 ALA H 4.87 
 &rst
  ixpk= 0, nxpk= 0, iat=1277,1289, r1= 1.30, r2= 1.80, r3= 4.87, r4= 5.37,  &end
#
# 83 GLN HB3 83 GLN HE22 5.32 
 &rst
  ixpk= 0, nxpk= 0, iat=1277,1284, r1= 1.30, r2= 1.80, r3= 5.32, r4= 5.82,  &end
#
# 83 GLN HB3 83 GLN HE21 5.50 
 &rst
  ixpk= 0, nxpk= 0, iat=1277,1285, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
# 10 LEU QD2 83 GLN HB3 5.50 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1277, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr1= 154, 155, 156,
 &end
#
# 83 GLN HB2 84 ALA H 4.89 
 &rst
  ixpk= 0, nxpk= 0, iat=1276,1289, r1= 1.30, r2= 1.80, r3= 4.89, r4= 5.39,  &end
#
# 82 GLU HA 83 GLN HB2 5.16 
 &rst
  ixpk= 0, nxpk= 0, iat=1259,1276, r1= 1.30, r2= 1.80, r3= 5.16, r4= 5.66,  &end
#
# 63 LYS QB 63 LYS QD 3.00 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 3.78, r4= 4.28,
 igr1= 973, 974,
 igr2= 979, 980,
 &end
#
# 47 LYS HG2 47 LYS QD 2.79 
 &rst
  ixpk= 0, nxpk= 0, iat= 740,  -1, r1= 1.30, r2= 1.80, r3= 3.13, r4= 3.63,
 igr2= 743, 744,
 &end
#
# 41 LYS HA 41 LYS HD2 5.02 
 &rst
  ixpk= 0, nxpk= 0, iat= 634, 642, r1= 1.30, r2= 1.80, r3= 5.02, r4= 5.52,  &end
#
# 41 LYS HD2 46 ASN HB3 5.09 
 &rst
  ixpk= 0, nxpk= 0, iat= 642, 724, r1= 1.30, r2= 1.80, r3= 5.09, r4= 5.59,  &end
#
# 41 LYS H 41 LYS HD2 5.37 
 &rst
  ixpk= 0, nxpk= 0, iat= 632, 642, r1= 1.30, r2= 1.80, r3= 5.37, r4= 5.87,  &end
#
# 30 LYS HA 30 LYS QD 4.74 
 &rst
  ixpk= 0, nxpk= 0, iat= 439,  -1, r1= 1.30, r2= 1.80, r3= 5.32, r4= 5.82,
 igr2= 447, 448,
 &end
#
# 27 VAL HA 30 LYS QD 5.36 
 &rst
  ixpk= 0, nxpk= 0, iat= 396,  -1, r1= 1.30, r2= 1.80, r3= 6.02, r4= 6.52,
 igr2= 447, 448,
 &end
#
# 30 LYS H 30 LYS QD 5.11 
 &rst
  ixpk= 0, nxpk= 0, iat= 437,  -1, r1= 1.30, r2= 1.80, r3= 5.74, r4= 6.24,
 igr2= 447, 448,
 &end
#
# 30 LYS QD 31 TYR QE 5.50 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1= 447, 448,
 igr2= 469, 474,
 &end
#
# 21 GLU HB3 22 LYS HA 5.18 
 &rst
  ixpk= 0, nxpk= 0, iat= 308, 320, r1= 1.30, r2= 1.80, r3= 5.18, r4= 5.68,  &end
#
# 21 GLU HB3 37 VAL QG1 4.88 
 &rst
  ixpk= 0, nxpk= 0, iat= 308,  -1, r1= 1.30, r2= 1.80, r3= 5.86, r4= 6.36,
 igr2= 567, 568, 569,
 &end
#
# 21 GLU HB3 22 LYS H 3.91 
 &rst
  ixpk= 0, nxpk= 0, iat= 308, 318, r1= 1.30, r2= 1.80, r3= 3.91, r4= 4.41,  &end
#
# 10 LEU HA 83 GLN HB2 5.41 
 &rst
  ixpk= 0, nxpk= 0, iat= 143,1276, r1= 1.30, r2= 1.80, r3= 5.41, r4= 5.91,  &end
#
# 21 GLU H 21 GLU HB2 3.82 
 &rst
  ixpk= 0, nxpk= 0, iat= 303, 307, r1= 1.30, r2= 1.80, r3= 3.82, r4= 4.32,  &end
#
# 21 GLU HB2 22 LYS H 3.93 
 &rst
  ixpk= 0, nxpk= 0, iat= 307, 318, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,  &end
#
# 20 ASN HB3 21 GLU HB2 5.06 
 &rst
  ixpk= 0, nxpk= 0, iat= 294, 307, r1= 1.30, r2= 1.80, r3= 5.06, r4= 5.56,  &end
#
# 21 GLU HB2 37 VAL QG1 4.24 
 &rst
  ixpk= 0, nxpk= 0, iat= 307,  -1, r1= 1.30, r2= 1.80, r3= 5.09, r4= 5.59,
 igr2= 567, 568, 569,
 &end
#
# 21 GLU HB2 22 LYS HA 5.09 
 &rst
  ixpk= 0, nxpk= 0, iat= 307, 320, r1= 1.30, r2= 1.80, r3= 5.09, r4= 5.59,  &end
#
# 22 LYS QD 23 ALA H 4.40 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 340, r1= 1.30, r2= 1.80, r3= 4.94, r4= 5.44,
 igr1= 328, 329,
 &end
#
# 47 LYS HB3 47 LYS QD 2.68 
 &rst
  ixpk= 0, nxpk= 0, iat= 738,  -1, r1= 1.30, r2= 1.80, r3= 3.01, r4= 3.51,
 igr2= 743, 744,
 &end
#
# 22 LYS HG3 22 LYS QD 2.68 
 &rst
  ixpk= 0, nxpk= 0, iat= 326,  -1, r1= 1.30, r2= 1.80, r3= 3.01, r4= 3.51,
 igr2= 328, 329,
 &end
#
# 69 MET HA 72 LYS QD 4.52 
 &rst
  ixpk= 0, nxpk= 0, iat=1061,  -1, r1= 1.30, r2= 1.80, r3= 5.07, r4= 5.57,
 igr2=1107,1108,
 &end
#
# 72 LYS HA 72 LYS QD 3.88 
 &rst
  ixpk= 0, nxpk= 0, iat=1099,  -1, r1= 1.30, r2= 1.80, r3= 4.36, r4= 4.86,
 igr2=1107,1108,
 &end
#
# 72 LYS QD 73 SER H 4.68 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1119, r1= 1.30, r2= 1.80, r3= 5.25, r4= 5.75,
 igr1=1107,1108,
 &end
#
# 72 LYS H 72 LYS QD 4.79 
 &rst
  ixpk= 0, nxpk= 0, iat=1097,  -1, r1= 1.30, r2= 1.80, r3= 5.38, r4= 5.88,
 igr2=1107,1108,
 &end
#
# 72 LYS HB3 72 LYS QD 4.10 
 &rst
  ixpk= 0, nxpk= 0, iat=1102,  -1, r1= 1.30, r2= 1.80, r3= 4.60, r4= 5.10,
 igr2=1107,1108,
 &end
#
# 17 THR QG2 47 LYS QD 4.19 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.65, r4= 6.15,
 igr1= 252, 253, 254,
 igr2= 743, 744,
 &end
#
# 11 PHE HA 12 ILE HG13 5.37 
 &rst
  ixpk= 0, nxpk= 0, iat= 162, 191, r1= 1.30, r2= 1.80, r3= 5.37, r4= 5.87,  &end
#
# 12 ILE QG2 12 ILE HG13 4.13 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 191, r1= 1.30, r2= 1.80, r3= 4.96, r4= 5.46,
 igr1= 186, 187, 188,
 &end
#
# 12 ILE HG13 54 VAL H 5.23 
 &rst
  ixpk= 0, nxpk= 0, iat= 191, 847, r1= 1.30, r2= 1.80, r3= 5.23, r4= 5.73,  &end
#
# 12 ILE H 12 ILE HG13 4.78 
 &rst
  ixpk= 0, nxpk= 0, iat= 180, 191, r1= 1.30, r2= 1.80, r3= 4.78, r4= 5.28,  &end
#
# 12 ILE HG13 28 PHE HZ 4.85 
 &rst
  ixpk= 0, nxpk= 0, iat= 191, 422, r1= 1.30, r2= 1.80, r3= 4.85, r4= 5.35,  &end
#
# 12 ILE HG13 54 VAL QG1 4.47 
 &rst
  ixpk= 0, nxpk= 0, iat= 191,  -1, r1= 1.30, r2= 1.80, r3= 5.37, r4= 5.87,
 igr2= 853, 854, 855,
 &end
#
# 12 ILE H 12 ILE HG12 4.80 
 &rst
  ixpk= 0, nxpk= 0, iat= 180, 190, r1= 1.30, r2= 1.80, r3= 4.80, r4= 5.30,  &end
#
# 12 ILE HG12 28 PHE HZ 4.89 
 &rst
  ixpk= 0, nxpk= 0, iat= 190, 422, r1= 1.30, r2= 1.80, r3= 4.89, r4= 5.39,  &end
#
# 12 ILE HG12 81 VAL HA 5.40 
 &rst
  ixpk= 0, nxpk= 0, iat= 190,1243, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,  &end
#
# 11 PHE HA 12 ILE HG12 5.43 
 &rst
  ixpk= 0, nxpk= 0, iat= 162, 190, r1= 1.30, r2= 1.80, r3= 5.43, r4= 5.93,  &end
#
# 12 ILE QG2 12 ILE HG12 4.07 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 190, r1= 1.30, r2= 1.80, r3= 4.89, r4= 5.39,
 igr1= 186, 187, 188,
 &end
#
# 12 ILE HG12 54 VAL QG1 4.55 
 &rst
  ixpk= 0, nxpk= 0, iat= 190,  -1, r1= 1.30, r2= 1.80, r3= 5.46, r4= 5.96,
 igr2= 853, 854, 855,
 &end
#
# 59 PRO HG3 63 LYS QD 5.50 
 &rst
  ixpk= 0, nxpk= 0, iat= 928,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2= 979, 980,
 &end
#
# 58 SER HA 59 PRO HG3 4.50 
 &rst
  ixpk= 0, nxpk= 0, iat= 914, 928, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
# 59 PRO HG3 60 ALA QB 5.50 
 &rst
  ixpk= 0, nxpk= 0, iat= 928,  -1, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr2= 941, 942, 943,
 &end
#
# 77 LYS HA 77 LYS HD3 3.83 
 &rst
  ixpk= 0, nxpk= 0, iat=1170,1179, r1= 1.30, r2= 1.80, r3= 3.83, r4= 4.33,  &end
#
# 77 LYS HD2 78 ALA H 4.57 
 &rst
  ixpk= 0, nxpk= 0, iat=1178,1190, r1= 1.30, r2= 1.80, r3= 4.57, r4= 5.07,  &end
#
# 77 LYS HA 77 LYS HD2 3.86 
 &rst
  ixpk= 0, nxpk= 0, iat=1170,1178, r1= 1.30, r2= 1.80, r3= 3.86, r4= 4.36,  &end
#
# 77 LYS H 77 LYS HD2 5.50 
 &rst
  ixpk= 0, nxpk= 0, iat=1168,1178, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
# 7 PRO QG 8 GLY H 5.10 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 112, r1= 1.30, r2= 1.80, r3= 5.72, r4= 6.22,
 igr1= 102, 103,
 &end
#
# 7 PRO QG 59 PRO HB3 3.40 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 931, r1= 1.30, r2= 1.80, r3= 3.82, r4= 4.32,
 igr1= 102, 103,
 &end
#
# 7 PRO HB3 59 PRO HG2 4.37 
 &rst
  ixpk= 0, nxpk= 0, iat= 106, 927, r1= 1.30, r2= 1.80, r3= 4.37, r4= 4.87,  &end
#
# 34 ILE HG13 56 PHE QR 4.67 
 &rst
  ixpk= 0, nxpk= 0, iat= 522,  -1, r1= 1.30, r2= 1.80, r3= 5.88, r4= 6.38,
 igr2= 885, 893, 887, 891,
 &end
#
# 33 ARG QB 33 ARG HG2 2.98 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 494, r1= 1.30, r2= 1.80, r3= 3.34, r4= 3.84,
 igr1= 491, 492,
 &end
#
# 34 ILE HG12 56 PHE HA 5.43 
 &rst
  ixpk= 0, nxpk= 0, iat= 521, 879, r1= 1.30, r2= 1.80, r3= 5.43, r4= 5.93,  &end
#
# 29 GLY HA3 34 ILE HG12 5.16 
 &rst
  ixpk= 0, nxpk= 0, iat= 433, 521, r1= 1.30, r2= 1.80, r3= 5.16, r4= 5.66,  &end
#
# 34 ILE HG12 54 VAL HB 5.50 
 &rst
  ixpk= 0, nxpk= 0, iat= 521, 851, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
# 38 LEU HG 53 PHE QD 5.10 
 &rst
  ixpk= 0, nxpk= 0, iat= 584,  -1, r1= 1.30, r2= 1.80, r3= 5.72, r4= 6.22,
 igr2= 835, 843,
 &end
#
# 41 LYS HA 49 ARG HG3 4.97 
 &rst
  ixpk= 0, nxpk= 0, iat= 634, 774, r1= 1.30, r2= 1.80, r3= 4.97, r4= 5.47,  &end
#
# 49 ARG HA 49 ARG HG3 4.01 
 &rst
  ixpk= 0, nxpk= 0, iat= 768, 774, r1= 1.30, r2= 1.80, r3= 4.01, r4= 4.51,  &end
#
# 67 ARG QB 67 ARG HG3 2.94 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1031, r1= 1.30, r2= 1.80, r3= 3.30, r4= 3.80,
 igr1=1027,1028,
 &end
#
# 43 ARG HA 43 ARG QG 3.89 
 &rst
  ixpk= 0, nxpk= 0, iat= 668,  -1, r1= 1.30, r2= 1.80, r3= 4.37, r4= 4.87,
 igr2= 673, 674,
 &end
#
# 43 ARG QG 44 GLU HA 4.47 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 692, r1= 1.30, r2= 1.80, r3= 5.02, r4= 5.52,
 igr1= 673, 674,
 &end
#
# 64 ASP HA 67 ARG HG2 5.19 
 &rst
  ixpk= 0, nxpk= 0, iat= 993,1030, r1= 1.30, r2= 1.80, r3= 5.19, r4= 5.69,  &end
#
# 49 ARG H 49 ARG HG2 4.23 
 &rst
  ixpk= 0, nxpk= 0, iat= 766, 773, r1= 1.30, r2= 1.80, r3= 4.23, r4= 4.73,  &end
#
# 41 LYS HA 49 ARG HG2 4.59 
 &rst
  ixpk= 0, nxpk= 0, iat= 634, 773, r1= 1.30, r2= 1.80, r3= 4.59, r4= 5.09,  &end
#
# 49 ARG HA 49 ARG HG2 3.78 
 &rst
  ixpk= 0, nxpk= 0, iat= 768, 773, r1= 1.30, r2= 1.80, r3= 3.78, r4= 4.28,  &end
#
# 42 ASP HB2 49 ARG HG2 5.42 
 &rst
  ixpk= 0, nxpk= 0, iat= 658, 773, r1= 1.30, r2= 1.80, r3= 5.42, r4= 5.92,  &end
#
# 39 LEU H 39 LEU HG 5.01 
 &rst
  ixpk= 0, nxpk= 0, iat= 596, 603, r1= 1.30, r2= 1.80, r3= 5.01, r4= 5.51,  &end
#
# 39 LEU HG 40 MET H 4.81 
 &rst
  ixpk= 0, nxpk= 0, iat= 603, 615, r1= 1.30, r2= 1.80, r3= 4.81, r4= 5.31,  &end
#
# 39 LEU HG 41 LYS QE 4.69 
 &rst
  ixpk= 0, nxpk= 0, iat= 603,  -1, r1= 1.30, r2= 1.80, r3= 5.26, r4= 5.76,
 igr2= 645, 646,
 &end
#
# 39 LEU HG 41 LYS HG2 5.18 
 &rst
  ixpk= 0, nxpk= 0, iat= 603, 639, r1= 1.30, r2= 1.80, r3= 5.18, r4= 5.68,  &end
#
# 24 LEU QD1 39 LEU HG 5.50 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 603, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr1= 359, 360, 361,
 &end
#
# 15 LEU QD1 39 LEU HG 5.50 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 603, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr1= 222, 223, 224,
 &end
#
# 87 PRO QG 90 GLU H 5.08 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1380, r1= 1.30, r2= 1.80, r3= 5.70, r4= 6.20,
 igr1=1339,1340,
 &end
#
# 15 LEU HG 16 ASN H 5.43 
 &rst
  ixpk= 0, nxpk= 0, iat= 220, 232, r1= 1.30, r2= 1.80, r3= 5.43, r4= 5.93,  &end
#
# 15 LEU HG 79 ILE QG1 5.50 
 &rst
  ixpk= 0, nxpk= 0, iat= 220,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=1210,1211,
 &end
#
# 10 LEU HB3 10 LEU HG 2.97 
 &rst
  ixpk= 0, nxpk= 0, iat= 146, 148, r1= 1.30, r2= 1.80, r3= 2.97, r4= 3.47,  &end
#
# 23 ALA H 24 LEU HG 5.50 
 &rst
  ixpk= 0, nxpk= 0, iat= 340, 357, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
# 15 LEU QD1 24 LEU HG 5.50 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 357, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr1= 222, 223, 224,
 &end
#
# 10 LEU QD1 62 ALA QB 4.06 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.86, r4= 6.36,
 igr1= 150, 151, 152,
 igr2= 963, 964, 965,
 &end
#
# 9 LYS HA 10 LEU QD1 5.50 
 &rst
  ixpk= 0, nxpk= 0, iat= 121,  -1, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr2= 150, 151, 152,
 &end
#
# 39 LEU QD1 40 MET H 5.05 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 615, r1= 1.30, r2= 1.80, r3= 6.06, r4= 6.56,
 igr1= 605, 606, 607,
 &end
#
# 39 LEU QD1 48 SER HA 4.31 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 757, r1= 1.30, r2= 1.80, r3= 5.18, r4= 5.68,
 igr1= 605, 606, 607,
 &end
#
# 21 GLU HA 39 LEU QD1 4.77 
 &rst
  ixpk= 0, nxpk= 0, iat= 305,  -1, r1= 1.30, r2= 1.80, r3= 5.73, r4= 6.23,
 igr2= 605, 606, 607,
 &end
#
# 19 THR QG2 24 LEU HG 4.22 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 357, r1= 1.30, r2= 1.80, r3= 5.07, r4= 5.57,
 igr1= 281, 282, 283,
 &end
#
# 10 LEU H 10 LEU QD1 4.51 
 &rst
  ixpk= 0, nxpk= 0, iat= 141,  -1, r1= 1.30, r2= 1.80, r3= 5.42, r4= 5.92,
 igr2= 150, 151, 152,
 &end
#
# 10 LEU QD1 11 PHE H 5.26 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 160, r1= 1.30, r2= 1.80, r3= 6.32, r4= 6.82,
 igr1= 150, 151, 152,
 &end
#
# 10 LEU QD1 56 PHE H 5.50 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 877, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr1= 150, 151, 152,
 &end
#
# 10 LEU QD1 54 VAL H 5.42 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 847, r1= 1.30, r2= 1.80, r3= 6.51, r4= 7.01,
 igr1= 150, 151, 152,
 &end
#
# 10 LEU QD1 28 PHE QE 4.96 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.69, r4= 7.19,
 igr1= 150, 151, 152,
 igr2= 420, 424,
 &end
#
# 10 LEU HA 10 LEU QD1 4.41 
 &rst
  ixpk= 0, nxpk= 0, iat= 143,  -1, r1= 1.30, r2= 1.80, r3= 5.30, r4= 5.80,
 igr2= 150, 151, 152,
 &end
#
# 10 LEU QD1 66 ALA HA 4.76 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1015, r1= 1.30, r2= 1.80, r3= 5.72, r4= 6.22,
 igr1= 150, 151, 152,
 &end
#
# 10 LEU HB3 10 LEU QD1 3.64 
 &rst
  ixpk= 0, nxpk= 0, iat= 146,  -1, r1= 1.30, r2= 1.80, r3= 4.37, r4= 4.87,
 igr2= 150, 151, 152,
 &end
#
# 10 LEU QD1 66 ALA QB 3.98 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.74, r4= 6.24,
 igr1= 150, 151, 152,
 igr2=1017,1018,1019,
 &end
#
# 10 LEU HB2 10 LEU QD1 3.64 
 &rst
  ixpk= 0, nxpk= 0, iat= 145,  -1, r1= 1.30, r2= 1.80, r3= 4.37, r4= 4.87,
 igr2= 150, 151, 152,
 &end
#
# 10 LEU QD1 65 ALA QB 3.43 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.95, r4= 5.45,
 igr1= 150, 151, 152,
 igr2=1007,1008,1009,
 &end
#
# 10 LEU QD1 12 ILE QD1 4.66 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.72, r4= 7.22,
 igr1= 150, 151, 152,
 igr2= 193, 194, 195,
 &end
#
# 21 GLU H 39 LEU QD1 4.05 
 &rst
  ixpk= 0, nxpk= 0, iat= 303,  -1, r1= 1.30, r2= 1.80, r3= 4.86, r4= 5.36,
 igr2= 605, 606, 607,
 &end
#
# 39 LEU H 39 LEU QD1 4.64 
 &rst
  ixpk= 0, nxpk= 0, iat= 596,  -1, r1= 1.30, r2= 1.80, r3= 5.57, r4= 6.07,
 igr2= 605, 606, 607,
 &end
#
# 20 ASN HB3 39 LEU QD1 4.50 
 &rst
  ixpk= 0, nxpk= 0, iat= 294,  -1, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr2= 605, 606, 607,
 &end
#
# 39 LEU QD1 41 LYS QE 3.74 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.04, r4= 5.54,
 igr1= 605, 606, 607,
 igr2= 645, 646,
 &end
#
# 39 LEU HB3 39 LEU QD1 3.53 
 &rst
  ixpk= 0, nxpk= 0, iat= 601,  -1, r1= 1.30, r2= 1.80, r3= 4.24, r4= 4.74,
 igr2= 605, 606, 607,
 &end
#
# 39 LEU QD1 41 LYS HG2 3.93 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 639, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,
 igr1= 605, 606, 607,
 &end
#
# 24 LEU QD1 39 LEU QD1 4.53 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.53, r4= 7.03,
 igr1= 359, 360, 361,
 igr2= 605, 606, 607,
 &end
#
# 15 LEU QD1 51 PHE HB3 5.50 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 802, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr1= 222, 223, 224,
 &end
#
# 12 ILE QD1 15 LEU QD1 5.43 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.83, r4= 8.33,
 igr1= 193, 194, 195,
 igr2= 222, 223, 224,
 &end
#
# 15 LEU QD1 16 ASN H 5.50 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 232, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr1= 222, 223, 224,
 &end
#
# 15 LEU QD1 52 ALA H 4.56 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 817, r1= 1.30, r2= 1.80, r3= 5.48, r4= 5.98,
 igr1= 222, 223, 224,
 &end
#
# 15 LEU QD1 52 ALA HA 5.50 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 819, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr1= 222, 223, 224,
 &end
#
# 15 LEU QD1 51 PHE HB2 5.50 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 801, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr1= 222, 223, 224,
 &end
#
# 15 LEU HB3 15 LEU QD1 3.66 
 &rst
  ixpk= 0, nxpk= 0, iat= 218,  -1, r1= 1.30, r2= 1.80, r3= 4.40, r4= 4.90,
 igr2= 222, 223, 224,
 &end
#
# 15 LEU HB2 15 LEU QD1 3.69 
 &rst
  ixpk= 0, nxpk= 0, iat= 217,  -1, r1= 1.30, r2= 1.80, r3= 4.43, r4= 4.93,
 igr2= 222, 223, 224,
 &end
#
# 15 LEU QD1 24 LEU QD2 3.41 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.92, r4= 5.42,
 igr1= 222, 223, 224,
 igr2= 363, 364, 365,
 &end
#
# 15 LEU QD1 24 LEU QD1 3.67 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.29, r4= 5.79,
 igr1= 222, 223, 224,
 igr2= 359, 360, 361,
 &end
#
# 9 LYS HA 10 LEU HG 5.22 
 &rst
  ixpk= 0, nxpk= 0, iat= 121, 148, r1= 1.30, r2= 1.80, r3= 5.22, r4= 5.72,  &end
#
# 72 LYS HG3 73 SER H 4.75 
 &rst
  ixpk= 0, nxpk= 0, iat=1105,1119, r1= 1.30, r2= 1.80, r3= 4.75, r4= 5.25,  &end
#
# 69 MET HA 72 LYS HG2 4.16 
 &rst
  ixpk= 0, nxpk= 0, iat=1061,1104, r1= 1.30, r2= 1.80, r3= 4.16, r4= 4.66,  &end
#
# 72 LYS HA 72 LYS HG2 4.00 
 &rst
  ixpk= 0, nxpk= 0, iat=1099,1104, r1= 1.30, r2= 1.80, r3= 4.00, r4= 4.50,  &end
#
# 72 LYS HG2 72 LYS HE3 4.09 
 &rst
  ixpk= 0, nxpk= 0, iat=1104,1111, r1= 1.30, r2= 1.80, r3= 4.09, r4= 4.59,  &end
#
# 74 LEU QD1 75 ASP H 5.50 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1149, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr1=1139,1140,1141,
 &end
#
# 74 LEU H 74 LEU QD1 5.35 
 &rst
  ixpk= 0, nxpk= 0, iat=1130,  -1, r1= 1.30, r2= 1.80, r3= 6.43, r4= 6.93,
 igr2=1139,1140,1141,
 &end
#
# 28 PHE QD 74 LEU QD1 5.50 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1= 418, 426,
 igr2=1139,1140,1141,
 &end
#
# 28 PHE QE 74 LEU QD1 4.82 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.50, r4= 7.00,
 igr1= 420, 424,
 igr2=1139,1140,1141,
 &end
#
# 74 LEU HA 74 LEU QD1 5.17 
 &rst
  ixpk= 0, nxpk= 0, iat=1132,  -1, r1= 1.30, r2= 1.80, r3= 6.21, r4= 6.71,
 igr2=1139,1140,1141,
 &end
#
# 23 ALA HA 74 LEU QD1 5.50 
 &rst
  ixpk= 0, nxpk= 0, iat= 342,  -1, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr2=1139,1140,1141,
 &end
#
# 24 LEU HA 74 LEU QD1 4.71 
 &rst
  ixpk= 0, nxpk= 0, iat= 352,  -1, r1= 1.30, r2= 1.80, r3= 5.66, r4= 6.16,
 igr2=1139,1140,1141,
 &end
#
# 15 LEU HA 74 LEU QD1 5.27 
 &rst
  ixpk= 0, nxpk= 0, iat= 215,  -1, r1= 1.30, r2= 1.80, r3= 6.33, r4= 6.83,
 igr2=1139,1140,1141,
 &end
#
# 27 VAL HB 74 LEU QD1 4.98 
 &rst
  ixpk= 0, nxpk= 0, iat= 398,  -1, r1= 1.30, r2= 1.80, r3= 5.98, r4= 6.48,
 igr2=1139,1140,1141,
 &end
#
# 74 LEU HB3 74 LEU QD1 3.71 
 &rst
  ixpk= 0, nxpk= 0, iat=1135,  -1, r1= 1.30, r2= 1.80, r3= 4.46, r4= 4.96,
 igr2=1139,1140,1141,
 &end
#
# 69 MET QE 74 LEU QD1 4.14 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.97, r4= 6.47,
 igr1=1070,1071,1072,
 igr2=1139,1140,1141,
 &end
#
# 19 THR QG2 74 LEU QD1 3.33 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.80, r4= 5.30,
 igr1= 281, 282, 283,
 igr2=1139,1140,1141,
 &end
#
# 24 LEU QD1 74 LEU QD1 4.64 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.69, r4= 7.19,
 igr1= 359, 360, 361,
 igr2=1139,1140,1141,
 &end
#
# 15 LEU QD1 74 LEU QD1 4.86 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.01, r4= 7.51,
 igr1= 222, 223, 224,
 igr2=1139,1140,1141,
 &end
#
# 24 LEU QD1 39 LEU H 5.50 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 596, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr1= 359, 360, 361,
 &end
#
# 23 ALA H 24 LEU QD1 5.45 
 &rst
  ixpk= 0, nxpk= 0, iat= 340,  -1, r1= 1.30, r2= 1.80, r3= 6.55, r4= 7.05,
 igr2= 359, 360, 361,
 &end
#
# 24 LEU H 24 LEU QD1 4.11 
 &rst
  ixpk= 0, nxpk= 0, iat= 350,  -1, r1= 1.30, r2= 1.80, r3= 4.94, r4= 5.44,
 igr2= 359, 360, 361,
 &end
#
# 24 LEU QD1 28 PHE QD 5.50 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1= 359, 360, 361,
 igr2= 418, 426,
 &end
#
# 24 LEU QD1 28 PHE QE 5.47 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.37, r4= 7.87,
 igr1= 359, 360, 361,
 igr2= 420, 424,
 &end
#
# 24 LEU QD1 52 ALA HA 5.41 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 819, r1= 1.30, r2= 1.80, r3= 6.50, r4= 7.00,
 igr1= 359, 360, 361,
 &end
#
# 24 LEU QD1 39 LEU HA 4.87 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 598, r1= 1.30, r2= 1.80, r3= 5.85, r4= 6.35,
 igr1= 359, 360, 361,
 &end
#
# 24 LEU HA 24 LEU QD1 4.37 
 &rst
  ixpk= 0, nxpk= 0, iat= 352,  -1, r1= 1.30, r2= 1.80, r3= 5.25, r4= 5.75,
 igr2= 359, 360, 361,
 &end
#
# 21 GLU HG3 24 LEU QD1 5.50 
 &rst
  ixpk= 0, nxpk= 0, iat= 311,  -1, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr2= 359, 360, 361,
 &end
#
# 24 LEU HB3 24 LEU QD1 3.48 
 &rst
  ixpk= 0, nxpk= 0, iat= 355,  -1, r1= 1.30, r2= 1.80, r3= 4.18, r4= 4.68,
 igr2= 359, 360, 361,
 &end
#
# 24 LEU QD1 39 LEU HB2 3.19 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 600, r1= 1.30, r2= 1.80, r3= 3.83, r4= 4.33,
 igr1= 359, 360, 361,
 &end
#
# 12 ILE QD1 52 ALA QB 4.96 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.15, r4= 7.65,
 igr1= 193, 194, 195,
 igr2= 821, 822, 823,
 &end
#
# 21 GLU H 24 LEU QD1 5.50 
 &rst
  ixpk= 0, nxpk= 0, iat= 303,  -1, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr2= 359, 360, 361,
 &end
#
# 24 LEU QD1 39 LEU HB3 5.12 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 601, r1= 1.30, r2= 1.80, r3= 6.15, r4= 6.65,
 igr1= 359, 360, 361,
 &end
#
# 60 ALA HA 63 LYS HG3 4.82 
 &rst
  ixpk= 0, nxpk= 0, iat= 939, 977, r1= 1.30, r2= 1.80, r3= 4.82, r4= 5.32,  &end
#
# 37 VAL HA 38 LEU QD1 5.46 
 &rst
  ixpk= 0, nxpk= 0, iat= 563,  -1, r1= 1.30, r2= 1.80, r3= 6.56, r4= 7.06,
 igr2= 586, 587, 588,
 &end
#
# 38 LEU H 52 ALA QB 4.77 
 &rst
  ixpk= 0, nxpk= 0, iat= 577,  -1, r1= 1.30, r2= 1.80, r3= 5.73, r4= 6.23,
 igr2= 821, 822, 823,
 &end
#
# 52 ALA QB 53 PHE H 3.64 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 827, r1= 1.30, r2= 1.80, r3= 4.37, r4= 4.87,
 igr1= 821, 822, 823,
 &end
#
# 40 MET H 52 ALA QB 4.34 
 &rst
  ixpk= 0, nxpk= 0, iat= 615,  -1, r1= 1.30, r2= 1.80, r3= 5.21, r4= 5.71,
 igr2= 821, 822, 823,
 &end
#
# 52 ALA QB 53 PHE HA 5.44 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 829, r1= 1.30, r2= 1.80, r3= 6.53, r4= 7.03,
 igr1= 821, 822, 823,
 &end
#
# 24 LEU HB3 52 ALA QB 5.11 
 &rst
  ixpk= 0, nxpk= 0, iat= 355,  -1, r1= 1.30, r2= 1.80, r3= 6.14, r4= 6.64,
 igr2= 821, 822, 823,
 &end
#
# 38 LEU HB3 52 ALA QB 5.41 
 &rst
  ixpk= 0, nxpk= 0, iat= 582,  -1, r1= 1.30, r2= 1.80, r3= 6.50, r4= 7.00,
 igr2= 821, 822, 823,
 &end
#
# 12 ILE HB 52 ALA QB 3.51 
 &rst
  ixpk= 0, nxpk= 0, iat= 184,  -1, r1= 1.30, r2= 1.80, r3= 4.22, r4= 4.72,
 igr2= 821, 822, 823,
 &end
#
# 39 LEU QD2 52 ALA QB 3.25 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.69, r4= 5.19,
 igr1= 609, 610, 611,
 igr2= 821, 822, 823,
 &end
#
# 24 LEU QD1 52 ALA QB 3.61 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.21, r4= 5.71,
 igr1= 359, 360, 361,
 igr2= 821, 822, 823,
 &end
#
# 15 LEU QD1 52 ALA QB 3.73 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.38, r4= 5.88,
 igr1= 222, 223, 224,
 igr2= 821, 822, 823,
 &end
#
# 52 ALA H 52 ALA QB 3.96 
 &rst
  ixpk= 0, nxpk= 0, iat= 817,  -1, r1= 1.30, r2= 1.80, r3= 4.76, r4= 5.26,
 igr2= 821, 822, 823,
 &end
#
# 63 LYS HA 63 LYS HG3 4.22 
 &rst
  ixpk= 0, nxpk= 0, iat= 971, 977, r1= 1.30, r2= 1.80, r3= 4.22, r4= 4.72,  &end
#
# 70 ASN HD22 80 LYS HG3 5.50 
 &rst
  ixpk= 0, nxpk= 0, iat=1085,1227, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
# 80 LYS HG3 82 GLU HB3 5.50 
 &rst
  ixpk= 0, nxpk= 0, iat=1227,1262, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
# 80 LYS H 80 LYS HG3 4.86 
 &rst
  ixpk= 0, nxpk= 0, iat=1219,1227, r1= 1.30, r2= 1.80, r3= 4.86, r4= 5.36,  &end
#
# 46 ASN HB3 47 LYS HG2 5.50 
 &rst
  ixpk= 0, nxpk= 0, iat= 724, 740, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
# 63 LYS H 63 LYS HG2 4.39 
 &rst
  ixpk= 0, nxpk= 0, iat= 969, 976, r1= 1.30, r2= 1.80, r3= 4.39, r4= 4.89,  &end
#
# 60 ALA HA 63 LYS HG2 5.06 
 &rst
  ixpk= 0, nxpk= 0, iat= 939, 976, r1= 1.30, r2= 1.80, r3= 5.06, r4= 5.56,  &end
#
# 63 LYS HA 63 LYS HG2 3.97 
 &rst
  ixpk= 0, nxpk= 0, iat= 971, 976, r1= 1.30, r2= 1.80, r3= 3.97, r4= 4.47,  &end
#
# 63 LYS HG2 64 ASP H 5.34 
 &rst
  ixpk= 0, nxpk= 0, iat= 976, 991, r1= 1.30, r2= 1.80, r3= 5.34, r4= 5.84,  &end
#
# 80 LYS HG2 82 GLU H 5.50 
 &rst
  ixpk= 0, nxpk= 0, iat=1226,1257, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
# 11 PHE QD 80 LYS HG2 5.50 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1226, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 168, 176,
 &end
#
# 11 PHE QE 80 LYS HG2 5.50 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1226, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 170, 174,
 &end
#
# 80 LYS HG2 81 VAL HA 5.50 
 &rst
  ixpk= 0, nxpk= 0, iat=1226,1243, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
# 5 ASP HA 86 LYS HG3 5.11 
 &rst
  ixpk= 0, nxpk= 0, iat=  64,1321, r1= 1.30, r2= 1.80, r3= 5.11, r4= 5.61,  &end
#
# 86 LYS H 86 LYS HG2 4.54 
 &rst
  ixpk= 0, nxpk= 0, iat=1313,1320, r1= 1.30, r2= 1.80, r3= 4.54, r4= 5.04,  &end
#
# 5 ASP HA 86 LYS HG2 4.97 
 &rst
  ixpk= 0, nxpk= 0, iat=  64,1320, r1= 1.30, r2= 1.80, r3= 4.97, r4= 5.47,  &end
#
# 86 LYS HG2 87 PRO HD3 5.50 
 &rst
  ixpk= 0, nxpk= 0, iat=1320,1337, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
# 38 LEU H 38 LEU QD1 4.65 
 &rst
  ixpk= 0, nxpk= 0, iat= 577,  -1, r1= 1.30, r2= 1.80, r3= 5.58, r4= 6.08,
 igr2= 586, 587, 588,
 &end
#
# 38 LEU QD1 53 PHE QD 4.47 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.03, r4= 6.53,
 igr1= 586, 587, 588,
 igr2= 835, 843,
 &end
#
# 38 LEU HA 38 LEU QD1 4.61 
 &rst
  ixpk= 0, nxpk= 0, iat= 579,  -1, r1= 1.30, r2= 1.80, r3= 5.54, r4= 6.04,
 igr2= 586, 587, 588,
 &end
#
# 38 LEU QD1 53 PHE H 5.50 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 827, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr1= 586, 587, 588,
 &end
#
# 38 LEU QD1 40 MET QE 4.97 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.17, r4= 7.67,
 igr1= 586, 587, 588,
 igr2= 626, 627, 628,
 &end
#
# 38 LEU HB3 38 LEU QD1 3.64 
 &rst
  ixpk= 0, nxpk= 0, iat= 582,  -1, r1= 1.30, r2= 1.80, r3= 4.37, r4= 4.87,
 igr2= 586, 587, 588,
 &end
#
# 47 LYS H 47 LYS HG3 5.14 
 &rst
  ixpk= 0, nxpk= 0, iat= 733, 741, r1= 1.30, r2= 1.80, r3= 5.14, r4= 5.64,  &end
#
# 22 LYS HA 22 LYS HG2 4.10 
 &rst
  ixpk= 0, nxpk= 0, iat= 320, 325, r1= 1.30, r2= 1.80, r3= 4.10, r4= 4.60,  &end
#
# 22 LYS HG2 22 LYS QE 3.90 
 &rst
  ixpk= 0, nxpk= 0, iat= 325,  -1, r1= 1.30, r2= 1.80, r3= 4.38, r4= 4.88,
 igr2= 331, 332,
 &end
#
# 9 LYS HG3 53 PHE QD 5.34 
 &rst
  ixpk= 0, nxpk= 0, iat= 127,  -1, r1= 1.30, r2= 1.80, r3= 5.99, r4= 6.49,
 igr2= 835, 843,
 &end
#
# 40 MET HA 41 LYS HG3 5.50 
 &rst
  ixpk= 0, nxpk= 0, iat= 617, 640, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
# 41 LYS HG3 41 LYS QE 4.21 
 &rst
  ixpk= 0, nxpk= 0, iat= 640,  -1, r1= 1.30, r2= 1.80, r3= 4.73, r4= 5.23,
 igr2= 645, 646,
 &end
#
# 39 LEU QD1 41 LYS HG3 5.27 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 640, r1= 1.30, r2= 1.80, r3= 6.33, r4= 6.83,
 igr1= 605, 606, 607,
 &end
#
# 41 LYS HG2 42 ASP H 5.14 
 &rst
  ixpk= 0, nxpk= 0, iat= 639, 654, r1= 1.30, r2= 1.80, r3= 5.14, r4= 5.64,  &end
#
# 41 LYS HG2 41 LYS QE 4.23 
 &rst
  ixpk= 0, nxpk= 0, iat= 639,  -1, r1= 1.30, r2= 1.80, r3= 4.75, r4= 5.25,
 igr2= 645, 646,
 &end
#
# 41 LYS HG2 49 ARG H 5.16 
 &rst
  ixpk= 0, nxpk= 0, iat= 639, 766, r1= 1.30, r2= 1.80, r3= 5.16, r4= 5.66,  &end
#
# 39 LEU QD2 41 LYS HG2 5.50 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 639, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr1= 609, 610, 611,
 &end
#
# 77 LYS HG3 77 LYS QE 4.12 
 &rst
  ixpk= 0, nxpk= 0, iat=1176,  -1, r1= 1.30, r2= 1.80, r3= 4.62, r4= 5.12,
 igr2=1181,1182,
 &end
#
# 39 LEU QD2 41 LYS HG3 5.50 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 640, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr1= 609, 610, 611,
 &end
#
# 74 LEU QD2 75 ASP H 4.54 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1149, r1= 1.30, r2= 1.80, r3= 5.45, r4= 5.95,
 igr1=1143,1144,1145,
 &end
#
# 74 LEU H 74 LEU QD2 4.98 
 &rst
  ixpk= 0, nxpk= 0, iat=1130,  -1, r1= 1.30, r2= 1.80, r3= 5.98, r4= 6.48,
 igr2=1143,1144,1145,
 &end
#
# 28 PHE QE 74 LEU QD2 4.81 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.48, r4= 6.98,
 igr1= 420, 424,
 igr2=1143,1144,1145,
 &end
#
# 24 LEU HA 74 LEU QD2 5.30 
 &rst
  ixpk= 0, nxpk= 0, iat= 352,  -1, r1= 1.30, r2= 1.80, r3= 6.36, r4= 6.86,
 igr2=1143,1144,1145,
 &end
#
# 74 LEU HB3 74 LEU QD2 4.04 
 &rst
  ixpk= 0, nxpk= 0, iat=1135,  -1, r1= 1.30, r2= 1.80, r3= 4.85, r4= 5.35,
 igr2=1143,1144,1145,
 &end
#
# 74 LEU HB2 74 LEU QD2 3.19 
 &rst
  ixpk= 0, nxpk= 0, iat=1134,  -1, r1= 1.30, r2= 1.80, r3= 3.83, r4= 4.33,
 igr2=1143,1144,1145,
 &end
#
# 74 LEU QD2 79 ILE QD1 3.02 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.36, r4= 4.86,
 igr1=1143,1144,1145,
 igr2=1213,1214,1215,
 &end
#
# 27 VAL QG2 74 LEU QD2 3.51 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.06, r4= 5.56,
 igr1= 404, 405, 406,
 igr2=1143,1144,1145,
 &end
#
# 74 LEU H 79 ILE QG1 4.73 
 &rst
  ixpk= 0, nxpk= 0, iat=1130,  -1, r1= 1.30, r2= 1.80, r3= 5.31, r4= 5.81,
 igr2=1210,1211,
 &end
#
# 77 LYS H 77 LYS HG3 4.50 
 &rst
  ixpk= 0, nxpk= 0, iat=1168,1176, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
# 16 ASN HA 77 LYS HG2 4.75 
 &rst
  ixpk= 0, nxpk= 0, iat= 234,1175, r1= 1.30, r2= 1.80, r3= 4.75, r4= 5.25,  &end
#
# 15 LEU HA 77 LYS HG2 5.50 
 &rst
  ixpk= 0, nxpk= 0, iat= 215,1175, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
# 77 LYS HG2 77 LYS QE 4.22 
 &rst
  ixpk= 0, nxpk= 0, iat=1175,  -1, r1= 1.30, r2= 1.80, r3= 4.74, r4= 5.24,
 igr2=1181,1182,
 &end
#
# 15 LEU QD2 80 LYS H 5.50 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1219, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr1= 226, 227, 228,
 &end
#
# 15 LEU QD2 16 ASN H 4.38 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 232, r1= 1.30, r2= 1.80, r3= 5.26, r4= 5.76,
 igr1= 226, 227, 228,
 &end
#
# 15 LEU QD2 51 PHE HA 5.25 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 799, r1= 1.30, r2= 1.80, r3= 6.30, r4= 6.80,
 igr1= 226, 227, 228,
 &end
#
# 15 LEU QD2 79 ILE HA 5.23 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1202, r1= 1.30, r2= 1.80, r3= 6.28, r4= 6.78,
 igr1= 226, 227, 228,
 &end
#
# 15 LEU HA 15 LEU QD2 3.47 
 &rst
  ixpk= 0, nxpk= 0, iat= 215,  -1, r1= 1.30, r2= 1.80, r3= 4.17, r4= 4.67,
 igr2= 226, 227, 228,
 &end
#
# 15 LEU QD2 74 LEU HB3 4.66 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1135, r1= 1.30, r2= 1.80, r3= 5.60, r4= 6.10,
 igr1= 226, 227, 228,
 &end
#
# 15 LEU QD2 79 ILE QG1 4.68 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.31, r4= 6.81,
 igr1= 226, 227, 228,
 igr2=1210,1211,
 &end
#
# 15 LEU HB3 15 LEU QD2 3.62 
 &rst
  ixpk= 0, nxpk= 0, iat= 218,  -1, r1= 1.30, r2= 1.80, r3= 4.35, r4= 4.85,
 igr2= 226, 227, 228,
 &end
#
# 15 LEU HB2 15 LEU QD2 3.49 
 &rst
  ixpk= 0, nxpk= 0, iat= 217,  -1, r1= 1.30, r2= 1.80, r3= 4.19, r4= 4.69,
 igr2= 226, 227, 228,
 &end
#
# 12 ILE QD1 15 LEU QD2 5.50 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.93, r4= 8.43,
 igr1= 193, 194, 195,
 igr2= 226, 227, 228,
 &end
#
# 16 ASN HB3 77 LYS HG3 5.01 
 &rst
  ixpk= 0, nxpk= 0, iat= 237,1176, r1= 1.30, r2= 1.80, r3= 5.01, r4= 5.51,  &end
#
# 16 ASN H 77 LYS HG2 5.25 
 &rst
  ixpk= 0, nxpk= 0, iat= 232,1175, r1= 1.30, r2= 1.80, r3= 5.25, r4= 5.75,  &end
#
# 12 ILE H 81 VAL QG1 5.47 
 &rst
  ixpk= 0, nxpk= 0, iat= 180,  -1, r1= 1.30, r2= 1.80, r3= 6.57, r4= 7.07,
 igr2=1247,1248,1249,
 &end
#
# 38 LEU QD2 53 PHE HB2 5.42 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 831, r1= 1.30, r2= 1.80, r3= 6.51, r4= 7.01,
 igr1= 590, 591, 592,
 &end
#
# 27 VAL HA 30 LYS HG3 5.19 
 &rst
  ixpk= 0, nxpk= 0, iat= 396, 445, r1= 1.30, r2= 1.80, r3= 5.19, r4= 5.69,  &end
#
# 81 VAL QG1 82 GLU H 3.60 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1257, r1= 1.30, r2= 1.80, r3= 4.32, r4= 4.82,
 igr1=1247,1248,1249,
 &end
#
# 81 VAL H 81 VAL QG1 4.66 
 &rst
  ixpk= 0, nxpk= 0, iat=1241,  -1, r1= 1.30, r2= 1.80, r3= 5.60, r4= 6.10,
 igr2=1247,1248,1249,
 &end
#
# 66 ALA H 81 VAL QG1 4.49 
 &rst
  ixpk= 0, nxpk= 0, iat=1013,  -1, r1= 1.30, r2= 1.80, r3= 5.39, r4= 5.89,
 igr2=1247,1248,1249,
 &end
#
# 10 LEU HB3 81 VAL QG1 4.47 
 &rst
  ixpk= 0, nxpk= 0, iat= 146,  -1, r1= 1.30, r2= 1.80, r3= 5.37, r4= 5.87,
 igr2=1247,1248,1249,
 &end
#
# 10 LEU QD2 81 VAL QG1 3.59 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.18, r4= 5.68,
 igr1= 154, 155, 156,
 igr2=1247,1248,1249,
 &end
#
# 30 LYS HG3 31 TYR H 5.12 
 &rst
  ixpk= 0, nxpk= 0, iat= 445, 459, r1= 1.30, r2= 1.80, r3= 5.12, r4= 5.62,  &end
#
# 30 LYS HG3 31 TYR QD 5.50 
 &rst
  ixpk= 0, nxpk= 0, iat= 445,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2= 467, 476,
 &end
#
# 30 LYS HG3 31 TYR QE 5.50 
 &rst
  ixpk= 0, nxpk= 0, iat= 445,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2= 469, 474,
 &end
#
# 21 GLU H 39 LEU QD2 5.09 
 &rst
  ixpk= 0, nxpk= 0, iat= 303,  -1, r1= 1.30, r2= 1.80, r3= 6.11, r4= 6.61,
 igr2= 609, 610, 611,
 &end
#
# 39 LEU QD2 40 MET H 3.70 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 615, r1= 1.30, r2= 1.80, r3= 4.44, r4= 4.94,
 igr1= 609, 610, 611,
 &end
#
# 39 LEU QD2 52 ALA HA 4.41 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 819, r1= 1.30, r2= 1.80, r3= 5.30, r4= 5.80,
 igr1= 609, 610, 611,
 &end
#
# 39 LEU HA 39 LEU QD2 3.42 
 &rst
  ixpk= 0, nxpk= 0, iat= 598,  -1, r1= 1.30, r2= 1.80, r3= 4.11, r4= 4.61,
 igr2= 609, 610, 611,
 &end
#
# 39 LEU QD2 50 GLY HA2 5.44 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 792, r1= 1.30, r2= 1.80, r3= 6.53, r4= 7.03,
 igr1= 609, 610, 611,
 &end
#
# 39 LEU QD2 41 LYS QE 4.99 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.73, r4= 7.23,
 igr1= 609, 610, 611,
 igr2= 645, 646,
 &end
#
# 24 LEU QD2 25 GLU H 5.11 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 369, r1= 1.30, r2= 1.80, r3= 6.14, r4= 6.64,
 igr1= 363, 364, 365,
 &end
#
# 24 LEU QD2 28 PHE QD 4.18 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.63, r4= 6.13,
 igr1= 363, 364, 365,
 igr2= 418, 426,
 &end
#
# 24 LEU QD2 28 PHE QE 3.77 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.08, r4= 5.58,
 igr1= 363, 364, 365,
 igr2= 420, 424,
 &end
#
# 24 LEU HA 24 LEU QD2 3.16 
 &rst
  ixpk= 0, nxpk= 0, iat= 352,  -1, r1= 1.30, r2= 1.80, r3= 3.79, r4= 4.29,
 igr2= 363, 364, 365,
 &end
#
# 24 LEU HB3 24 LEU QD2 3.84 
 &rst
  ixpk= 0, nxpk= 0, iat= 355,  -1, r1= 1.30, r2= 1.80, r3= 4.61, r4= 5.11,
 igr2= 363, 364, 365,
 &end
#
# 19 THR QG2 24 LEU QD2 3.61 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.21, r4= 5.71,
 igr1= 281, 282, 283,
 igr2= 363, 364, 365,
 &end
#
# 24 LEU HB2 24 LEU QD2 3.45 
 &rst
  ixpk= 0, nxpk= 0, iat= 354,  -1, r1= 1.30, r2= 1.80, r3= 4.14, r4= 4.64,
 igr2= 363, 364, 365,
 &end
#
# 39 LEU QD2 51 PHE HA 5.50 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 799, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr1= 609, 610, 611,
 &end
#
# 39 LEU QD2 48 SER HB2 5.40 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 759, r1= 1.30, r2= 1.80, r3= 6.49, r4= 6.99,
 igr1= 609, 610, 611,
 &end
#
# 21 GLU HA 39 LEU QD2 4.80 
 &rst
  ixpk= 0, nxpk= 0, iat= 305,  -1, r1= 1.30, r2= 1.80, r3= 5.76, r4= 6.26,
 igr2= 609, 610, 611,
 &end
#
# 19 THR QG2 24 LEU H 4.40 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 350, r1= 1.30, r2= 1.80, r3= 5.28, r4= 5.78,
 igr1= 281, 282, 283,
 &end
#
# 19 THR QG2 23 ALA HA 5.27 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 342, r1= 1.30, r2= 1.80, r3= 6.33, r4= 6.83,
 igr1= 281, 282, 283,
 &end
#
# 16 ASN H 19 THR QG2 5.50 
 &rst
  ixpk= 0, nxpk= 0, iat= 232,  -1, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr2= 281, 282, 283,
 &end
#
# 19 THR QG2 20 ASN HA 5.32 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 291, r1= 1.30, r2= 1.80, r3= 6.39, r4= 6.89,
 igr1= 281, 282, 283,
 &end
#
# 19 THR QG2 23 ALA QB 3.40 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.90, r4= 5.40,
 igr1= 281, 282, 283,
 igr2= 344, 345, 346,
 &end
#
# 19 THR QG2 24 LEU QD1 4.55 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.56, r4= 7.06,
 igr1= 281, 282, 283,
 igr2= 359, 360, 361,
 &end
#
# 19 THR QG2 23 ALA H 4.81 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 340, r1= 1.30, r2= 1.80, r3= 5.78, r4= 6.28,
 igr1= 281, 282, 283,
 &end
#
# 19 THR HA 19 THR QG2 3.54 
 &rst
  ixpk= 0, nxpk= 0, iat= 277,  -1, r1= 1.30, r2= 1.80, r3= 4.25, r4= 4.75,
 igr2= 281, 282, 283,
 &end
#
# 19 THR QG2 74 LEU HG 4.85 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1137, r1= 1.30, r2= 1.80, r3= 5.82, r4= 6.32,
 igr1= 281, 282, 283,
 &end
#
# 15 LEU HB3 19 THR QG2 3.42 
 &rst
  ixpk= 0, nxpk= 0, iat= 218,  -1, r1= 1.30, r2= 1.80, r3= 4.11, r4= 4.61,
 igr2= 281, 282, 283,
 &end
#
# 19 THR QG2 27 VAL QG1 4.20 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.06, r4= 6.56,
 igr1= 281, 282, 283,
 igr2= 400, 401, 402,
 &end
#
# 15 LEU QD1 19 THR QG2 4.72 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.81, r4= 7.31,
 igr1= 222, 223, 224,
 igr2= 281, 282, 283,
 &end
#
# 10 LEU QD2 11 PHE H 4.21 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 160, r1= 1.30, r2= 1.80, r3= 5.06, r4= 5.56,
 igr1= 154, 155, 156,
 &end
#
# 10 LEU QD2 82 GLU H 4.86 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1257, r1= 1.30, r2= 1.80, r3= 5.84, r4= 6.34,
 igr1= 154, 155, 156,
 &end
#
# 10 LEU H 10 LEU QD2 4.67 
 &rst
  ixpk= 0, nxpk= 0, iat= 141,  -1, r1= 1.30, r2= 1.80, r3= 5.61, r4= 6.11,
 igr2= 154, 155, 156,
 &end
#
# 10 LEU QD2 83 GLN H 4.57 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1272, r1= 1.30, r2= 1.80, r3= 5.49, r4= 5.99,
 igr1= 154, 155, 156,
 &end
#
# 10 LEU HA 10 LEU QD2 3.49 
 &rst
  ixpk= 0, nxpk= 0, iat= 143,  -1, r1= 1.30, r2= 1.80, r3= 4.19, r4= 4.69,
 igr2= 154, 155, 156,
 &end
#
# 10 LEU QD2 63 LYS HA 5.24 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 971, r1= 1.30, r2= 1.80, r3= 6.29, r4= 6.79,
 igr1= 154, 155, 156,
 &end
#
# 17 THR QG2 48 SER H 4.41 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 755, r1= 1.30, r2= 1.80, r3= 5.30, r4= 5.80,
 igr1= 252, 253, 254,
 &end
#
# 17 THR QG2 19 THR H 5.50 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 275, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr1= 252, 253, 254,
 &end
#
# 17 THR QG2 47 LYS QE 5.15 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.94, r4= 7.44,
 igr1= 252, 253, 254,
 igr2= 746, 747,
 &end
#
# 17 THR QG2 18 GLU HG3 5.50 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 268, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr1= 252, 253, 254,
 &end
#
# 17 THR QG2 50 GLY HA2 4.97 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 792, r1= 1.30, r2= 1.80, r3= 5.97, r4= 6.47,
 igr1= 252, 253, 254,
 &end
#
# 27 VAL QG1 28 PHE H 4.27 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 410, r1= 1.30, r2= 1.80, r3= 5.13, r4= 5.63,
 igr1= 400, 401, 402,
 &end
#
# 26 ALA H 27 VAL QG1 4.59 
 &rst
  ixpk= 0, nxpk= 0, iat= 384,  -1, r1= 1.30, r2= 1.80, r3= 5.51, r4= 6.01,
 igr2= 400, 401, 402,
 &end
#
# 27 VAL H 27 VAL QG1 3.32 
 &rst
  ixpk= 0, nxpk= 0, iat= 394,  -1, r1= 1.30, r2= 1.80, r3= 3.99, r4= 4.49,
 igr2= 400, 401, 402,
 &end
#
# 27 VAL QG1 28 PHE QD 4.95 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.67, r4= 7.17,
 igr1= 400, 401, 402,
 igr2= 418, 426,
 &end
#
# 24 LEU HA 27 VAL QG1 4.04 
 &rst
  ixpk= 0, nxpk= 0, iat= 352,  -1, r1= 1.30, r2= 1.80, r3= 4.85, r4= 5.35,
 igr2= 400, 401, 402,
 &end
#
# 27 VAL HA 27 VAL QG1 3.24 
 &rst
  ixpk= 0, nxpk= 0, iat= 396,  -1, r1= 1.30, r2= 1.80, r3= 3.89, r4= 4.39,
 igr2= 400, 401, 402,
 &end
#
# 27 VAL QG1 30 LYS QE 5.50 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1= 400, 401, 402,
 igr2= 450, 451,
 &end
#
# 23 ALA QB 27 VAL QG1 4.00 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.77, r4= 6.27,
 igr1= 344, 345, 346,
 igr2= 400, 401, 402,
 &end
#
# 26 ALA QB 27 VAL QG1 3.93 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1= 388, 389, 390,
 igr2= 400, 401, 402,
 &end
#
# 27 VAL QG1 30 LYS QD 4.07 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.49, r4= 5.99,
 igr1= 400, 401, 402,
 igr2= 447, 448,
 &end
#
# 27 VAL QG1 74 LEU QD2 3.26 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.70, r4= 5.20,
 igr1= 400, 401, 402,
 igr2=1143,1144,1145,
 &end
#
# 27 VAL QG1 74 LEU QD1 3.76 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.42, r4= 5.92,
 igr1= 400, 401, 402,
 igr2=1139,1140,1141,
 &end
#
# 10 LEU QD2 82 GLU HA 5.17 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1259, r1= 1.30, r2= 1.80, r3= 6.21, r4= 6.71,
 igr1= 154, 155, 156,
 &end
#
# 10 LEU QD2 56 PHE H 5.50 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 877, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr1= 154, 155, 156,
 &end
#
# 10 LEU QD2 66 ALA H 4.79 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1013, r1= 1.30, r2= 1.80, r3= 5.75, r4= 6.25,
 igr1= 154, 155, 156,
 &end
#
# 70 ASN HB2 81 VAL QG2 5.41 
 &rst
  ixpk= 0, nxpk= 0, iat=1080,  -1, r1= 1.30, r2= 1.80, r3= 6.50, r4= 7.00,
 igr2=1251,1252,1253,
 &end
#
# 71 GLY H 81 VAL QG2 4.14 
 &rst
  ixpk= 0, nxpk= 0, iat=1090,  -1, r1= 1.30, r2= 1.80, r3= 4.97, r4= 5.47,
 igr2=1251,1252,1253,
 &end
#
# 81 VAL H 81 VAL QG2 4.00 
 &rst
  ixpk= 0, nxpk= 0, iat=1241,  -1, r1= 1.30, r2= 1.80, r3= 4.80, r4= 5.30,
 igr2=1251,1252,1253,
 &end
#
# 72 LYS H 81 VAL QG2 5.50 
 &rst
  ixpk= 0, nxpk= 0, iat=1097,  -1, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr2=1251,1252,1253,
 &end
#
# 81 VAL HA 81 VAL QG2 3.69 
 &rst
  ixpk= 0, nxpk= 0, iat=1243,  -1, r1= 1.30, r2= 1.80, r3= 4.43, r4= 4.93,
 igr2=1251,1252,1253,
 &end
#
# 70 ASN HB3 81 VAL QG2 4.70 
 &rst
  ixpk= 0, nxpk= 0, iat=1081,  -1, r1= 1.30, r2= 1.80, r3= 5.64, r4= 6.14,
 igr2=1251,1252,1253,
 &end
#
# 69 MET QG 81 VAL QG2 5.50 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1=1066,1067,
 igr2=1251,1252,1253,
 &end
#
# 69 MET HB3 81 VAL QG2 3.80 
 &rst
  ixpk= 0, nxpk= 0, iat=1064,  -1, r1= 1.30, r2= 1.80, r3= 4.56, r4= 5.06,
 igr2=1251,1252,1253,
 &end
#
# 79 ILE QG1 81 VAL QG2 3.75 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.06, r4= 5.56,
 igr1=1210,1211,
 igr2=1251,1252,1253,
 &end
#
# 79 ILE QD1 81 VAL QG2 3.48 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.02, r4= 5.52,
 igr1=1213,1214,1215,
 igr2=1251,1252,1253,
 &end
#
# 12 ILE QD1 81 VAL QG2 4.28 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 193, 194, 195,
 igr2=1251,1252,1253,
 &end
#
# 37 VAL H 37 VAL QG2 3.80 
 &rst
  ixpk= 0, nxpk= 0, iat= 561,  -1, r1= 1.30, r2= 1.80, r3= 4.56, r4= 5.06,
 igr2= 571, 572, 573,
 &end
#
# 26 ALA H 37 VAL QG2 5.50 
 &rst
  ixpk= 0, nxpk= 0, iat= 384,  -1, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr2= 571, 572, 573,
 &end
#
# 24 LEU H 37 VAL QG2 5.50 
 &rst
  ixpk= 0, nxpk= 0, iat= 350,  -1, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr2= 571, 572, 573,
 &end
#
# 37 VAL QG2 54 VAL HA 4.68 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 849, r1= 1.30, r2= 1.80, r3= 5.62, r4= 6.12,
 igr1= 571, 572, 573,
 &end
#
# 36 GLU HA 37 VAL QG2 4.69 
 &rst
  ixpk= 0, nxpk= 0, iat= 548,  -1, r1= 1.30, r2= 1.80, r3= 5.63, r4= 6.13,
 igr2= 571, 572, 573,
 &end
#
# 37 VAL HA 37 VAL QG2 3.49 
 &rst
  ixpk= 0, nxpk= 0, iat= 563,  -1, r1= 1.30, r2= 1.80, r3= 4.19, r4= 4.69,
 igr2= 571, 572, 573,
 &end
#
# 25 GLU HA 37 VAL QG2 3.94 
 &rst
  ixpk= 0, nxpk= 0, iat= 371,  -1, r1= 1.30, r2= 1.80, r3= 4.73, r4= 5.23,
 igr2= 571, 572, 573,
 &end
#
# 34 ILE HB 37 VAL QG2 4.52 
 &rst
  ixpk= 0, nxpk= 0, iat= 515,  -1, r1= 1.30, r2= 1.80, r3= 5.43, r4= 5.93,
 igr2= 571, 572, 573,
 &end
#
# 34 ILE HG13 37 VAL QG2 4.61 
 &rst
  ixpk= 0, nxpk= 0, iat= 522,  -1, r1= 1.30, r2= 1.80, r3= 5.54, r4= 6.04,
 igr2= 571, 572, 573,
 &end
#
# 34 ILE QG2 37 VAL QG2 3.25 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.69, r4= 5.19,
 igr1= 517, 518, 519,
 igr2= 571, 572, 573,
 &end
#
# 54 VAL H 54 VAL QG1 4.12 
 &rst
  ixpk= 0, nxpk= 0, iat= 847,  -1, r1= 1.30, r2= 1.80, r3= 4.95, r4= 5.45,
 igr2= 853, 854, 855,
 &end
#
# 28 PHE QD 54 VAL QG1 4.97 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.70, r4= 7.20,
 igr1= 418, 426,
 igr2= 853, 854, 855,
 &end
#
# 54 VAL HA 54 VAL QG1 3.75 
 &rst
  ixpk= 0, nxpk= 0, iat= 849,  -1, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,
 igr2= 853, 854, 855,
 &end
#
# 37 VAL HA 54 VAL QG1 5.00 
 &rst
  ixpk= 0, nxpk= 0, iat= 563,  -1, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,
 igr2= 853, 854, 855,
 &end
#
# 25 GLU HA 54 VAL QG1 5.50 
 &rst
  ixpk= 0, nxpk= 0, iat= 371,  -1, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr2= 853, 854, 855,
 &end
#
# 28 PHE HB3 54 VAL QG1 5.24 
 &rst
  ixpk= 0, nxpk= 0, iat= 415,  -1, r1= 1.30, r2= 1.80, r3= 6.29, r4= 6.79,
 igr2= 853, 854, 855,
 &end
#
# 28 PHE HB2 54 VAL QG1 5.05 
 &rst
  ixpk= 0, nxpk= 0, iat= 414,  -1, r1= 1.30, r2= 1.80, r3= 6.06, r4= 6.56,
 igr2= 853, 854, 855,
 &end
#
# 10 LEU HB3 54 VAL QG1 4.93 
 &rst
  ixpk= 0, nxpk= 0, iat= 146,  -1, r1= 1.30, r2= 1.80, r3= 5.92, r4= 6.42,
 igr2= 853, 854, 855,
 &end
#
# 37 VAL QG2 54 VAL QG1 3.47 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50,
 igr1= 571, 572, 573,
 igr2= 853, 854, 855,
 &end
#
# 12 ILE QG2 54 VAL QG1 4.14 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.97, r4= 6.47,
 igr1= 186, 187, 188,
 igr2= 853, 854, 855,
 &end
#
# 10 LEU H 55 THR QG2 5.10 
 &rst
  ixpk= 0, nxpk= 0, iat= 141,  -1, r1= 1.30, r2= 1.80, r3= 6.12, r4= 6.62,
 igr2= 869, 870, 871,
 &end
#
# 55 THR QG2 56 PHE H 3.73 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 877, r1= 1.30, r2= 1.80, r3= 4.48, r4= 4.98,
 igr1= 869, 870, 871,
 &end
#
# 9 LYS H 55 THR QG2 4.86 
 &rst
  ixpk= 0, nxpk= 0, iat= 119,  -1, r1= 1.30, r2= 1.80, r3= 5.84, r4= 6.34,
 igr2= 869, 870, 871,
 &end
#
# 36 GLU H 55 THR QG2 4.45 
 &rst
  ixpk= 0, nxpk= 0, iat= 546,  -1, r1= 1.30, r2= 1.80, r3= 5.34, r4= 5.84,
 igr2= 869, 870, 871,
 &end
#
# 55 THR HA 55 THR QG2 3.46 
 &rst
  ixpk= 0, nxpk= 0, iat= 865,  -1, r1= 1.30, r2= 1.80, r3= 4.16, r4= 4.66,
 igr2= 869, 870, 871,
 &end
#
# 55 THR QG2 56 PHE HB2 5.13 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 881, r1= 1.30, r2= 1.80, r3= 6.16, r4= 6.66,
 igr1= 869, 870, 871,
 &end
#
# 9 LYS HB2 55 THR QG2 4.29 
 &rst
  ixpk= 0, nxpk= 0, iat= 123,  -1, r1= 1.30, r2= 1.80, r3= 5.15, r4= 5.65,
 igr2= 869, 870, 871,
 &end
#
# 55 THR QG2 62 ALA QB 5.06 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.30, r4= 7.80,
 igr1= 869, 870, 871,
 igr2= 963, 964, 965,
 &end
#
# 55 THR QG2 56 PHE HB3 5.50 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 882, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr1= 869, 870, 871,
 &end
#
# 2 VAL QG1 3 GLU HA 4.43 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  39, r1= 1.30, r2= 1.80, r3= 5.32, r4= 5.82,
 igr1=  27,  28,  29,
 &end
#
# 10 LEU H 54 VAL QG1 5.50 
 &rst
  ixpk= 0, nxpk= 0, iat= 141,  -1, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr2= 853, 854, 855,
 &end
#
# 38 LEU H 54 VAL QG1 4.63 
 &rst
  ixpk= 0, nxpk= 0, iat= 577,  -1, r1= 1.30, r2= 1.80, r3= 5.56, r4= 6.06,
 igr2= 853, 854, 855,
 &end
#
# 54 VAL QG1 55 THR H 4.53 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 863, r1= 1.30, r2= 1.80, r3= 5.44, r4= 5.94,
 igr1= 853, 854, 855,
 &end
#
# 54 VAL QG1 56 PHE QR 5.23 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.91, r4= 8.41,
 igr1= 853, 854, 855,
 igr2= 885, 893, 887, 891,
 &end
#
# 28 PHE QE 54 VAL QG1 5.27 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.10, r4= 7.60,
 igr1= 420, 424,
 igr2= 853, 854, 855,
 &end
#
# 28 PHE H 54 VAL QG2 5.50 
 &rst
  ixpk= 0, nxpk= 0, iat= 410,  -1, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr2= 857, 858, 859,
 &end
#
# 54 VAL HA 54 VAL QG2 3.79 
 &rst
  ixpk= 0, nxpk= 0, iat= 849,  -1, r1= 1.30, r2= 1.80, r3= 4.55, r4= 5.05,
 igr2= 857, 858, 859,
 &end
#
# 37 VAL HA 54 VAL QG2 4.68 
 &rst
  ixpk= 0, nxpk= 0, iat= 563,  -1, r1= 1.30, r2= 1.80, r3= 5.62, r4= 6.12,
 igr2= 857, 858, 859,
 &end
#
# 34 ILE HA 54 VAL QG2 5.50 
 &rst
  ixpk= 0, nxpk= 0, iat= 513,  -1, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr2= 857, 858, 859,
 &end
#
# 28 PHE HB3 54 VAL QG2 4.33 
 &rst
  ixpk= 0, nxpk= 0, iat= 415,  -1, r1= 1.30, r2= 1.80, r3= 5.20, r4= 5.70,
 igr2= 857, 858, 859,
 &end
#
# 34 ILE HG13 54 VAL QG2 5.18 
 &rst
  ixpk= 0, nxpk= 0, iat= 522,  -1, r1= 1.30, r2= 1.80, r3= 6.22, r4= 6.72,
 igr2= 857, 858, 859,
 &end
#
# 37 VAL QG2 54 VAL QG2 3.87 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.58, r4= 6.08,
 igr1= 571, 572, 573,
 igr2= 857, 858, 859,
 &end
#
# 12 ILE QD1 54 VAL QG2 4.44 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.40, r4= 6.90,
 igr1= 193, 194, 195,
 igr2= 857, 858, 859,
 &end
#
# 34 ILE HG12 54 VAL QG2 4.15 
 &rst
  ixpk= 0, nxpk= 0, iat= 521,  -1, r1= 1.30, r2= 1.80, r3= 4.98, r4= 5.48,
 igr2= 857, 858, 859,
 &end
#
# 45 THR H 45 THR QG2 3.54 
 &rst
  ixpk= 0, nxpk= 0, iat= 705,  -1, r1= 1.30, r2= 1.80, r3= 4.25, r4= 4.75,
 igr2= 711, 712, 713,
 &end
#
# 45 THR QG2 47 LYS QE 5.12 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.90, r4= 7.40,
 igr1= 711, 712, 713,
 igr2= 746, 747,
 &end
#
# 45 THR QG2 46 ASN HB2 5.50 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 723, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr1= 711, 712, 713,
 &end
#
# 44 GLU QB 45 THR QG2 3.74 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.04, r4= 5.54,
 igr1= 694, 695,
 igr2= 711, 712, 713,
 &end
#
# 8 GLY HA3 55 THR QG2 3.35 
 &rst
  ixpk= 0, nxpk= 0, iat= 115,  -1, r1= 1.30, r2= 1.80, r3= 4.02, r4= 4.52,
 igr2= 869, 870, 871,
 &end
#
# 35 VAL QG1 36 GLU H 4.43 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 546, r1= 1.30, r2= 1.80, r3= 5.32, r4= 5.82,
 igr1= 536, 537, 538,
 &end
#
# 2 VAL QG1 3 GLU H 4.26 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  37, r1= 1.30, r2= 1.80, r3= 5.12, r4= 5.62,
 igr1=  27,  28,  29,
 &end
#
# 2 VAL H 2 VAL QG1 4.64 
 &rst
  ixpk= 0, nxpk= 0, iat=  21,  -1, r1= 1.30, r2= 1.80, r3= 5.57, r4= 6.07,
 igr2=  27,  28,  29,
 &end
#
# 21 GLU H 37 VAL QG1 5.39 
 &rst
  ixpk= 0, nxpk= 0, iat= 303,  -1, r1= 1.30, r2= 1.80, r3= 6.47, r4= 6.97,
 igr2= 567, 568, 569,
 &end
#
# 37 VAL QG1 38 LEU H 3.78 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 577, r1= 1.30, r2= 1.80, r3= 4.54, r4= 5.04,
 igr1= 567, 568, 569,
 &end
#
# 37 VAL H 37 VAL QG1 4.39 
 &rst
  ixpk= 0, nxpk= 0, iat= 561,  -1, r1= 1.30, r2= 1.80, r3= 5.27, r4= 5.77,
 igr2= 567, 568, 569,
 &end
#
# 24 LEU H 37 VAL QG1 4.93 
 &rst
  ixpk= 0, nxpk= 0, iat= 350,  -1, r1= 1.30, r2= 1.80, r3= 5.92, r4= 6.42,
 igr2= 567, 568, 569,
 &end
#
# 37 VAL QG1 38 LEU HA 5.50 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 579, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr1= 567, 568, 569,
 &end
#
# 37 VAL QG1 54 VAL HA 5.50 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 849, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr1= 567, 568, 569,
 &end
#
# 37 VAL HA 37 VAL QG1 3.58 
 &rst
  ixpk= 0, nxpk= 0, iat= 563,  -1, r1= 1.30, r2= 1.80, r3= 4.30, r4= 4.80,
 igr2= 567, 568, 569,
 &end
#
# 22 LYS HA 37 VAL QG1 5.50 
 &rst
  ixpk= 0, nxpk= 0, iat= 320,  -1, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr2= 567, 568, 569,
 &end
#
# 21 GLU HA 37 VAL QG1 3.68 
 &rst
  ixpk= 0, nxpk= 0, iat= 305,  -1, r1= 1.30, r2= 1.80, r3= 4.42, r4= 4.92,
 igr2= 567, 568, 569,
 &end
#
# 21 GLU HG3 37 VAL QG1 4.24 
 &rst
  ixpk= 0, nxpk= 0, iat= 311,  -1, r1= 1.30, r2= 1.80, r3= 5.09, r4= 5.59,
 igr2= 567, 568, 569,
 &end
#
# 25 GLU HG3 37 VAL QG1 5.09 
 &rst
  ixpk= 0, nxpk= 0, iat= 377,  -1, r1= 1.30, r2= 1.80, r3= 6.11, r4= 6.61,
 igr2= 567, 568, 569,
 &end
#
# 37 VAL QG1 39 LEU HB3 4.36 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 601, r1= 1.30, r2= 1.80, r3= 5.24, r4= 5.74,
 igr1= 567, 568, 569,
 &end
#
# 24 LEU HG 37 VAL QG1 5.50 
 &rst
  ixpk= 0, nxpk= 0, iat= 357,  -1, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr2= 567, 568, 569,
 &end
#
# 37 VAL QG1 39 LEU HG 5.41 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 603, r1= 1.30, r2= 1.80, r3= 6.50, r4= 7.00,
 igr1= 567, 568, 569,
 &end
#
# 10 LEU H 54 VAL QG2 5.50 
 &rst
  ixpk= 0, nxpk= 0, iat= 141,  -1, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr2= 857, 858, 859,
 &end
#
# 54 VAL QG2 55 THR H 4.00 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 863, r1= 1.30, r2= 1.80, r3= 4.80, r4= 5.30,
 igr1= 857, 858, 859,
 &end
#
# 54 VAL H 54 VAL QG2 4.54 
 &rst
  ixpk= 0, nxpk= 0, iat= 847,  -1, r1= 1.30, r2= 1.80, r3= 5.45, r4= 5.95,
 igr2= 857, 858, 859,
 &end
#
# 28 PHE QD 54 VAL QG2 4.71 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.35, r4= 6.85,
 igr1= 418, 426,
 igr2= 857, 858, 859,
 &end
#
# 54 VAL QG2 56 PHE HA 5.50 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 879, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr1= 857, 858, 859,
 &end
#
# 25 GLU HA 54 VAL QG2 5.42 
 &rst
  ixpk= 0, nxpk= 0, iat= 371,  -1, r1= 1.30, r2= 1.80, r3= 6.51, r4= 7.01,
 igr2= 857, 858, 859,
 &end
#
# 28 PHE HB2 54 VAL QG2 4.38 
 &rst
  ixpk= 0, nxpk= 0, iat= 414,  -1, r1= 1.30, r2= 1.80, r3= 5.26, r4= 5.76,
 igr2= 857, 858, 859,
 &end
#
# 35 VAL H 35 VAL QG1 4.21 
 &rst
  ixpk= 0, nxpk= 0, iat= 530,  -1, r1= 1.30, r2= 1.80, r3= 5.06, r4= 5.56,
 igr2= 536, 537, 538,
 &end
#
# 35 VAL QG1 57 GLU H 4.67 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 897, r1= 1.30, r2= 1.80, r3= 5.61, r4= 6.11,
 igr1= 536, 537, 538,
 &end
#
# 33 ARG QD 35 VAL QG1 4.84 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.52, r4= 7.02,
 igr1= 497, 498,
 igr2= 536, 537, 538,
 &end
#
# 27 VAL QG2 28 PHE H 4.17 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 410, r1= 1.30, r2= 1.80, r3= 5.01, r4= 5.51,
 igr1= 404, 405, 406,
 &end
#
# 26 ALA H 27 VAL QG2 5.50 
 &rst
  ixpk= 0, nxpk= 0, iat= 384,  -1, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr2= 404, 405, 406,
 &end
#
# 27 VAL H 27 VAL QG2 4.03 
 &rst
  ixpk= 0, nxpk= 0, iat= 394,  -1, r1= 1.30, r2= 1.80, r3= 4.84, r4= 5.34,
 igr2= 404, 405, 406,
 &end
#
# 27 VAL QG2 28 PHE QD 4.46 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.01, r4= 6.51,
 igr1= 404, 405, 406,
 igr2= 418, 426,
 &end
#
# 27 VAL QG2 31 TYR QD 5.50 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1= 404, 405, 406,
 igr2= 467, 476,
 &end
#
# 27 VAL QG2 28 PHE QE 4.45 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,
 igr1= 404, 405, 406,
 igr2= 420, 424,
 &end
#
# 27 VAL QG2 28 PHE HA 4.87 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 412, r1= 1.30, r2= 1.80, r3= 5.85, r4= 6.35,
 igr1= 404, 405, 406,
 &end
#
# 24 LEU HA 27 VAL QG2 4.28 
 &rst
  ixpk= 0, nxpk= 0, iat= 352,  -1, r1= 1.30, r2= 1.80, r3= 5.14, r4= 5.64,
 igr2= 404, 405, 406,
 &end
#
# 27 VAL HA 27 VAL QG2 3.46 
 &rst
  ixpk= 0, nxpk= 0, iat= 396,  -1, r1= 1.30, r2= 1.80, r3= 4.16, r4= 4.66,
 igr2= 404, 405, 406,
 &end
#
# 27 VAL QG2 28 PHE HB2 5.50 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 414, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr1= 404, 405, 406,
 &end
#
# 27 VAL QG2 69 MET QG 5.36 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.23, r4= 7.73,
 igr1= 404, 405, 406,
 igr2=1066,1067,
 &end
#
# 27 VAL QG2 74 LEU HG 4.56 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1137, r1= 1.30, r2= 1.80, r3= 5.48, r4= 5.98,
 igr1= 404, 405, 406,
 &end
#
# 19 THR QG2 27 VAL QG2 5.50 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.93, r4= 8.43,
 igr1= 281, 282, 283,
 igr2= 404, 405, 406,
 &end
#
# 27 VAL QG2 74 LEU QD1 3.27 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,
 igr1= 404, 405, 406,
 igr2=1139,1140,1141,
 &end
#
# 2 VAL QG2 3 GLU H 4.47 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  37, r1= 1.30, r2= 1.80, r3= 5.37, r4= 5.87,
 igr1=  31,  32,  33,
 &end
#
# 2 VAL H 2 VAL QG2 3.73 
 &rst
  ixpk= 0, nxpk= 0, iat=  21,  -1, r1= 1.30, r2= 1.80, r3= 4.48, r4= 4.98,
 igr2=  31,  32,  33,
 &end
#
# 2 VAL HA 2 VAL QG2 3.60 
 &rst
  ixpk= 0, nxpk= 0, iat=  23,  -1, r1= 1.30, r2= 1.80, r3= 4.32, r4= 4.82,
 igr2=  31,  32,  33,
 &end
#
# 2 VAL QG2 3 GLU QG 5.50 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1=  31,  32,  33,
 igr2=  44,  45,
 &end
#
# 65 ALA QB 68 ASP HB3 4.94 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1052, r1= 1.30, r2= 1.80, r3= 5.93, r4= 6.43,
 igr1=1007,1008,1009,
 &end
#
# 65 ALA QB 69 MET QG 5.49 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.40, r4= 7.90,
 igr1=1007,1008,1009,
 igr2=1066,1067,
 &end
#
# 62 ALA QB 65 ALA QB 4.89 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.05, r4= 7.55,
 igr1= 963, 964, 965,
 igr2=1007,1008,1009,
 &end
#
# 10 LEU QD2 65 ALA QB 4.78 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.89, r4= 7.39,
 igr1= 154, 155, 156,
 igr2=1007,1008,1009,
 &end
#
# 65 ALA QB 66 ALA H 3.54 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1013, r1= 1.30, r2= 1.80, r3= 4.25, r4= 4.75,
 igr1=1007,1008,1009,
 &end
#
# 65 ALA H 65 ALA QB 3.25 
 &rst
  ixpk= 0, nxpk= 0, iat=1003,  -1, r1= 1.30, r2= 1.80, r3= 3.90, r4= 4.40,
 igr2=1007,1008,1009,
 &end
#
# 28 PHE QE 65 ALA QB 4.35 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.86, r4= 6.36,
 igr1= 420, 424,
 igr2=1007,1008,1009,
 &end
#
# 31 TYR HA 65 ALA QB 4.86 
 &rst
  ixpk= 0, nxpk= 0, iat= 461,  -1, r1= 1.30, r2= 1.80, r3= 5.84, r4= 6.34,
 igr2=1007,1008,1009,
 &end
#
# 63 LYS HA 65 ALA QB 5.50 
 &rst
  ixpk= 0, nxpk= 0, iat= 971,  -1, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr2=1007,1008,1009,
 &end
#
# 65 ALA QB 66 ALA HA 4.98 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1015, r1= 1.30, r2= 1.80, r3= 5.98, r4= 6.48,
 igr1=1007,1008,1009,
 &end
#
# 31 TYR HB3 65 ALA QB 3.48 
 &rst
  ixpk= 0, nxpk= 0, iat= 464,  -1, r1= 1.30, r2= 1.80, r3= 4.18, r4= 4.68,
 igr2=1007,1008,1009,
 &end
#
# 31 TYR HB2 65 ALA QB 3.86 
 &rst
  ixpk= 0, nxpk= 0, iat= 463,  -1, r1= 1.30, r2= 1.80, r3= 4.64, r4= 5.14,
 igr2=1007,1008,1009,
 &end
#
# 65 ALA QB 68 ASP HB2 5.50 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1051, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr1=1007,1008,1009,
 &end
#
# 65 ALA QB 69 MET HB3 5.32 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1064, r1= 1.30, r2= 1.80, r3= 6.39, r4= 6.89,
 igr1=1007,1008,1009,
 &end
#
# 54 VAL QG1 65 ALA QB 5.50 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.93, r4= 8.43,
 igr1= 853, 854, 855,
 igr2=1007,1008,1009,
 &end
#
# 54 VAL QG2 65 ALA QB 5.50 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.93, r4= 8.43,
 igr1= 857, 858, 859,
 igr2=1007,1008,1009,
 &end
#
# 35 VAL H 35 VAL QG2 3.36 
 &rst
  ixpk= 0, nxpk= 0, iat= 530,  -1, r1= 1.30, r2= 1.80, r3= 4.04, r4= 4.54,
 igr2= 540, 541, 542,
 &end
#
# 35 VAL QG2 57 GLU H 4.23 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 897, r1= 1.30, r2= 1.80, r3= 5.08, r4= 5.58,
 igr1= 540, 541, 542,
 &end
#
# 35 VAL QG2 36 GLU H 3.83 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 546, r1= 1.30, r2= 1.80, r3= 4.60, r4= 5.10,
 igr1= 540, 541, 542,
 &end
#
# 35 VAL QG2 56 PHE HA 4.78 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 879, r1= 1.30, r2= 1.80, r3= 5.74, r4= 6.24,
 igr1= 540, 541, 542,
 &end
#
# 35 VAL HA 35 VAL QG2 3.51 
 &rst
  ixpk= 0, nxpk= 0, iat= 532,  -1, r1= 1.30, r2= 1.80, r3= 4.22, r4= 4.72,
 igr2= 540, 541, 542,
 &end
#
# 35 VAL QG2 57 GLU HA 3.44 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 899, r1= 1.30, r2= 1.80, r3= 4.13, r4= 4.63,
 igr1= 540, 541, 542,
 &end
#
# 33 ARG QD 35 VAL QG2 5.39 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.27, r4= 7.77,
 igr1= 497, 498,
 igr2= 540, 541, 542,
 &end
#
# 35 VAL QG2 57 GLU HB3 3.78 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 902, r1= 1.30, r2= 1.80, r3= 4.54, r4= 5.04,
 igr1= 540, 541, 542,
 &end
#
# 35 VAL QG2 36 GLU HB3 4.46 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 551, r1= 1.30, r2= 1.80, r3= 5.36, r4= 5.86,
 igr1= 540, 541, 542,
 &end
#
# 35 VAL QG2 55 THR QG2 3.34 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.82, r4= 5.32,
 igr1= 540, 541, 542,
 igr2= 869, 870, 871,
 &end
#
# 10 LEU H 84 ALA QB 5.48 
 &rst
  ixpk= 0, nxpk= 0, iat= 141,  -1, r1= 1.30, r2= 1.80, r3= 6.58, r4= 7.08,
 igr2=1293,1294,1295,
 &end
#
# 84 ALA H 84 ALA QB 3.80 
 &rst
  ixpk= 0, nxpk= 0, iat=1289,  -1, r1= 1.30, r2= 1.80, r3= 4.56, r4= 5.06,
 igr2=1293,1294,1295,
 &end
#
# 5 ASP H 84 ALA QB 5.25 
 &rst
  ixpk= 0, nxpk= 0, iat=  62,  -1, r1= 1.30, r2= 1.80, r3= 6.30, r4= 6.80,
 igr2=1293,1294,1295,
 &end
#
# 83 GLN HE22 84 ALA QB 5.34 
 &rst
  ixpk= 0, nxpk= 0, iat=1284,  -1, r1= 1.30, r2= 1.80, r3= 6.41, r4= 6.91,
 igr2=1293,1294,1295,
 &end
#
# 83 GLN HE21 84 ALA QB 4.23 
 &rst
  ixpk= 0, nxpk= 0, iat=1285,  -1, r1= 1.30, r2= 1.80, r3= 5.08, r4= 5.58,
 igr2=1293,1294,1295,
 &end
#
# 53 PHE QD 84 ALA QB 4.01 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.41, r4= 5.91,
 igr1= 835, 843,
 igr2=1293,1294,1295,
 &end
#
# 9 LYS HA 84 ALA QB 5.50 
 &rst
  ixpk= 0, nxpk= 0, iat= 121,  -1, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr2=1293,1294,1295,
 &end
#
# 83 GLN HA 84 ALA QB 4.32 
 &rst
  ixpk= 0, nxpk= 0, iat=1274,  -1, r1= 1.30, r2= 1.80, r3= 5.19, r4= 5.69,
 igr2=1293,1294,1295,
 &end
#
# 9 LYS HB3 84 ALA QB 4.68 
 &rst
  ixpk= 0, nxpk= 0, iat= 124,  -1, r1= 1.30, r2= 1.80, r3= 5.62, r4= 6.12,
 igr2=1293,1294,1295,
 &end
#
# 9 LYS HG2 84 ALA QB 4.13 
 &rst
  ixpk= 0, nxpk= 0, iat= 126,  -1, r1= 1.30, r2= 1.80, r3= 4.96, r4= 5.46,
 igr2=1293,1294,1295,
 &end
#
# 4 ALA QB 83 GLN HE21 5.25 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1285, r1= 1.30, r2= 1.80, r3= 6.30, r4= 6.80,
 igr1=  56,  57,  58,
 &end
#
# 12 ILE QG2 13 GLY H 4.17 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 199, r1= 1.30, r2= 1.80, r3= 5.01, r4= 5.51,
 igr1= 186, 187, 188,
 &end
#
# 12 ILE QG2 52 ALA H 4.89 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 817, r1= 1.30, r2= 1.80, r3= 5.87, r4= 6.37,
 igr1= 186, 187, 188,
 &end
#
# 12 ILE QG2 80 LYS H 4.95 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1219, r1= 1.30, r2= 1.80, r3= 5.94, r4= 6.44,
 igr1= 186, 187, 188,
 &end
#
# 12 ILE H 12 ILE QG2 4.89 
 &rst
  ixpk= 0, nxpk= 0, iat= 180,  -1, r1= 1.30, r2= 1.80, r3= 5.87, r4= 6.37,
 igr2= 186, 187, 188,
 &end
#
# 12 ILE QG2 28 PHE HZ 4.22 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 422, r1= 1.30, r2= 1.80, r3= 5.07, r4= 5.57,
 igr1= 186, 187, 188,
 &end
#
# 12 ILE QG2 51 PHE HA 4.60 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 799, r1= 1.30, r2= 1.80, r3= 5.52, r4= 6.02,
 igr1= 186, 187, 188,
 &end
#
# 12 ILE HA 12 ILE QG2 3.78 
 &rst
  ixpk= 0, nxpk= 0, iat= 182,  -1, r1= 1.30, r2= 1.80, r3= 4.54, r4= 5.04,
 igr2= 186, 187, 188,
 &end
#
# 12 ILE QG2 79 ILE HB 4.14 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1204, r1= 1.30, r2= 1.80, r3= 4.97, r4= 5.47,
 igr1= 186, 187, 188,
 &end
#
# 12 ILE QG2 79 ILE QG1 4.78 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.44, r4= 6.94,
 igr1= 186, 187, 188,
 igr2=1210,1211,
 &end
#
# 12 ILE QG2 15 LEU HG 3.98 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 220, r1= 1.30, r2= 1.80, r3= 4.78, r4= 5.28,
 igr1= 186, 187, 188,
 &end
#
# 12 ILE QG2 81 VAL QG2 3.84 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.54, r4= 6.04,
 igr1= 186, 187, 188,
 igr2=1251,1252,1253,
 &end
#
# 12 ILE QG2 79 ILE QG2 3.40 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.90, r4= 5.40,
 igr1= 186, 187, 188,
 igr2=1206,1207,1208,
 &end
#
# 12 ILE QG2 15 LEU QD2 3.19 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.60, r4= 5.10,
 igr1= 186, 187, 188,
 igr2= 226, 227, 228,
 &end
#
# 12 ILE QG2 15 LEU QD1 4.03 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.81, r4= 6.31,
 igr1= 186, 187, 188,
 igr2= 222, 223, 224,
 &end
#
# 3 GLU H 4 ALA QB 5.15 
 &rst
  ixpk= 0, nxpk= 0, iat=  37,  -1, r1= 1.30, r2= 1.80, r3= 6.18, r4= 6.68,
 igr2=  56,  57,  58,
 &end
#
# 4 ALA H 4 ALA QB 3.33 
 &rst
  ixpk= 0, nxpk= 0, iat=  52,  -1, r1= 1.30, r2= 1.80, r3= 4.00, r4= 4.50,
 igr2=  56,  57,  58,
 &end
#
# 4 ALA QB 83 GLN HE22 5.15 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1284, r1= 1.30, r2= 1.80, r3= 6.18, r4= 6.68,
 igr1=  56,  57,  58,
 &end
#
# 4 ALA QB 85 THR HA 5.05 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1301, r1= 1.30, r2= 1.80, r3= 6.06, r4= 6.56,
 igr1=  56,  57,  58,
 &end
#
# 4 ALA QB 5 ASP HA 5.50 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  64, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr1=  56,  57,  58,
 &end
#
# 3 GLU HA 4 ALA QB 4.11 
 &rst
  ixpk= 0, nxpk= 0, iat=  39,  -1, r1= 1.30, r2= 1.80, r3= 4.94, r4= 5.44,
 igr2=  56,  57,  58,
 &end
#
# 4 ALA QB 83 GLN HG2 4.46 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1279, r1= 1.30, r2= 1.80, r3= 5.36, r4= 5.86,
 igr1=  56,  57,  58,
 &end
#
# 2 VAL QG1 4 ALA QB 5.50 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.93, r4= 8.43,
 igr1=  27,  28,  29,
 igr2=  56,  57,  58,
 &end
#
# 19 THR H 23 ALA QB 5.50 
 &rst
  ixpk= 0, nxpk= 0, iat= 275,  -1, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr2= 344, 345, 346,
 &end
#
# 20 ASN HB3 23 ALA QB 5.50 
 &rst
  ixpk= 0, nxpk= 0, iat= 294,  -1, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr2= 344, 345, 346,
 &end
#
# 21 GLU H 23 ALA QB 5.50 
 &rst
  ixpk= 0, nxpk= 0, iat= 303,  -1, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr2= 344, 345, 346,
 &end
#
# 23 ALA QB 25 GLU H 5.00 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 369, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,
 igr1= 344, 345, 346,
 &end
#
# 20 ASN H 23 ALA QB 3.56 
 &rst
  ixpk= 0, nxpk= 0, iat= 289,  -1, r1= 1.30, r2= 1.80, r3= 4.28, r4= 4.78,
 igr2= 344, 345, 346,
 &end
#
# 23 ALA H 23 ALA QB 3.04 
 &rst
  ixpk= 0, nxpk= 0, iat= 340,  -1, r1= 1.30, r2= 1.80, r3= 3.65, r4= 4.15,
 igr2= 344, 345, 346,
 &end
#
# 23 ALA QB 24 LEU H 3.45 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 350, r1= 1.30, r2= 1.80, r3= 4.14, r4= 4.64,
 igr1= 344, 345, 346,
 &end
#
# 20 ASN HA 23 ALA QB 5.50 
 &rst
  ixpk= 0, nxpk= 0, iat= 291,  -1, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr2= 344, 345, 346,
 &end
#
# 23 ALA QB 24 LEU HA 4.31 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 352, r1= 1.30, r2= 1.80, r3= 5.18, r4= 5.68,
 igr1= 344, 345, 346,
 &end
#
# 19 THR HA 23 ALA QB 4.30 
 &rst
  ixpk= 0, nxpk= 0, iat= 277,  -1, r1= 1.30, r2= 1.80, r3= 5.16, r4= 5.66,
 igr2= 344, 345, 346,
 &end
#
# 21 GLU HA 23 ALA QB 5.50 
 &rst
  ixpk= 0, nxpk= 0, iat= 305,  -1, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr2= 344, 345, 346,
 &end
#
# 20 ASN HB2 23 ALA QB 5.50 
 &rst
  ixpk= 0, nxpk= 0, iat= 293,  -1, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr2= 344, 345, 346,
 &end
#
# 23 ALA QB 24 LEU QD1 5.50 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.93, r4= 8.43,
 igr1= 344, 345, 346,
 igr2= 359, 360, 361,
 &end
#
# 56 PHE H 62 ALA QB 4.41 
 &rst
  ixpk= 0, nxpk= 0, iat= 877,  -1, r1= 1.30, r2= 1.80, r3= 5.30, r4= 5.80,
 igr2= 963, 964, 965,
 &end
#
# 62 ALA QB 66 ALA H 5.35 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1013, r1= 1.30, r2= 1.80, r3= 6.43, r4= 6.93,
 igr1= 963, 964, 965,
 &end
#
# 62 ALA QB 63 LYS H 3.72 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 969, r1= 1.30, r2= 1.80, r3= 4.47, r4= 4.97,
 igr1= 963, 964, 965,
 &end
#
# 62 ALA H 62 ALA QB 3.39 
 &rst
  ixpk= 0, nxpk= 0, iat= 959,  -1, r1= 1.30, r2= 1.80, r3= 4.07, r4= 4.57,
 igr2= 963, 964, 965,
 &end
#
# 9 LYS HA 62 ALA QB 5.32 
 &rst
  ixpk= 0, nxpk= 0, iat= 121,  -1, r1= 1.30, r2= 1.80, r3= 6.39, r4= 6.89,
 igr2= 963, 964, 965,
 &end
#
# 32 GLY HA3 62 ALA QB 5.50 
 &rst
  ixpk= 0, nxpk= 0, iat= 483,  -1, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr2= 963, 964, 965,
 &end
#
# 59 PRO HA 62 ALA QB 3.64 
 &rst
  ixpk= 0, nxpk= 0, iat= 933,  -1, r1= 1.30, r2= 1.80, r3= 4.37, r4= 4.87,
 igr2= 963, 964, 965,
 &end
#
# 56 PHE HB2 62 ALA QB 3.82 
 &rst
  ixpk= 0, nxpk= 0, iat= 881,  -1, r1= 1.30, r2= 1.80, r3= 4.59, r4= 5.09,
 igr2= 963, 964, 965,
 &end
#
# 61 ASP HB2 62 ALA QB 5.50 
 &rst
  ixpk= 0, nxpk= 0, iat= 951,  -1, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr2= 963, 964, 965,
 &end
#
# 59 PRO HB3 62 ALA QB 4.93 
 &rst
  ixpk= 0, nxpk= 0, iat= 931,  -1, r1= 1.30, r2= 1.80, r3= 5.92, r4= 6.42,
 igr2= 963, 964, 965,
 &end
#
# 10 LEU HG 62 ALA QB 4.35 
 &rst
  ixpk= 0, nxpk= 0, iat= 148,  -1, r1= 1.30, r2= 1.80, r3= 5.22, r4= 5.72,
 igr2= 963, 964, 965,
 &end
#
# 62 ALA QB 63 LYS HG3 3.77 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 977, r1= 1.30, r2= 1.80, r3= 4.53, r4= 5.03,
 igr1= 963, 964, 965,
 &end
#
# 10 LEU QD2 62 ALA QB 3.80 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.48, r4= 5.98,
 igr1= 154, 155, 156,
 igr2= 963, 964, 965,
 &end
#
# 54 VAL QG2 62 ALA QB 5.50 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.93, r4= 8.43,
 igr1= 857, 858, 859,
 igr2= 963, 964, 965,
 &end
#
# 16 ASN H 79 ILE QG2 5.22 
 &rst
  ixpk= 0, nxpk= 0, iat= 232,  -1, r1= 1.30, r2= 1.80, r3= 6.27, r4= 6.77,
 igr2=1206,1207,1208,
 &end
#
# 74 LEU H 79 ILE QG2 4.24 
 &rst
  ixpk= 0, nxpk= 0, iat=1130,  -1, r1= 1.30, r2= 1.80, r3= 5.09, r4= 5.59,
 igr2=1206,1207,1208,
 &end
#
# 79 ILE QG2 80 LYS H 4.10 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1219, r1= 1.30, r2= 1.80, r3= 4.92, r4= 5.42,
 igr1=1206,1207,1208,
 &end
#
# 79 ILE H 79 ILE QG2 3.82 
 &rst
  ixpk= 0, nxpk= 0, iat=1200,  -1, r1= 1.30, r2= 1.80, r3= 4.59, r4= 5.09,
 igr2=1206,1207,1208,
 &end
#
# 28 PHE HZ 79 ILE QG2 5.50 
 &rst
  ixpk= 0, nxpk= 0, iat= 422,  -1, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr2=1206,1207,1208,
 &end
#
# 15 LEU HA 79 ILE QG2 4.16 
 &rst
  ixpk= 0, nxpk= 0, iat= 215,  -1, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50,
 igr2=1206,1207,1208,
 &end
#
# 77 LYS HB3 79 ILE QG2 4.76 
 &rst
  ixpk= 0, nxpk= 0, iat=1173,  -1, r1= 1.30, r2= 1.80, r3= 5.72, r4= 6.22,
 igr2=1206,1207,1208,
 &end
#
# 79 ILE QG2 79 ILE QG1 3.55 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.79, r4= 5.29,
 igr1=1206,1207,1208,
 igr2=1210,1211,
 &end
#
# 15 LEU HG 79 ILE QG2 3.81 
 &rst
  ixpk= 0, nxpk= 0, iat= 220,  -1, r1= 1.30, r2= 1.80, r3= 4.58, r4= 5.08,
 igr2=1206,1207,1208,
 &end
#
# 15 LEU QD1 79 ILE QG2 5.33 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.69, r4= 8.19,
 igr1= 222, 223, 224,
 igr2=1206,1207,1208,
 &end
#
# 26 ALA H 26 ALA QB 2.96 
 &rst
  ixpk= 0, nxpk= 0, iat= 384,  -1, r1= 1.30, r2= 1.80, r3= 3.55, r4= 4.05,
 igr2= 388, 389, 390,
 &end
#
# 26 ALA QB 27 VAL H 3.40 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 394, r1= 1.30, r2= 1.80, r3= 4.08, r4= 4.58,
 igr1= 388, 389, 390,
 &end
#
# 23 ALA HA 26 ALA QB 3.39 
 &rst
  ixpk= 0, nxpk= 0, iat= 342,  -1, r1= 1.30, r2= 1.80, r3= 4.07, r4= 4.57,
 igr2= 388, 389, 390,
 &end
#
# 25 GLU HG3 26 ALA QB 5.50 
 &rst
  ixpk= 0, nxpk= 0, iat= 377,  -1, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr2= 388, 389, 390,
 &end
#
# 25 GLU QB 26 ALA QB 4.17 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.62, r4= 6.12,
 igr1= 373, 374,
 igr2= 388, 389, 390,
 &end
#
# 26 ALA QB 27 VAL HB 4.24 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 398, r1= 1.30, r2= 1.80, r3= 5.09, r4= 5.59,
 igr1= 388, 389, 390,
 &end
#
# 22 LYS QD 26 ALA QB 3.30 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.45, r4= 4.95,
 igr1= 328, 329,
 igr2= 388, 389, 390,
 &end
#
# 26 ALA QB 27 VAL QG2 5.50 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.93, r4= 8.43,
 igr1= 388, 389, 390,
 igr2= 404, 405, 406,
 &end
#
# 60 ALA QB 62 ALA H 5.10 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 959, r1= 1.30, r2= 1.80, r3= 6.12, r4= 6.62,
 igr1= 941, 942, 943,
 &end
#
# 58 SER HA 60 ALA QB 5.50 
 &rst
  ixpk= 0, nxpk= 0, iat= 914,  -1, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr2= 941, 942, 943,
 &end
#
# 60 ALA QB 61 ASP HA 4.70 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 949, r1= 1.30, r2= 1.80, r3= 5.64, r4= 6.14,
 igr1= 941, 942, 943,
 &end
#
# 60 ALA QB 63 LYS QE 5.50 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1= 941, 942, 943,
 igr2= 982, 983,
 &end
#
# 60 ALA QB 64 ASP HB2 5.50 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 995, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr1= 941, 942, 943,
 &end
#
# 60 ALA QB 63 LYS QB 4.25 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.73, r4= 6.23,
 igr1= 941, 942, 943,
 igr2= 973, 974,
 &end
#
# 60 ALA QB 63 LYS QD 4.36 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.88, r4= 6.38,
 igr1= 941, 942, 943,
 igr2= 979, 980,
 &end
#
# 60 ALA QB 63 LYS HG3 3.86 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 977, r1= 1.30, r2= 1.80, r3= 4.64, r4= 5.14,
 igr1= 941, 942, 943,
 &end
#
# 34 ILE QG2 56 PHE HA 5.47 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 879, r1= 1.30, r2= 1.80, r3= 6.57, r4= 7.07,
 igr1= 517, 518, 519,
 &end
#
# 34 ILE QG2 54 VAL HA 5.50 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 849, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr1= 517, 518, 519,
 &end
#
# 25 GLU HA 34 ILE QG2 5.17 
 &rst
  ixpk= 0, nxpk= 0, iat= 371,  -1, r1= 1.30, r2= 1.80, r3= 6.21, r4= 6.71,
 igr2= 517, 518, 519,
 &end
#
# 34 ILE QG2 37 VAL HB 5.31 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 565, r1= 1.30, r2= 1.80, r3= 6.38, r4= 6.88,
 igr1= 517, 518, 519,
 &end
#
# 34 ILE QG2 55 THR QG2 5.12 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.38, r4= 7.88,
 igr1= 517, 518, 519,
 igr2= 869, 870, 871,
 &end
#
# 34 ILE QG2 35 VAL H 3.72 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 530, r1= 1.30, r2= 1.80, r3= 4.47, r4= 4.97,
 igr1= 517, 518, 519,
 &end
#
# 34 ILE QG2 37 VAL H 5.09 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 561, r1= 1.30, r2= 1.80, r3= 6.11, r4= 6.61,
 igr1= 517, 518, 519,
 &end
#
# 34 ILE QG2 57 GLU H 5.50 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 897, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr1= 517, 518, 519,
 &end
#
# 34 ILE QG2 36 GLU H 3.44 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 546, r1= 1.30, r2= 1.80, r3= 4.13, r4= 4.63,
 igr1= 517, 518, 519,
 &end
#
# 34 ILE QG2 55 THR HB 5.43 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 867, r1= 1.30, r2= 1.80, r3= 6.52, r4= 7.02,
 igr1= 517, 518, 519,
 &end
#
# 25 GLU HG3 34 ILE QG2 5.22 
 &rst
  ixpk= 0, nxpk= 0, iat= 377,  -1, r1= 1.30, r2= 1.80, r3= 6.27, r4= 6.77,
 igr2= 517, 518, 519,
 &end
#
# 25 GLU HG2 34 ILE QG2 4.90 
 &rst
  ixpk= 0, nxpk= 0, iat= 376,  -1, r1= 1.30, r2= 1.80, r3= 5.88, r4= 6.38,
 igr2= 517, 518, 519,
 &end
#
# 34 ILE QG2 35 VAL QG2 4.18 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.03, r4= 6.53,
 igr1= 517, 518, 519,
 igr2= 540, 541, 542,
 &end
#
# 34 ILE QG2 54 VAL QG2 3.34 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.82, r4= 5.32,
 igr1= 517, 518, 519,
 igr2= 857, 858, 859,
 &end
#
# 34 ILE QG2 34 ILE HG12 3.95 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 521, r1= 1.30, r2= 1.80, r3= 4.74, r4= 5.24,
 igr1= 517, 518, 519,
 &end
#
# 26 ALA QB 29 GLY H 5.50 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 430, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr1= 388, 389, 390,
 &end
#
# 74 LEU H 78 ALA QB 5.03 
 &rst
  ixpk= 0, nxpk= 0, iat=1130,  -1, r1= 1.30, r2= 1.80, r3= 6.04, r4= 6.54,
 igr2=1194,1195,1196,
 &end
#
# 78 ALA H 78 ALA QB 3.04 
 &rst
  ixpk= 0, nxpk= 0, iat=1190,  -1, r1= 1.30, r2= 1.80, r3= 3.65, r4= 4.15,
 igr2=1194,1195,1196,
 &end
#
# 73 SER H 78 ALA QB 5.23 
 &rst
  ixpk= 0, nxpk= 0, iat=1119,  -1, r1= 1.30, r2= 1.80, r3= 6.28, r4= 6.78,
 igr2=1194,1195,1196,
 &end
#
# 77 LYS HA 78 ALA QB 4.31 
 &rst
  ixpk= 0, nxpk= 0, iat=1170,  -1, r1= 1.30, r2= 1.80, r3= 5.18, r4= 5.68,
 igr2=1194,1195,1196,
 &end
#
# 71 GLY HA2 78 ALA QB 4.44 
 &rst
  ixpk= 0, nxpk= 0, iat=1092,  -1, r1= 1.30, r2= 1.80, r3= 5.33, r4= 5.83,
 igr2=1194,1195,1196,
 &end
#
# 73 SER HB2 78 ALA QB 4.72 
 &rst
  ixpk= 0, nxpk= 0, iat=1123,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr2=1194,1195,1196,
 &end
#
# 77 LYS HB3 78 ALA QB 5.02 
 &rst
  ixpk= 0, nxpk= 0, iat=1173,  -1, r1= 1.30, r2= 1.80, r3= 6.03, r4= 6.53,
 igr2=1194,1195,1196,
 &end
#
# 78 ALA QB 79 ILE QG2 4.73 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.82, r4= 7.32,
 igr1=1194,1195,1196,
 igr2=1206,1207,1208,
 &end
#
# 66 ALA QB 82 GLU H 5.26 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1257, r1= 1.30, r2= 1.80, r3= 6.32, r4= 6.82,
 igr1=1017,1018,1019,
 &end
#
# 66 ALA QB 83 GLN H 4.98 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1272, r1= 1.30, r2= 1.80, r3= 5.98, r4= 6.48,
 igr1=1017,1018,1019,
 &end
#
# 66 ALA H 66 ALA QB 3.11 
 &rst
  ixpk= 0, nxpk= 0, iat=1013,  -1, r1= 1.30, r2= 1.80, r3= 3.73, r4= 4.23,
 igr2=1017,1018,1019,
 &end
#
# 66 ALA QB 67 ARG H 3.45 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1023, r1= 1.30, r2= 1.80, r3= 4.14, r4= 4.64,
 igr1=1017,1018,1019,
 &end
#
# 10 LEU HA 66 ALA QB 5.50 
 &rst
  ixpk= 0, nxpk= 0, iat= 143,  -1, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr2=1017,1018,1019,
 &end
#
# 66 ALA QB 82 GLU HA 4.24 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1259, r1= 1.30, r2= 1.80, r3= 5.09, r4= 5.59,
 igr1=1017,1018,1019,
 &end
#
# 66 ALA QB 83 GLN HA 5.50 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1274, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr1=1017,1018,1019,
 &end
#
# 66 ALA QB 81 VAL HB 3.91 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1245, r1= 1.30, r2= 1.80, r3= 4.70, r4= 5.20,
 igr1=1017,1018,1019,
 &end
#
# 66 ALA QB 67 ARG HG3 4.93 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1031, r1= 1.30, r2= 1.80, r3= 5.92, r4= 6.42,
 igr1=1017,1018,1019,
 &end
#
# 10 LEU HB3 66 ALA QB 4.60 
 &rst
  ixpk= 0, nxpk= 0, iat= 146,  -1, r1= 1.30, r2= 1.80, r3= 5.52, r4= 6.02,
 igr2=1017,1018,1019,
 &end
#
# 62 ALA QB 66 ALA QB 3.66 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.28, r4= 5.78,
 igr1= 963, 964, 965,
 igr2=1017,1018,1019,
 &end
#
# 65 ALA QB 66 ALA QB 4.25 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.13, r4= 6.63,
 igr1=1007,1008,1009,
 igr2=1017,1018,1019,
 &end
#
# 66 ALA QB 81 VAL QG1 3.43 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.95, r4= 5.45,
 igr1=1017,1018,1019,
 igr2=1247,1248,1249,
 &end
#
# 10 LEU QD2 66 ALA QB 3.64 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.25, r4= 5.75,
 igr1= 154, 155, 156,
 igr2=1017,1018,1019,
 &end
#
# 66 ALA QB 81 VAL HA 5.50 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1243, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr1=1017,1018,1019,
 &end
#
# 1 MET QE 2 VAL H 5.50 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  21, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr1=  15,  16,  17,
 &end
#
# 40 MET QE 41 LYS H 4.60 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 632, r1= 1.30, r2= 1.80, r3= 5.52, r4= 6.02,
 igr1= 626, 627, 628,
 &end
#
# 40 MET H 40 MET QE 5.27 
 &rst
  ixpk= 0, nxpk= 0, iat= 615,  -1, r1= 1.30, r2= 1.80, r3= 6.33, r4= 6.83,
 igr2= 626, 627, 628,
 &end
#
# 40 MET QE 51 PHE QE 5.50 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1= 626, 627, 628,
 igr2= 807, 811,
 &end
#
# 40 MET QE 51 PHE HZ 5.50 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 809, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr1= 626, 627, 628,
 &end
#
# 40 MET QE 41 LYS HA 5.50 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 634, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr1= 626, 627, 628,
 &end
#
# 38 LEU HA 40 MET QE 4.37 
 &rst
  ixpk= 0, nxpk= 0, iat= 579,  -1, r1= 1.30, r2= 1.80, r3= 5.25, r4= 5.75,
 igr2= 626, 627, 628,
 &end
#
# 40 MET QE 49 ARG HD3 5.50 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 777, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr1= 626, 627, 628,
 &end
#
# 40 MET QE 41 LYS QE 5.44 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.33, r4= 7.83,
 igr1= 626, 627, 628,
 igr2= 645, 646,
 &end
#
# 40 MET HG2 40 MET QE 4.21 
 &rst
  ixpk= 0, nxpk= 0, iat= 622,  -1, r1= 1.30, r2= 1.80, r3= 5.06, r4= 5.56,
 igr2= 626, 627, 628,
 &end
#
# 39 LEU HB3 40 MET QE 5.49 
 &rst
  ixpk= 0, nxpk= 0, iat= 601,  -1, r1= 1.30, r2= 1.80, r3= 6.59, r4= 7.09,
 igr2= 626, 627, 628,
 &end
#
# 38 LEU HG 40 MET QE 4.65 
 &rst
  ixpk= 0, nxpk= 0, iat= 584,  -1, r1= 1.30, r2= 1.80, r3= 5.58, r4= 6.08,
 igr2= 626, 627, 628,
 &end
#
# 40 MET HB3 40 MET QE 3.81 
 &rst
  ixpk= 0, nxpk= 0, iat= 620,  -1, r1= 1.30, r2= 1.80, r3= 4.58, r4= 5.08,
 igr2= 626, 627, 628,
 &end
#
# 40 MET HB2 40 MET QE 4.19 
 &rst
  ixpk= 0, nxpk= 0, iat= 619,  -1, r1= 1.30, r2= 1.80, r3= 5.03, r4= 5.53,
 igr2= 626, 627, 628,
 &end
#
# 38 LEU QD2 40 MET QE 5.00 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.21, r4= 7.71,
 igr1= 590, 591, 592,
 igr2= 626, 627, 628,
 &end
#
# 1 MET QG 1 MET QE 4.13 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.57, r4= 6.07,
 igr1=  11,  12,
 igr2=  15,  16,  17,
 &end
#
# 1 MET HA 1 MET QE 5.28 
 &rst
  ixpk= 0, nxpk= 0, iat=   6,  -1, r1= 1.30, r2= 1.80, r3= 6.34, r4= 6.84,
 igr2=  15,  16,  17,
 &end
#
# 1 MET QE 3 GLU HA 5.49 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  39, r1= 1.30, r2= 1.80, r3= 6.59, r4= 7.09,
 igr1=  15,  16,  17,
 &end
#
# 1 MET QE 2 VAL QG2 5.43 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.83, r4= 8.33,
 igr1=  15,  16,  17,
 igr2=  31,  32,  33,
 &end
#
# 69 MET QE 71 GLY H 5.24 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1090, r1= 1.30, r2= 1.80, r3= 6.29, r4= 6.79,
 igr1=1070,1071,1072,
 &end
#
# 69 MET H 69 MET QE 4.93 
 &rst
  ixpk= 0, nxpk= 0, iat=1059,  -1, r1= 1.30, r2= 1.80, r3= 5.92, r4= 6.42,
 igr2=1070,1071,1072,
 &end
#
# 69 MET QE 73 SER H 5.39 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1119, r1= 1.30, r2= 1.80, r3= 6.47, r4= 6.97,
 igr1=1070,1071,1072,
 &end
#
# 28 PHE HZ 69 MET QE 4.07 
 &rst
  ixpk= 0, nxpk= 0, iat= 422,  -1, r1= 1.30, r2= 1.80, r3= 4.89, r4= 5.39,
 igr2=1070,1071,1072,
 &end
#
# 69 MET HA 69 MET QE 3.78 
 &rst
  ixpk= 0, nxpk= 0, iat=1061,  -1, r1= 1.30, r2= 1.80, r3= 4.54, r4= 5.04,
 igr2=1070,1071,1072,
 &end
#
# 69 MET QE 72 LYS HA 5.29 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1099, r1= 1.30, r2= 1.80, r3= 6.35, r4= 6.85,
 igr1=1070,1071,1072,
 &end
#
# 69 MET QG 69 MET QE 4.09 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.51, r4= 6.01,
 igr1=1066,1067,
 igr2=1070,1071,1072,
 &end
#
# 69 MET HB3 69 MET QE 3.28 
 &rst
  ixpk= 0, nxpk= 0, iat=1064,  -1, r1= 1.30, r2= 1.80, r3= 3.94, r4= 4.44,
 igr2=1070,1071,1072,
 &end
#
# 69 MET QE 72 LYS HG2 4.50 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1104, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr1=1070,1071,1072,
 &end
#
# 69 MET QE 81 VAL QG2 3.79 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.47, r4= 5.97,
 igr1=1070,1071,1072,
 igr2=1251,1252,1253,
 &end
#
# 69 MET QE 74 LEU QD2 3.86 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.57, r4= 6.07,
 igr1=1070,1071,1072,
 igr2=1143,1144,1145,
 &end
#
# 69 MET QE 79 ILE QD1 3.49 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.03, r4= 5.53,
 igr1=1070,1071,1072,
 igr2=1213,1214,1215,
 &end
#
# 27 VAL QG2 69 MET QE 3.39 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.89, r4= 5.39,
 igr1= 404, 405, 406,
 igr2=1070,1071,1072,
 &end
#
# 69 MET QE 72 LYS H 4.79 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1097, r1= 1.30, r2= 1.80, r3= 5.75, r4= 6.25,
 igr1=1070,1071,1072,
 &end
#
# 78 ALA HA 79 ILE QD1 5.50 
 &rst
  ixpk= 0, nxpk= 0, iat=1192,  -1, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr2=1213,1214,1215,
 &end
#
# 15 LEU HA 79 ILE QD1 5.50 
 &rst
  ixpk= 0, nxpk= 0, iat= 215,  -1, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr2=1213,1214,1215,
 &end
#
# 74 LEU H 79 ILE QD1 4.92 
 &rst
  ixpk= 0, nxpk= 0, iat=1130,  -1, r1= 1.30, r2= 1.80, r3= 5.91, r4= 6.41,
 igr2=1213,1214,1215,
 &end
#
# 72 LYS H 79 ILE QD1 5.38 
 &rst
  ixpk= 0, nxpk= 0, iat=1097,  -1, r1= 1.30, r2= 1.80, r3= 6.46, r4= 6.96,
 igr2=1213,1214,1215,
 &end
#
# 15 LEU H 79 ILE QD1 5.50 
 &rst
  ixpk= 0, nxpk= 0, iat= 213,  -1, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr2=1213,1214,1215,
 &end
#
# 79 ILE QD1 81 VAL HA 5.50 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1243, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr1=1213,1214,1215,
 &end
#
# 79 ILE HA 79 ILE QD1 4.66 
 &rst
  ixpk= 0, nxpk= 0, iat=1202,  -1, r1= 1.30, r2= 1.80, r3= 5.60, r4= 6.10,
 igr2=1213,1214,1215,
 &end
#
# 69 MET QG 79 ILE QD1 5.50 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1=1066,1067,
 igr2=1213,1214,1215,
 &end
#
# 69 MET HB3 79 ILE QD1 4.40 
 &rst
  ixpk= 0, nxpk= 0, iat=1064,  -1, r1= 1.30, r2= 1.80, r3= 5.28, r4= 5.78,
 igr2=1213,1214,1215,
 &end
#
# 79 ILE HB 79 ILE QD1 3.47 
 &rst
  ixpk= 0, nxpk= 0, iat=1204,  -1, r1= 1.30, r2= 1.80, r3= 4.17, r4= 4.67,
 igr2=1213,1214,1215,
 &end
#
# 79 ILE QG2 79 ILE QD1 3.22 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.64, r4= 5.14,
 igr1=1206,1207,1208,
 igr2=1213,1214,1215,
 &end
#
# 12 ILE QD1 79 ILE QD1 5.28 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.62, r4= 8.12,
 igr1= 193, 194, 195,
 igr2=1213,1214,1215,
 &end
#
# 10 LEU H 12 ILE QD1 5.50 
 &rst
  ixpk= 0, nxpk= 0, iat= 141,  -1, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr2= 193, 194, 195,
 &end
#
# 12 ILE QD1 82 GLU H 5.01 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1257, r1= 1.30, r2= 1.80, r3= 6.02, r4= 6.52,
 igr1= 193, 194, 195,
 &end
#
# 12 ILE QD1 13 GLY H 5.25 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 199, r1= 1.30, r2= 1.80, r3= 6.30, r4= 6.80,
 igr1= 193, 194, 195,
 &end
#
# 12 ILE QD1 54 VAL H 4.45 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 847, r1= 1.30, r2= 1.80, r3= 5.34, r4= 5.84,
 igr1= 193, 194, 195,
 &end
#
# 12 ILE QD1 53 PHE HA 5.16 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 829, r1= 1.30, r2= 1.80, r3= 6.20, r4= 6.70,
 igr1= 193, 194, 195,
 &end
#
# 12 ILE QD1 81 VAL HA 4.64 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1243, r1= 1.30, r2= 1.80, r3= 5.57, r4= 6.07,
 igr1= 193, 194, 195,
 &end
#
# 10 LEU HA 12 ILE QD1 5.50 
 &rst
  ixpk= 0, nxpk= 0, iat= 143,  -1, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr2= 193, 194, 195,
 &end
#
# 12 ILE HA 12 ILE QD1 4.52 
 &rst
  ixpk= 0, nxpk= 0, iat= 182,  -1, r1= 1.30, r2= 1.80, r3= 5.43, r4= 5.93,
 igr2= 193, 194, 195,
 &end
#
# 11 PHE HA 12 ILE QD1 5.28 
 &rst
  ixpk= 0, nxpk= 0, iat= 162,  -1, r1= 1.30, r2= 1.80, r3= 6.34, r4= 6.84,
 igr2= 193, 194, 195,
 &end
#
# 10 LEU HB3 12 ILE QD1 4.24 
 &rst
  ixpk= 0, nxpk= 0, iat= 146,  -1, r1= 1.30, r2= 1.80, r3= 5.09, r4= 5.59,
 igr2= 193, 194, 195,
 &end
#
# 12 ILE QD1 54 VAL HB 3.71 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 851, r1= 1.30, r2= 1.80, r3= 4.46, r4= 4.96,
 igr1= 193, 194, 195,
 &end
#
# 10 LEU HB2 12 ILE QD1 4.19 
 &rst
  ixpk= 0, nxpk= 0, iat= 145,  -1, r1= 1.30, r2= 1.80, r3= 5.03, r4= 5.53,
 igr2= 193, 194, 195,
 &end
#
# 12 ILE QD1 81 VAL QG1 3.39 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.89, r4= 5.39,
 igr1= 193, 194, 195,
 igr2=1247,1248,1249,
 &end
#
# 12 ILE QG2 12 ILE QD1 3.59 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.18, r4= 5.68,
 igr1= 186, 187, 188,
 igr2= 193, 194, 195,
 &end
#
# 12 ILE QD1 54 VAL QG1 3.60 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.19, r4= 5.69,
 igr1= 193, 194, 195,
 igr2= 853, 854, 855,
 &end
#
# 11 PHE H 12 ILE QD1 5.50 
 &rst
  ixpk= 0, nxpk= 0, iat= 160,  -1, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr2= 193, 194, 195,
 &end
#
# 12 ILE H 12 ILE QD1 4.94 
 &rst
  ixpk= 0, nxpk= 0, iat= 180,  -1, r1= 1.30, r2= 1.80, r3= 5.93, r4= 6.43,
 igr2= 193, 194, 195,
 &end
#
# 34 ILE QD1 56 PHE QR 4.51 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.82, r4= 7.32,
 igr1= 524, 525, 526,
 igr2= 885, 893, 887, 891,
 &end
#
# 30 LYS H 34 ILE QD1 5.46 
 &rst
  ixpk= 0, nxpk= 0, iat= 437,  -1, r1= 1.30, r2= 1.80, r3= 6.56, r4= 7.06,
 igr2= 524, 525, 526,
 &end
#
# 28 PHE HA 34 ILE QD1 5.50 
 &rst
  ixpk= 0, nxpk= 0, iat= 412,  -1, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr2= 524, 525, 526,
 &end
#
# 25 GLU HG3 34 ILE QD1 4.56 
 &rst
  ixpk= 0, nxpk= 0, iat= 377,  -1, r1= 1.30, r2= 1.80, r3= 5.48, r4= 5.98,
 igr2= 524, 525, 526,
 &end
#
# 25 GLU QB 34 ILE QD1 4.04 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.45, r4= 5.95,
 igr1= 373, 374,
 igr2= 524, 525, 526,
 &end
#
# 34 ILE QD1 37 VAL QG2 4.24 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.12, r4= 6.62,
 igr1= 524, 525, 526,
 igr2= 571, 572, 573,
 &end
#
# 34 ILE QD1 54 VAL HB 5.23 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 851, r1= 1.30, r2= 1.80, r3= 6.28, r4= 6.78,
 igr1= 524, 525, 526,
 &end
#
# 24 LEU QD2 34 ILE QD1 4.85 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.99, r4= 7.49,
 igr1= 363, 364, 365,
 igr2= 524, 525, 526,
 &end
#
# 31 TYR H 31 TYR QD 2.79 
 &rst
  ixpk= 0, nxpk= 0, iat= 459,  -1, r1= 1.30, r2= 1.80, r3= 3.13, r4= 3.63,
 igr2= 467, 476,
 &end
#
# 28 PHE HA 31 TYR QD 2.68 
 &rst
  ixpk= 0, nxpk= 0, iat= 412,  -1, r1= 1.30, r2= 1.80, r3= 3.01, r4= 3.51,
 igr2= 467, 476,
 &end
#
# 31 TYR HA 31 TYR QD 2.87 
 &rst
  ixpk= 0, nxpk= 0, iat= 461,  -1, r1= 1.30, r2= 1.80, r3= 3.22, r4= 3.72,
 igr2= 467, 476,
 &end
#
# 28 PHE HB3 31 TYR QD 3.54 
 &rst
  ixpk= 0, nxpk= 0, iat= 415,  -1, r1= 1.30, r2= 1.80, r3= 3.97, r4= 4.47,
 igr2= 467, 476,
 &end
#
# 31 TYR QD 68 ASP HB2 4.43 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1051, r1= 1.30, r2= 1.80, r3= 4.97, r4= 5.47,
 igr1= 467, 476,
 &end
#
# 31 TYR QD 65 ALA HA 3.57 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1005, r1= 1.30, r2= 1.80, r3= 4.01, r4= 4.51,
 igr1= 467, 476,
 &end
#
# 30 LYS HB2 31 TYR QD 3.99 
 &rst
  ixpk= 0, nxpk= 0, iat= 441,  -1, r1= 1.30, r2= 1.80, r3= 4.48, r4= 4.98,
 igr2= 467, 476,
 &end
#
# 31 TYR QD 65 ALA QB 2.94 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 3.96, r4= 4.46,
 igr1= 467, 476,
 igr2=1007,1008,1009,
 &end
#
# 51 PHE QD 52 ALA H 3.37 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 817, r1= 1.30, r2= 1.80, r3= 3.78, r4= 4.28,
 igr1= 805, 813,
 &end
#
# 51 PHE H 51 PHE QD 2.68 
 &rst
  ixpk= 0, nxpk= 0, iat= 797,  -1, r1= 1.30, r2= 1.80, r3= 3.01, r4= 3.51,
 igr2= 805, 813,
 &end
#
# 11 PHE QE 51 PHE QD 3.56 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.49, r4= 4.99,
 igr1= 170, 174,
 igr2= 805, 813,
 &end
#
# 51 PHE QD 52 ALA HA 4.42 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 819, r1= 1.30, r2= 1.80, r3= 4.96, r4= 5.46,
 igr1= 805, 813,
 &end
#
# 49 ARG HB2 51 PHE QD 3.48 
 &rst
  ixpk= 0, nxpk= 0, iat= 770,  -1, r1= 1.30, r2= 1.80, r3= 3.91, r4= 4.41,
 igr2= 805, 813,
 &end
#
# 89 PHE HA 89 PHE QD 3.64 
 &rst
  ixpk= 0, nxpk= 0, iat=1362,  -1, r1= 1.30, r2= 1.80, r3= 4.09, r4= 4.59,
 igr2=1368,1376,
 &end
#
# 89 PHE H 89 PHE QD 4.04 
 &rst
  ixpk= 0, nxpk= 0, iat=1360,  -1, r1= 1.30, r2= 1.80, r3= 4.53, r4= 5.03,
 igr2=1368,1376,
 &end
#
# 87 PRO HB3 89 PHE QD 4.25 
 &rst
  ixpk= 0, nxpk= 0, iat=1343,  -1, r1= 1.30, r2= 1.80, r3= 4.77, r4= 5.27,
 igr2=1368,1376,
 &end
#
# 53 PHE QD 54 VAL H 4.13 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 847, r1= 1.30, r2= 1.80, r3= 4.64, r4= 5.14,
 igr1= 835, 843,
 &end
#
# 53 PHE H 53 PHE QD 3.26 
 &rst
  ixpk= 0, nxpk= 0, iat= 827,  -1, r1= 1.30, r2= 1.80, r3= 3.66, r4= 4.16,
 igr2= 835, 843,
 &end
#
# 53 PHE QD 53 PHE HZ 3.83 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 839, r1= 1.30, r2= 1.80, r3= 4.30, r4= 4.80,
 igr1= 835, 843,
 &end
#
# 53 PHE HA 53 PHE QD 3.17 
 &rst
  ixpk= 0, nxpk= 0, iat= 829,  -1, r1= 1.30, r2= 1.80, r3= 3.56, r4= 4.06,
 igr2= 835, 843,
 &end
#
# 52 ALA HA 53 PHE QD 3.89 
 &rst
  ixpk= 0, nxpk= 0, iat= 819,  -1, r1= 1.30, r2= 1.80, r3= 4.37, r4= 4.87,
 igr2= 835, 843,
 &end
#
# 11 PHE HA 53 PHE QD 3.43 
 &rst
  ixpk= 0, nxpk= 0, iat= 162,  -1, r1= 1.30, r2= 1.80, r3= 3.85, r4= 4.35,
 igr2= 835, 843,
 &end
#
# 40 MET HG2 53 PHE QD 4.49 
 &rst
  ixpk= 0, nxpk= 0, iat= 622,  -1, r1= 1.30, r2= 1.80, r3= 5.04, r4= 5.54,
 igr2= 835, 843,
 &end
#
# 38 LEU HB3 53 PHE QD 3.56 
 &rst
  ixpk= 0, nxpk= 0, iat= 582,  -1, r1= 1.30, r2= 1.80, r3= 4.00, r4= 4.50,
 igr2= 835, 843,
 &end
#
# 9 LYS QD 53 PHE QD 2.88 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 3.63, r4= 4.13,
 igr1= 129, 130,
 igr2= 835, 843,
 &end
#
# 38 LEU HB2 53 PHE QD 3.41 
 &rst
  ixpk= 0, nxpk= 0, iat= 581,  -1, r1= 1.30, r2= 1.80, r3= 3.83, r4= 4.33,
 igr2= 835, 843,
 &end
#
# 9 LYS HG2 53 PHE QD 3.79 
 &rst
  ixpk= 0, nxpk= 0, iat= 126,  -1, r1= 1.30, r2= 1.80, r3= 4.25, r4= 4.75,
 igr2= 835, 843,
 &end
#
# 38 LEU QD2 53 PHE QD 4.16 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.61, r4= 6.11,
 igr1= 590, 591, 592,
 igr2= 835, 843,
 &end
#
# 38 LEU H 53 PHE QD 4.92 
 &rst
  ixpk= 0, nxpk= 0, iat= 577,  -1, r1= 1.30, r2= 1.80, r3= 5.52, r4= 6.02,
 igr2= 835, 843,
 &end
#
# 28 PHE H 28 PHE QD 3.02 
 &rst
  ixpk= 0, nxpk= 0, iat= 410,  -1, r1= 1.30, r2= 1.80, r3= 3.39, r4= 3.89,
 igr2= 418, 426,
 &end
#
# 28 PHE HA 28 PHE QD 3.24 
 &rst
  ixpk= 0, nxpk= 0, iat= 412,  -1, r1= 1.30, r2= 1.80, r3= 3.64, r4= 4.14,
 igr2= 418, 426,
 &end
#
# 24 LEU HA 28 PHE QD 3.33 
 &rst
  ixpk= 0, nxpk= 0, iat= 352,  -1, r1= 1.30, r2= 1.80, r3= 3.74, r4= 4.24,
 igr2= 418, 426,
 &end
#
# 24 LEU HB2 28 PHE QD 5.00 
 &rst
  ixpk= 0, nxpk= 0, iat= 354,  -1, r1= 1.30, r2= 1.80, r3= 5.61, r4= 6.11,
 igr2= 418, 426,
 &end
#
# 28 PHE QD 65 ALA QB 2.82 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 3.80, r4= 4.30,
 igr1= 418, 426,
 igr2=1007,1008,1009,
 &end
#
# 49 ARG HD2 51 PHE QE 4.17 
 &rst
  ixpk= 0, nxpk= 0, iat= 776,  -1, r1= 1.30, r2= 1.80, r3= 4.68, r4= 5.18,
 igr2= 807, 811,
 &end
#
# 40 MET HG3 51 PHE QE 3.50 
 &rst
  ixpk= 0, nxpk= 0, iat= 623,  -1, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr2= 807, 811,
 &end
#
# 40 MET HB3 51 PHE QE 5.00 
 &rst
  ixpk= 0, nxpk= 0, iat= 620,  -1, r1= 1.30, r2= 1.80, r3= 5.61, r4= 6.11,
 igr2= 807, 811,
 &end
#
# 49 ARG HB2 51 PHE QE 3.36 
 &rst
  ixpk= 0, nxpk= 0, iat= 770,  -1, r1= 1.30, r2= 1.80, r3= 3.77, r4= 4.27,
 igr2= 807, 811,
 &end
#
# 56 PHE H 56 PHE QR 3.24 
 &rst
  ixpk= 0, nxpk= 0, iat= 877,  -1, r1= 1.30, r2= 1.80, r3= 4.08, r4= 4.58,
 igr2= 885, 893, 887, 891,
 &end
#
# 56 PHE QR 57 GLU H 4.11 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 897, r1= 1.30, r2= 1.80, r3= 5.18, r4= 5.68,
 igr1= 885, 893, 887, 891,
 &end
#
# 32 GLY HA3 56 PHE QR 3.85 
 &rst
  ixpk= 0, nxpk= 0, iat= 483,  -1, r1= 1.30, r2= 1.80, r3= 4.85, r4= 5.35,
 igr2= 885, 893, 887, 891,
 &end
#
# 56 PHE HA 56 PHE QR 3.52 
 &rst
  ixpk= 0, nxpk= 0, iat= 879,  -1, r1= 1.30, r2= 1.80, r3= 4.43, r4= 4.93,
 igr2= 885, 893, 887, 891,
 &end
#
# 31 TYR HA 56 PHE QR 4.37 
 &rst
  ixpk= 0, nxpk= 0, iat= 461,  -1, r1= 1.30, r2= 1.80, r3= 5.51, r4= 6.01,
 igr2= 885, 893, 887, 891,
 &end
#
# 31 TYR HB3 56 PHE QR 3.04 
 &rst
  ixpk= 0, nxpk= 0, iat= 464,  -1, r1= 1.30, r2= 1.80, r3= 3.83, r4= 4.33,
 igr2= 885, 893, 887, 891,
 &end
#
# 56 PHE QR 61 ASP HB2 3.77 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 951, r1= 1.30, r2= 1.80, r3= 4.75, r4= 5.25,
 igr1= 885, 893, 887, 891,
 &end
#
# 10 LEU HG 56 PHE QR 3.49 
 &rst
  ixpk= 0, nxpk= 0, iat= 148,  -1, r1= 1.30, r2= 1.80, r3= 4.40, r4= 4.90,
 igr2= 885, 893, 887, 891,
 &end
#
# 10 LEU HB3 56 PHE QR 4.21 
 &rst
  ixpk= 0, nxpk= 0, iat= 146,  -1, r1= 1.30, r2= 1.80, r3= 5.30, r4= 5.80,
 igr2= 885, 893, 887, 891,
 &end
#
# 56 PHE QR 62 ALA QB 2.82 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.27, r4= 4.77,
 igr1= 885, 893, 887, 891,
 igr2= 963, 964, 965,
 &end
#
# 54 VAL HB 56 PHE QR 3.95 
 &rst
  ixpk= 0, nxpk= 0, iat= 851,  -1, r1= 1.30, r2= 1.80, r3= 4.98, r4= 5.48,
 igr2= 885, 893, 887, 891,
 &end
#
# 10 LEU QD1 56 PHE QR 2.81 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.25, r4= 4.75,
 igr1= 150, 151, 152,
 igr2= 885, 893, 887, 891,
 &end
#
# 10 LEU QD2 56 PHE QR 3.91 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.92, r4= 6.42,
 igr1= 154, 155, 156,
 igr2= 885, 893, 887, 891,
 &end
#
# 54 VAL QG2 56 PHE QR 3.05 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.61, r4= 5.11,
 igr1= 857, 858, 859,
 igr2= 885, 893, 887, 891,
 &end
#
# 34 ILE HG12 56 PHE QR 3.91 
 &rst
  ixpk= 0, nxpk= 0, iat= 521,  -1, r1= 1.30, r2= 1.80, r3= 4.93, r4= 5.43,
 igr2= 885, 893, 887, 891,
 &end
#
# 87 PRO HB3 89 PHE QE 4.41 
 &rst
  ixpk= 0, nxpk= 0, iat=1343,  -1, r1= 1.30, r2= 1.80, r3= 4.95, r4= 5.45,
 igr2=1370,1374,
 &end
#
# 10 LEU QD1 28 PHE QD 3.32 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.48, r4= 4.98,
 igr1= 150, 151, 152,
 igr2= 418, 426,
 &end
#
# 12 ILE QD1 28 PHE QD 3.98 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.37, r4= 5.87,
 igr1= 193, 194, 195,
 igr2= 418, 426,
 &end
#
# 24 LEU HA 28 PHE QE 4.16 
 &rst
  ixpk= 0, nxpk= 0, iat= 352,  -1, r1= 1.30, r2= 1.80, r3= 4.67, r4= 5.17,
 igr2= 420, 424,
 &end
#
# 28 PHE QE 69 MET QG 4.50 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1= 420, 424,
 igr2=1066,1067,
 &end
#
# 28 PHE QE 69 MET HB3 3.66 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1064, r1= 1.30, r2= 1.80, r3= 4.11, r4= 4.61,
 igr1= 420, 424,
 &end
#
# 28 PHE QE 69 MET HB2 4.34 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1063, r1= 1.30, r2= 1.80, r3= 4.87, r4= 5.37,
 igr1= 420, 424,
 &end
#
# 28 PHE QE 81 VAL QG2 2.98 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.02, r4= 4.52,
 igr1= 420, 424,
 igr2=1251,1252,1253,
 &end
#
# 28 PHE QE 81 VAL QG1 3.01 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.06, r4= 4.56,
 igr1= 420, 424,
 igr2=1247,1248,1249,
 &end
#
# 12 ILE QG2 28 PHE QE 2.97 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.00, r4= 4.50,
 igr1= 186, 187, 188,
 igr2= 420, 424,
 &end
#
# 12 ILE QD1 28 PHE QE 3.59 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.84, r4= 5.34,
 igr1= 193, 194, 195,
 igr2= 420, 424,
 &end
#
# 11 PHE QE 13 GLY H 4.39 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 199, r1= 1.30, r2= 1.80, r3= 4.93, r4= 5.43,
 igr1= 170, 174,
 &end
#
# 11 PHE QE 13 GLY HA2 3.91 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 201, r1= 1.30, r2= 1.80, r3= 4.39, r4= 4.89,
 igr1= 170, 174,
 &end
#
# 11 PHE QE 51 PHE HB3 4.16 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 802, r1= 1.30, r2= 1.80, r3= 4.67, r4= 5.17,
 igr1= 170, 174,
 &end
#
# 11 PHE QE 80 LYS QE 4.75 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.98, r4= 6.48,
 igr1= 170, 174,
 igr2=1232,1233,
 &end
#
# 11 PHE QE 51 PHE HB2 3.75 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 801, r1= 1.30, r2= 1.80, r3= 4.21, r4= 4.71,
 igr1= 170, 174,
 &end
#
# 11 PHE QE 80 LYS QD 3.80 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.79, r4= 5.29,
 igr1= 170, 174,
 igr2=1229,1230,
 &end
#
# 11 PHE H 11 PHE QD 4.43 
 &rst
  ixpk= 0, nxpk= 0, iat= 160,  -1, r1= 1.30, r2= 1.80, r3= 4.97, r4= 5.47,
 igr2= 168, 176,
 &end
#
# 11 PHE HA 11 PHE QD 3.92 
 &rst
  ixpk= 0, nxpk= 0, iat= 162,  -1, r1= 1.30, r2= 1.80, r3= 4.40, r4= 4.90,
 igr2= 168, 176,
 &end
#
# 11 PHE QD 80 LYS QD 4.25 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.35, r4= 5.85,
 igr1= 168, 176,
 igr2=1229,1230,
 &end
#
# 11 PHE QD 82 GLU H 4.32 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1257, r1= 1.30, r2= 1.80, r3= 4.85, r4= 5.35,
 igr1= 168, 176,
 &end
#
# 11 PHE QD 53 PHE QE 4.05 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.10, r4= 5.60,
 igr1= 168, 176,
 igr2= 837, 841,
 &end
#
# 11 PHE QD 81 VAL HA 4.32 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1243, r1= 1.30, r2= 1.80, r3= 4.85, r4= 5.35,
 igr1= 168, 176,
 &end
#
# 11 PHE QD 82 GLU QG 6.00 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.56, r4= 8.06,
 igr1= 168, 176,
 igr2=1264,1265,
 &end
#
# 11 PHE QD 82 GLU HB3 4.36 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1262, r1= 1.30, r2= 1.80, r3= 4.89, r4= 5.39,
 igr1= 168, 176,
 &end
#
# 28 PHE QE 69 MET QE 3.96 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.34, r4= 5.84,
 igr1= 420, 424,
 igr2=1070,1071,1072,
 &end
#
# 11 PHE HA 53 PHE QE 4.02 
 &rst
  ixpk= 0, nxpk= 0, iat= 162,  -1, r1= 1.30, r2= 1.80, r3= 4.51, r4= 5.01,
 igr2= 837, 841,
 &end
#
# 40 MET HG3 53 PHE QE 3.65 
 &rst
  ixpk= 0, nxpk= 0, iat= 623,  -1, r1= 1.30, r2= 1.80, r3= 4.10, r4= 4.60,
 igr2= 837, 841,
 &end
#
# 40 MET HG2 53 PHE QE 4.16 
 &rst
  ixpk= 0, nxpk= 0, iat= 622,  -1, r1= 1.30, r2= 1.80, r3= 4.67, r4= 5.17,
 igr2= 837, 841,
 &end
#
# 87 PRO HB3 89 PHE HZ 4.65 
 &rst
  ixpk= 0, nxpk= 0, iat=1343,1372, r1= 1.30, r2= 1.80, r3= 4.65, r4= 5.15,  &end
#
# 28 PHE HZ 69 MET HB3 4.19 
 &rst
  ixpk= 0, nxpk= 0, iat= 422,1064, r1= 1.30, r2= 1.80, r3= 4.19, r4= 4.69,  &end
#
# 51 PHE QD 51 PHE HZ 3.91 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 809, r1= 1.30, r2= 1.80, r3= 4.39, r4= 4.89,
 igr1= 805, 813,
 &end
#
# 40 MET HG3 51 PHE HZ 4.00 
 &rst
  ixpk= 0, nxpk= 0, iat= 623, 809, r1= 1.30, r2= 1.80, r3= 4.00, r4= 4.50,  &end
#
# 40 MET HG2 51 PHE HZ 5.00 
 &rst
  ixpk= 0, nxpk= 0, iat= 622, 809, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50,  &end
#
# 40 MET HB2 51 PHE HZ 4.50 
 &rst
  ixpk= 0, nxpk= 0, iat= 619, 809, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
# 28 PHE QD 28 PHE HZ 3.80 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 422, r1= 1.30, r2= 1.80, r3= 4.27, r4= 4.77,
 igr1= 418, 426,
 &end
#
# 28 PHE HZ 81 VAL QG2 3.02 
 &rst
  ixpk= 0, nxpk= 0, iat= 422,  -1, r1= 1.30, r2= 1.80, r3= 3.63, r4= 4.13,
 igr2=1251,1252,1253,
 &end
#
# 28 PHE HZ 79 ILE QD1 3.09 
 &rst
  ixpk= 0, nxpk= 0, iat= 422,  -1, r1= 1.30, r2= 1.80, r3= 3.71, r4= 4.21,
 igr2=1213,1214,1215,
 &end
#
# 12 ILE QD1 28 PHE HZ 3.61 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 422, r1= 1.30, r2= 1.80, r3= 4.34, r4= 4.84,
 igr1= 193, 194, 195,
 &end
#
# 28 PHE HZ 69 MET HB2 5.00 
 &rst
  ixpk= 0, nxpk= 0, iat= 422,1063, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50,  &end
#
# 11 PHE HZ 13 GLY H 4.38 
 &rst
  ixpk= 0, nxpk= 0, iat= 172, 199, r1= 1.30, r2= 1.80, r3= 4.38, r4= 4.88,  &end
#
# 11 PHE QD 11 PHE HZ 4.18 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 172, r1= 1.30, r2= 1.80, r3= 4.69, r4= 5.19,
 igr1= 168, 176,
 &end
#
# 11 PHE HZ 13 GLY HA3 3.67 
 &rst
  ixpk= 0, nxpk= 0, iat= 172, 202, r1= 1.30, r2= 1.80, r3= 3.67, r4= 4.17,  &end
#
# 11 PHE HZ 51 PHE HB2 3.88 
 &rst
  ixpk= 0, nxpk= 0, iat= 172, 801, r1= 1.30, r2= 1.80, r3= 3.88, r4= 4.38,  &end
#
# 11 PHE HZ 13 GLY HA2 3.45 
 &rst
  ixpk= 0, nxpk= 0, iat= 172, 201, r1= 1.30, r2= 1.80, r3= 3.45, r4= 3.95,  &end
#
# 51 PHE QE 53 PHE HZ 4.19 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 839, r1= 1.30, r2= 1.80, r3= 4.70, r4= 5.20,
 igr1= 807, 811,
 &end
#
# 31 TYR QE 68 ASP HB3 2.99 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1052, r1= 1.30, r2= 1.80, r3= 3.36, r4= 3.86,
 igr1= 469, 474,
 &end
#
# 31 TYR QE 69 MET QG 3.23 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.07, r4= 4.57,
 igr1= 469, 474,
 igr2=1066,1067,
 &end
#
# 31 TYR QE 69 MET QE 3.98 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.37, r4= 5.87,
 igr1= 469, 474,
 igr2=1070,1071,1072,
 &end
#
# 30 LYS HB2 31 TYR QE 4.06 
 &rst
  ixpk= 0, nxpk= 0, iat= 441,  -1, r1= 1.30, r2= 1.80, r3= 4.56, r4= 5.06,
 igr2= 469, 474,
 &end
#
# 31 TYR QE 65 ALA QB 3.24 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.37, r4= 4.87,
 igr1= 469, 474,
 igr2=1007,1008,1009,
 &end
#
# 27 VAL QG2 31 TYR QE 3.45 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.65, r4= 5.15,
 igr1= 404, 405, 406,
 igr2= 469, 474,
 &end
#
# 31 TYR QE 69 MET H 4.30 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1059, r1= 1.30, r2= 1.80, r3= 4.83, r4= 5.33,
 igr1= 469, 474,
 &end
#
# 96 RADE H1' 96 RADE H8 4.00 (# )
 &rst
  ixpk= 0, nxpk= 0, iat=1477,1480, r1= 1.30, r2= 1.80, r3= 4.00, r4= 4.50, 
      rk2=50, rk3=50, ir6=1, ialtd=0,
 &end
#
# 96 RADE H2' 96 RADE H8 4.90 (#
 )
 &rst
  ixpk= 0, nxpk= 0, iat=1495,1480, r1= 1.30, r2= 1.80, r3= 4.90, r4= 5.40,  &end
#
# 96 RADE H3' 96 RADE H8 5.50 (# )
 &rst
  ixpk= 0, nxpk= 0, iat=1493,1480, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
# 96 RADE H4' 96 RADE H8 4.70 (# )
 &rst
  ixpk= 0, nxpk= 0, iat=1474,1480, r1= 1.30, r2= 1.80, r3= 4.70, r4= 5.20,  &end
#
# 96 RADE H5' 96 RADE H8 5.60 (# )
 &rst
  ixpk= 0, nxpk= 0, iat=1471,1480, r1= 1.30, r2= 1.80, r3= 5.60, r4= 6.10,  &end
#
# 96 RADE H5" 96 RADE H8 5.50 (#
 )
 &rst
  ixpk= 0, nxpk= 0, iat=1472,1480, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
# 96 RADE H1' 96 RADE H2 5.50 (#make )
 &rst
  ixpk= 0, nxpk= 0, iat=1477,1489, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
# 96 RADE H2' 96 RADE H2 5.30 (#make )
 &rst
  ixpk= 0, nxpk= 0, iat=1495,1489, r1= 1.30, r2= 1.80, r3= 5.30, r4= 5.80,  &end
#
# 96 RADE H1' 97 URA H6 5.10 (#
 )
 &rst
  ixpk= 0, nxpk= 0, iat=1477,1513, r1= 1.30, r2= 1.80, r3= 5.10, r4= 5.60,  &end
#
# 96 RADE H2' 97 URA H6 4.50 (#
 )
 &rst
  ixpk= 0, nxpk= 0, iat=1495,1513, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
# 96 RADE H3' 97 URA H6 4.50 (#
 )
 &rst
  ixpk= 0, nxpk= 0, iat=1493,1513, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
# 96 RADE H8 97 URA H6 5.50 (#, )
 &rst
  ixpk= 0, nxpk= 0, iat=1480,1513, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
# 96 RADE H8 97 URA H2' 6.00 (#make )
 &rst
  ixpk= 0, nxpk= 0, iat=1480,1525, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,  &end
#
# 96 RADE H8 97 URA H3' 5.40 (#make )
 &rst
  ixpk= 0, nxpk= 0, iat=1480,1523, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,  &end
#
# 96 RADE H2 97 URA H1' 5.20 (#make )
 &rst
  ixpk= 0, nxpk= 0, iat=1489,1510, r1= 1.30, r2= 1.80, r3= 5.20, r4= 5.70,  &end
#
# 96 RADE H2 97 URA H2' 6.00 (#very )
 &rst
  ixpk= 0, nxpk= 0, iat=1489,1525, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,  &end
#
# 96 RADE H2 97 URA H6 5.80 (#new, )
 &rst
  ixpk= 0, nxpk= 0, iat=1489,1513, r1= 1.30, r2= 1.80, r3= 5.80, r4= 6.30,  &end
#
# 97 URA H6 97 URA H1' 3.70 (# )
 &rst
  ixpk= 0, nxpk= 0, iat=1513,1510, r1= 1.30, r2= 1.80, r3= 3.70, r4= 4.20,  &end
#
# 97 URA H6 97 URA H2' 2.60 (# )
 &rst
  ixpk= 0, nxpk= 0, iat=1513,1525, r1= 1.30, r2= 1.80, r3= 2.60, r4= 3.10,  &end
#
# 97 URA H6 97 URA H3' 3.10 (#new )
 &rst
  ixpk= 0, nxpk= 0, iat=1513,1523, r1= 1.30, r2= 1.80, r3= 3.10, r4= 3.60,  &end
#
# 97 URA H6 97 URA H4' 4.00 (# )
 &rst
  ixpk= 0, nxpk= 0, iat=1513,1507, r1= 1.30, r2= 1.80, r3= 4.00, r4= 4.50,  &end
#
# 97 URA H6 97 URA H5' 3.60 (# )
 &rst
  ixpk= 0, nxpk= 0, iat=1513,1504, r1= 1.30, r2= 1.80, r3= 3.60, r4= 4.10,  &end
#
# 97 URA H6 97 URA H5" 3.60 (# )
 &rst
  ixpk= 0, nxpk= 0, iat=1513,1505, r1= 1.30, r2= 1.80, r3= 3.60, r4= 4.10,  &end
#
# 97 URA H3' 98 RCYT H6 4.20 (# )
 &rst
  ixpk= 0, nxpk= 0, iat=1523,1543, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,  &end
#
# 98 RCYT H6 98 RCYT H2' 2.90 (# )
 &rst
  ixpk= 0, nxpk= 0, iat=1543,1556, r1= 1.30, r2= 1.80, r3= 2.90, r4= 3.40,  &end
#
# 98 RCYT H6 98 RCYT H3' 4.70 (# )
 &rst
  ixpk= 0, nxpk= 0, iat=1543,1554, r1= 1.30, r2= 1.80, r3= 4.70, r4= 5.20,  &end
#
# 98 RCYT H6 98 RCYT H4' 3.70 (#
 )
 &rst
  ixpk= 0, nxpk= 0, iat=1543,1537, r1= 1.30, r2= 1.80, r3= 3.70, r4= 4.20,  &end
#
# 98 RCYT H6 98 RCYT H5' 4.00 (#
 )
 &rst
  ixpk= 0, nxpk= 0, iat=1543,1534, r1= 1.30, r2= 1.80, r3= 4.00, r4= 4.50,  &end
#
# 98 RCYT H6 98 RCYT H5" 3.90 (#
 )
 &rst
  ixpk= 0, nxpk= 0, iat=1543,1535, r1= 1.30, r2= 1.80, r3= 3.90, r4= 4.40,  &end
#
# 98 RCYT H2' 99 RADE H2 4.70 (# )
 &rst
  ixpk= 0, nxpk= 0, iat=1556,1583, r1= 1.30, r2= 1.80, r3= 4.70, r4= 5.20,  &end
#
# 99 RADE H8 99 RADE H1' 2.50 (#overlap )
 &rst
  ixpk= 0, nxpk= 0, iat=1574,1571, r1= 1.30, r2= 1.80, r3= 2.50, r4= 3.00,  &end
#
# 99 RADE H8 99 RADE H2' 4.00 (# )
 &rst
  ixpk= 0, nxpk= 0, iat=1574,1589, r1= 1.30, r2= 1.80, r3= 4.00, r4= 4.50,  &end
#
# 99 RADE H8 99 RADE H3' 5.60 (# )
 &rst
  ixpk= 0, nxpk= 0, iat=1574,1587, r1= 1.30, r2= 1.80, r3= 5.60, r4= 6.10,  &end
#
# 99 RADE H8 99 RADE H4' 5.60 (# )
 &rst
  ixpk= 0, nxpk= 0, iat=1574,1568, r1= 1.30, r2= 1.80, r3= 5.60, r4= 6.10,  &end
#
# 99 RADE H1' 100 RADE H8 4.50 (# )
 &rst
  ixpk= 0, nxpk= 0, iat=1571,1607, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
# 99 RADE H3' 100 RADE H8 5.20 (# )
 &rst
  ixpk= 0, nxpk= 0, iat=1587,1607, r1= 1.30, r2= 1.80, r3= 5.20, r4= 5.70,  &end
#
# 99 RADE H4' 100 RADE H8 5.50 (#(added )
 &rst
  ixpk= 0, nxpk= 0, iat=1568,1607, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
# 99 RADE H8 100 RADE H8 5.00 (# )
 &rst
  ixpk= 0, nxpk= 0, iat=1574,1607, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50,  &end
#
# 100 RADE H1' 100 RADE H8 4.60 (# )
 &rst
  ixpk= 0, nxpk= 0, iat=1604,1607, r1= 1.30, r2= 1.80, r3= 4.60, r4= 5.10,  &end
#
# 100 RADE H2' 100 RADE H8 3.50 (# )
 &rst
  ixpk= 0, nxpk= 0, iat=1622,1607, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
# 100 RADE H3' 100 RADE H8 4.60 (# )
 &rst
  ixpk= 0, nxpk= 0, iat=1620,1607, r1= 1.30, r2= 1.80, r3= 4.60, r4= 5.10,  &end
#
# 100 RADE H1' 100 RADE H2 5.00 (# )
 &rst
  ixpk= 0, nxpk= 0, iat=1604,1616, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50,  &end
#
# 100 RADE H3' 101 RADE H8 3.50 
 &rst
  ixpk= 0, nxpk= 0, iat=1620,1640, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
# 100 RADE H4' 101 RADE H8 5.70 (# )
 &rst
  ixpk= 0, nxpk= 0, iat=1601,1640, r1= 1.30, r2= 1.80, r3= 5.70, r4= 6.20,  &end
#
# 101 RADE H1' 101 RADE H8 4.50 (# )
 &rst
  ixpk= 0, nxpk= 0, iat=1637,1640, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
# 101 RADE H2' 101 RADE H8 4.00 (#increased )
 &rst
  ixpk= 0, nxpk= 0, iat=1655,1640, r1= 1.30, r2= 1.80, r3= 4.00, r4= 4.50,  &end
#
# 101 RADE H3' 101 RADE H8 4.00 (#increased )
 &rst
  ixpk= 0, nxpk= 0, iat=1653,1640, r1= 1.30, r2= 1.80, r3= 4.00, r4= 4.50,  &end
#
# 101 RADE H4' 101 RADE H8 5.10 (# )
 &rst
  ixpk= 0, nxpk= 0, iat=1634,1640, r1= 1.30, r2= 1.80, r3= 5.10, r4= 5.60,  &end
#
# 101 RADE H5' 101 RADE H8 5.20 (# )
 &rst
  ixpk= 0, nxpk= 0, iat=1631,1640, r1= 1.30, r2= 1.80, r3= 5.20, r4= 5.70,  &end
#
# 101 RADE H5" 101 RADE H8 5.40 (#, )
 &rst
  ixpk= 0, nxpk= 0, iat=1632,1640, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,  &end
#
# 101 RADE H1' 101 RADE H2 4.90 (#, )
 &rst
  ixpk= 0, nxpk= 0, iat=1637,1649, r1= 1.30, r2= 1.80, r3= 4.90, r4= 5.40,  &end
#
# 99 RADE H8 84 ALA QB 4.00 (# )
 &rst
  ixpk= 0, nxpk= 0, iat=1574,  -1, r1= 1.30, r2= 1.80, r3= 4.80, r4= 5.30,
 igr2=1293,1294,1295,
 &end
#
# 99 RADE H8 85 THR QG2 5.50 (# )
 &rst
  ixpk= 0, nxpk= 0, iat=1574,  -1, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr2=1305,1306,1307,
 &end
#
# 99 RADE H8 11 PHE QB 4.70 (# )
 &rst
  ixpk= 0, nxpk= 0, iat=1574,  -1, r1= 1.30, r2= 1.80, r3= 5.28, r4= 5.78,
 igr2= 164, 165,
 &end
#
# 99 RADE H8 87 PRO HA 5.00 (# )
 &rst
  ixpk= 0, nxpk= 0, iat=1574,1345, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50,  &end
#
# 99 RADE H8 53 PHE QE 3.00 (# )
 &rst
  ixpk= 0, nxpk= 0, iat=1574,  -1, r1= 1.30, r2= 1.80, r3= 3.37, r4= 3.87,
 igr2= 837, 841,
 &end
#
# 99 RADE H8 53 PHE QD 4.80 (# )
 &rst
  ixpk= 0, nxpk= 0, iat=1574,  -1, r1= 1.30, r2= 1.80, r3= 5.39, r4= 5.89,
 igr2= 835, 843,
 &end
#
# 99 RADE H8 53 PHE HZ 4.50 (# )
 &rst
  ixpk= 0, nxpk= 0, iat=1574, 839, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
# 99 RADE H8 51 PHE QE 5.20 (# )
 &rst
  ixpk= 0, nxpk= 0, iat=1574,  -1, r1= 1.30, r2= 1.80, r3= 5.84, r4= 6.34,
 igr2= 807, 811,
 &end
#
# 99 RADE H8 11 PHE QE 5.50 (# )
 &rst
  ixpk= 0, nxpk= 0, iat=1574,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2= 170, 174,
 &end
#
# 99 RADE H8 11 PHE HZ 5.80 (# )
 &rst
  ixpk= 0, nxpk= 0, iat=1574, 172, r1= 1.30, r2= 1.80, r3= 5.80, r4= 6.30,  &end
#
# 99 RADE H8 84 ALA HA 5.50 (#(added )
 &rst
  ixpk= 0, nxpk= 0, iat=1574,1291, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
# 99 RADE H2 11 PHE QE 4.50 (# )
 &rst
  ixpk= 0, nxpk= 0, iat=1583,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2= 170, 174,
 &end
#
# 99 RADE H2 11 PHE HZ 4.70 (# )
 &rst
  ixpk= 0, nxpk= 0, iat=1583, 172, r1= 1.30, r2= 1.80, r3= 4.70, r4= 5.20,  &end
#
# 99 RADE H1' 87 PRO HA 4.50 (#overlap )
 &rst
  ixpk= 0, nxpk= 0, iat=1571,1345, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
# 99 RADE H1' 53 PHE QE 4.90 (#overlap )
 &rst
  ixpk= 0, nxpk= 0, iat=1571,  -1, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,
 igr2= 837, 841,
 &end
#
# 99 RADE H1' 11 PHE HZ 4.90 (#overlap )
 &rst
  ixpk= 0, nxpk= 0, iat=1571, 172, r1= 1.30, r2= 1.80, r3= 4.90, r4= 5.40,  &end
#
# 99 RADE H1' 53 PHE HZ 5.00 (# )
 &rst
  ixpk= 0, nxpk= 0, iat=1571, 839, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50,  &end
#
# 99 RADE H1' 51 PHE QE 5.20 (# )
 &rst
  ixpk= 0, nxpk= 0, iat=1571,  -1, r1= 1.30, r2= 1.80, r3= 5.84, r4= 6.34,
 igr2= 807, 811,
 &end
#
# 99 RADE H2' 88 SER QB 4.50 (# )
 &rst
  ixpk= 0, nxpk= 0, iat=1589,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2=1353,1354,
 &end
#
# 99 RADE H3' 88 SER QB 3.70 (# )
 &rst
  ixpk= 0, nxpk= 0, iat=1587,  -1, r1= 1.30, r2= 1.80, r3= 4.15, r4= 4.65,
 igr2=1353,1354,
 &end
#
# 99 RADE H3' 51 PHE QE 4.80 (# )
 &rst
  ixpk= 0, nxpk= 0, iat=1587,  -1, r1= 1.30, r2= 1.80, r3= 5.39, r4= 5.89,
 igr2= 807, 811,
 &end
#
# 99 RADE H3' 51 PHE HZ 4.80 (# )
 &rst
  ixpk= 0, nxpk= 0, iat=1587, 809, r1= 1.30, r2= 1.80, r3= 4.80, r4= 5.30,  &end
#
# 99 RADE H4' 51 PHE QD 4.50 (#not )
 &rst
  ixpk= 0, nxpk= 0, iat=1568,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2= 805, 813,
 &end
#
# 99 RADE H4' 51 PHE QE 3.60 (# )
 &rst
  ixpk= 0, nxpk= 0, iat=1568,  -1, r1= 1.30, r2= 1.80, r3= 4.04, r4= 4.54,
 igr2= 807, 811,
 &end
#
# 99 RADE H4' 51 PHE HZ 3.80 (# )
 &rst
  ixpk= 0, nxpk= 0, iat=1568, 809, r1= 1.30, r2= 1.80, r3= 3.80, r4= 4.30,  &end
#
# 99 RADE H4' 11 PHE QE 4.20 (# )
 &rst
  ixpk= 0, nxpk= 0, iat=1568,  -1, r1= 1.30, r2= 1.80, r3= 4.71, r4= 5.21,
 igr2= 170, 174,
 &end
#
# 99 RADE H4' 11 PHE HZ 4.80 (# )
 &rst
  ixpk= 0, nxpk= 0, iat=1568, 172, r1= 1.30, r2= 1.80, r3= 4.80, r4= 5.30,  &end
#
# 99 RADE H4' 53 PHE HZ 4.80 (# )
 &rst
  ixpk= 0, nxpk= 0, iat=1568, 839, r1= 1.30, r2= 1.80, r3= 4.80, r4= 5.30,  &end
#
# 100 RADE H8 87 PRO HB3 5.00 (# )
 &rst
  ixpk= 0, nxpk= 0, iat=1607,1343, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50,  &end
#
# 100 RADE H8 87 PRO HA 4.00 (# )
 &rst
  ixpk= 0, nxpk= 0, iat=1607,1345, r1= 1.30, r2= 1.80, r3= 4.00, r4= 4.50,  &end
#
# 100 RADE H8 87 PRO HB2 6.00 (# )
 &rst
  ixpk= 0, nxpk= 0, iat=1607,1342, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,  &end
#
# 100 RADE H8 53 PHE QE 6.00 (# )
 &rst
  ixpk= 0, nxpk= 0, iat=1607,  -1, r1= 1.30, r2= 1.80, r3= 6.73, r4= 7.23,
 igr2= 837, 841,
 &end
#
# 100 RADE H8 51 PHE QE 5.50 (# )
 &rst
  ixpk= 0, nxpk= 0, iat=1607,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2= 807, 811,
 &end
#
# 100 RADE H2 53 PHE HB3 4.50 (# )
 &rst
  ixpk= 0, nxpk= 0, iat=1616, 832, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
# 100 RADE H2 53 PHE HB2 4.50 (# )
 &rst
  ixpk= 0, nxpk= 0, iat=1616, 831, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
# 100 RADE H2 38 LEU QD1 3.80 
 &rst
  ixpk= 0, nxpk= 0, iat=1616,  -1, r1= 1.30, r2= 1.80, r3= 4.56, r4= 5.06,
 igr2= 586, 587, 588,
 &end
#
# 100 RADE H2 38 LEU QD2 4.00 
 &rst
  ixpk= 0, nxpk= 0, iat=1616,  -1, r1= 1.30, r2= 1.80, r3= 4.80, r4= 5.30,
 igr2= 590, 591, 592,
 &end
#
# 100 RADE H2 38 LEU HG 5.30 (#not )
 &rst
  ixpk= 0, nxpk= 0, iat=1616, 584, r1= 1.30, r2= 1.80, r3= 5.30, r4= 5.80,  &end
#
# 100 RADE H2 40 MET QE 5.40 (# )
 &rst
  ixpk= 0, nxpk= 0, iat=1616,  -1, r1= 1.30, r2= 1.80, r3= 6.49, r4= 6.99,
 igr2= 626, 627, 628,
 &end
#
# 100 RADE H2 38 LEU QB 5.70 (# )
 &rst
  ixpk= 0, nxpk= 0, iat=1616,  -1, r1= 1.30, r2= 1.80, r3= 6.40, r4= 6.90,
 igr2= 581, 582,
 &end
#
# 100 RADE H2 53 PHE QD 4.80 (# )
 &rst
  ixpk= 0, nxpk= 0, iat=1616,  -1, r1= 1.30, r2= 1.80, r3= 5.39, r4= 5.89,
 igr2= 835, 843,
 &end
#
# 100 RADE H2 9 LYS HE3 5.50 (# )
 &rst
  ixpk= 0, nxpk= 0, iat=1616, 133, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
# 100 RADE H2 9 LYS HE2 5.50 (# )
 &rst
  ixpk= 0, nxpk= 0, iat=1616, 132, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
# 100 RADE H2 9 LYS QD 5.00 (# )
 &rst
  ixpk= 0, nxpk= 0, iat=1616,  -1, r1= 1.30, r2= 1.80, r3= 5.61, r4= 6.11,
 igr2= 129, 130,
 &end
#
# 100 RADE H1' 40 MET QE 3.00 
 &rst
  ixpk= 0, nxpk= 0, iat=1604,  -1, r1= 1.30, r2= 1.80, r3= 3.60, r4= 4.10,
 igr2= 626, 627, 628,
 &end
#
# 100 RADE H1' 40 MET HG3 5.40 (#
 )
 &rst
  ixpk= 0, nxpk= 0, iat=1604, 623, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,  &end
#
# 100 RADE H1' 38 LEU QD1 5.20 (#not )
 &rst
  ixpk= 0, nxpk= 0, iat=1604,  -1, r1= 1.30, r2= 1.80, r3= 6.24, r4= 6.74,
 igr2= 586, 587, 588,
 &end
#
# 100 RADE H1' 38 LEU QD2 6.00 (# )
 &rst
  ixpk= 0, nxpk= 0, iat=1604,  -1, r1= 1.30, r2= 1.80, r3= 7.21, r4= 7.71,
 igr2= 590, 591, 592,
 &end
#
# 100 RADE H1' 53 PHE QE 4.90 (# )
 &rst
  ixpk= 0, nxpk= 0, iat=1604,  -1, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,
 igr2= 837, 841,
 &end
#
# 100 RADE H1' 51 PHE QE 5.20 (#
 )
 &rst
  ixpk= 0, nxpk= 0, iat=1604,  -1, r1= 1.30, r2= 1.80, r3= 5.84, r4= 6.34,
 igr2= 807, 811,
 &end
#
# 100 RADE H2' 87 PRO HB2 3.00 (#all )
 &rst
  ixpk= 0, nxpk= 0, iat=1622,1342, r1= 1.30, r2= 1.80, r3= 3.00, r4= 3.50,  &end
#
# 100 RADE H2' 87 PRO HB3 3.50 (#in )
 &rst
  ixpk= 0, nxpk= 0, iat=1622,1343, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
# 100 RADE H2' 87 PRO QG 4.8 (#in )
 &rst
  ixpk= 0, nxpk= 0, iat=1622,  -1, r1= 1.30, r2= 1.80, r3= 5.39, r4= 5.89,
 igr2=1339,1340,
 &end
#
# 100 RADE H2' 40 MET QE 5.00 (#in )
 &rst
  ixpk= 0, nxpk= 0, iat=1622,  -1, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,
 igr2= 626, 627, 628,
 &end
#
# 100 RADE H2' 87 PRO HA 4.80 (#(added )
 &rst
  ixpk= 0, nxpk= 0, iat=1622,1345, r1= 1.30, r2= 1.80, r3= 4.80, r4= 5.30,  &end
#
# 100 RADE H2' 89 PHE HZ 4.20 (# )
 &rst
  ixpk= 0, nxpk= 0, iat=1622,1372, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,  &end
#
# 100 RADE H2' 89 PHE QD 4.00 (# )
 &rst
  ixpk= 0, nxpk= 0, iat=1622,  -1, r1= 1.30, r2= 1.80, r3= 4.49, r4= 4.99,
 igr2=1368,1376,
 &end
#
# 100 RADE H2' 89 PHE QE 3.50 (# )
 &rst
  ixpk= 0, nxpk= 0, iat=1622,  -1, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr2=1370,1374,
 &end
#
# 100 RADE H2' 51 PHE HZ 5.00 
 &rst
  ixpk= 0, nxpk= 0, iat=1622, 809, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50,  &end
#
# 100 RADE H2' 38 LEU QD1 5.50 (# )
 &rst
  ixpk= 0, nxpk= 0, iat=1622,  -1, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr2= 586, 587, 588,
 &end
#
# 100 RADE H3' 40 MET QE 4.00 (# )
 &rst
  ixpk= 0, nxpk= 0, iat=1620,  -1, r1= 1.30, r2= 1.80, r3= 4.80, r4= 5.30,
 igr2= 626, 627, 628,
 &end
#
# 100 RADE H3' 87 PRO HB3 5.00 (#not )
 &rst
  ixpk= 0, nxpk= 0, iat=1620,1343, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50,  &end
#
# 100 RADE H3' 87 PRO HB2 6.00 (# )
 &rst
  ixpk= 0, nxpk= 0, iat=1620,1342, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,  &end
#
# 100 RADE H3' 89 PHE QB 6.00 (#not )
 &rst
  ixpk= 0, nxpk= 0, iat=1620,  -1, r1= 1.30, r2= 1.80, r3= 6.73, r4= 7.23,
 igr2=1364,1365,
 &end
#
# 100 RADE H3' 87 PRO QG 6.00 (# )
 &rst
  ixpk= 0, nxpk= 0, iat=1620,  -1, r1= 1.30, r2= 1.80, r3= 6.73, r4= 7.23,
 igr2=1339,1340,
 &end
#
# 100 RADE H3' 51 PHE HZ 4.60 (# )
 &rst
  ixpk= 0, nxpk= 0, iat=1620, 809, r1= 1.30, r2= 1.80, r3= 4.60, r4= 5.10,  &end
#
# 100 RADE H3' 51 PHE QE 5.20 (# )
 &rst
  ixpk= 0, nxpk= 0, iat=1620,  -1, r1= 1.30, r2= 1.80, r3= 5.84, r4= 6.34,
 igr2= 807, 811,
 &end
#
# 100 RADE H3' 89 PHE HZ 4.20 (# )
 &rst
  ixpk= 0, nxpk= 0, iat=1620,1372, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,  &end
#
# 100 RADE H3' 89 PHE QE 3.80 (# )
 &rst
  ixpk= 0, nxpk= 0, iat=1620,  -1, r1= 1.30, r2= 1.80, r3= 4.27, r4= 4.77,
 igr2=1370,1374,
 &end
#
# 100 RADE H3' 89 PHE QD 4.80 (# )
 &rst
  ixpk= 0, nxpk= 0, iat=1620,  -1, r1= 1.30, r2= 1.80, r3= 5.39, r4= 5.89,
 igr2=1368,1376,
 &end
#
# 100 RADE H4' 40 MET QE 3.60 
 &rst
  ixpk= 0, nxpk= 0, iat=1601,  -1, r1= 1.30, r2= 1.80, r3= 4.32, r4= 4.82,
 igr2= 626, 627, 628,
 &end
#
# 100 RADE H4' 40 MET QG 5.50 (# )
 &rst
  ixpk= 0, nxpk= 0, iat=1601,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2= 622, 623,
 &end
#
# 100 RADE H4' 51 PHE HZ 3.60 (# )
 &rst
  ixpk= 0, nxpk= 0, iat=1601, 809, r1= 1.30, r2= 1.80, r3= 3.60, r4= 4.10,  &end
#
# 100 RADE H4' 51 PHE QE 4.20 (# )
 &rst
  ixpk= 0, nxpk= 0, iat=1601,  -1, r1= 1.30, r2= 1.80, r3= 4.71, r4= 5.21,
 igr2= 807, 811,
 &end
#
# 100 RADE Q5' 51 PHE QD 5.00 (# )
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.30, r4= 6.80,
 igr1=1598,1599,
 igr2= 805, 813,
 &end
#
# 100 RADE Q5' 51 PHE QE 4.00 (# )
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.04, r4= 5.54,
 igr1=1598,1599,
 igr2= 807, 811,
 &end
#
# 100 RADE Q5' 51 PHE HZ 3.20 (# )
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 809, r1= 1.30, r2= 1.80, r3= 3.59, r4= 4.09,
 igr1=1598,1599,
 &end
#
# 100 RADE Q5' 40 MET QE 5.00 (# )
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.74, r4= 7.24,
 igr1=1598,1599,
 igr2= 626, 627, 628,
 &end
#
# 100 RADE Q5' 40 MET QG 5.00 (# )
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.30, r4= 6.80,
 igr1=1598,1599,
 igr2= 622, 623,
 &end
#
# 101 RADE H8 89 PHE QE 5.00 (# )
 &rst
  ixpk= 0, nxpk= 0, iat=1640,  -1, r1= 1.30, r2= 1.80, r3= 5.61, r4= 6.11,
 igr2=1370,1374,
 &end
#
# 101 RADE H8 89 PHE QD 6.00 (# )
 &rst
  ixpk= 0, nxpk= 0, iat=1640,  -1, r1= 1.30, r2= 1.80, r3= 6.73, r4= 7.23,
 igr2=1368,1376,
 &end
#
# 101 RADE H8 89 PHE HZ 6.00 (# )
 &rst
  ixpk= 0, nxpk= 0, iat=1640,1372, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,  &end
#
# 101 RADE H2 89 PHE QB 4.00 (#not )
 &rst
  ixpk= 0, nxpk= 0, iat=1649,  -1, r1= 1.30, r2= 1.80, r3= 4.49, r4= 4.99,
 igr2=1364,1365,
 &end
#
# 101 RADE H2 89 PHE QD 4.80 (# )
 &rst
  ixpk= 0, nxpk= 0, iat=1649,  -1, r1= 1.30, r2= 1.80, r3= 5.39, r4= 5.89,
 igr2=1368,1376,
 &end
#
# 101 RADE H2 89 PHE QE 5.00 (# )
 &rst
  ixpk= 0, nxpk= 0, iat=1649,  -1, r1= 1.30, r2= 1.80, r3= 5.61, r4= 6.11,
 igr2=1370,1374,
 &end
#
# 101 RADE H1' 89 PHE QB 6.00 (#not )
 &rst
  ixpk= 0, nxpk= 0, iat=1637,  -1, r1= 1.30, r2= 1.80, r3= 6.73, r4= 7.23,
 igr2=1364,1365,
 &end
#
# 101 RADE H1' 89 PHE QD 5.50 (# )
 &rst
  ixpk= 0, nxpk= 0, iat=1637,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=1368,1376,
 &end
#
# 101 RADE H1' 89 PHE HZ 5.50 (# )
 &rst
  ixpk= 0, nxpk= 0, iat=1637,1372, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
# 101 RADE H1' 89 PHE QE 4.80 (# )
 &rst
  ixpk= 0, nxpk= 0, iat=1637,  -1, r1= 1.30, r2= 1.80, r3= 5.39, r4= 5.89,
 igr2=1370,1374,
 &end
#
# 101 RADE H3' 40 MET QE 5.80 (# )
 &rst
  ixpk= 0, nxpk= 0, iat=1653,  -1, r1= 1.30, r2= 1.80, r3= 6.97, r4= 7.47,
 igr2= 626, 627, 628,
 &end
#
# 101 RADE H4' 40 MET QE 5.50 (# )
 &rst
  ixpk= 0, nxpk= 0, iat=1634,  -1, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr2= 626, 627, 628,
 &end
#
# 101 RADE H4' 89 PHE QE 4.20 (# )
 &rst
  ixpk= 0, nxpk= 0, iat=1634,  -1, r1= 1.30, r2= 1.80, r3= 4.71, r4= 5.21,
 igr2=1370,1374,
 &end
#
# 101 RADE H5' 40 MET QE 5.50 (# )
 &rst
  ixpk= 0, nxpk= 0, iat=1631,  -1, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr2= 626, 627, 628,
 &end
#
# 101 RADE H5' 89 PHE HZ 4.20 (# )
 &rst
  ixpk= 0, nxpk= 0, iat=1631,1372, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,  &end
#
# 101 RADE H5' 89 PHE QE 4.50 (# )
 &rst
  ixpk= 0, nxpk= 0, iat=1631,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2=1370,1374,
 &end
#
# 101 RADE H5" 40 MET QE 5.50 (# )
 &rst
  ixpk= 0, nxpk= 0, iat=1632,  -1, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr2= 626, 627, 628,
 &end
#
# 101 RADE H5" 89 PHE HZ 6.00 (# )
 &rst
  ixpk= 0, nxpk= 0, iat=1632,1372, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,  &end
#
# 38 LEU H 53 PHE O 1.8 2.4
 &rst
  ixpk= 0, nxpk= 0, iat= 577, 845, r1= 1.30, r2= 1.80, r3= 2.40, r4= 2.90, 
      rk2=50, rk3=50, ir6=1, ialtd=0,
 &end
#
# 38 LEU N 53 PHE O 2.4 3.4
 &rst
  ixpk= 0, nxpk= 0, iat= 576, 845, r1= 1.90, r2= 2.40, r3= 3.40, r4= 3.90,  &end
#
# 36 GLU O 55 THR H 1.8 2.4
 &rst
  ixpk= 0, nxpk= 0, iat= 559, 863, r1= 1.30, r2= 1.80, r3= 2.40, r4= 2.90,  &end
#
# 36 GLU O 55 THR N 2.4 3.4
 &rst
  ixpk= 0, nxpk= 0, iat= 559, 862, r1= 1.90, r2= 2.40, r3= 3.40, r4= 3.90,  &end
#
# 38 LEU O 53 PHE H 1.8 2.4
 &rst
  ixpk= 0, nxpk= 0, iat= 594, 827, r1= 1.30, r2= 1.80, r3= 2.40, r4= 2.90,  &end
#
# 38 LEU O 53 PHE N 2.4 3.4
 &rst
  ixpk= 0, nxpk= 0, iat= 594, 826, r1= 1.90, r2= 2.40, r3= 3.40, r4= 3.90,  &end
#
# 36 GLU H 55 THR O 1.8 2.4
 &rst
  ixpk= 0, nxpk= 0, iat= 546, 875, r1= 1.30, r2= 1.80, r3= 2.40, r4= 2.90,  &end
#
# 36 GLU N 55 THR O 2.4 3.4
 &rst
  ixpk= 0, nxpk= 0, iat= 545, 875, r1= 1.90, r2= 2.40, r3= 3.40, r4= 3.90,  &end
#
# 54 VAL H 10 LEU O 1.8 2.4
 &rst
  ixpk= 0, nxpk= 0, iat= 847, 158, r1= 1.30, r2= 1.80, r3= 2.40, r4= 2.90,  &end
#
# 54 VAL N 10 LEU O 2.4 3.4
 &rst
  ixpk= 0, nxpk= 0, iat= 846, 158, r1= 1.90, r2= 2.40, r3= 3.40, r4= 3.90,  &end
#
# 54 VAL O 10 LEU H 1.8 2.4
 &rst
  ixpk= 0, nxpk= 0, iat= 861, 141, r1= 1.30, r2= 1.80, r3= 2.40, r4= 2.90,  &end
#
# 54 VAL O 10 LEU N 2.4 3.4
 &rst
  ixpk= 0, nxpk= 0, iat= 861, 140, r1= 1.90, r2= 2.40, r3= 3.40, r4= 3.90,  &end
#
# 12 ILE O 52 ALA H 1.8 2.4
 &rst
  ixpk= 0, nxpk= 0, iat= 197, 817, r1= 1.30, r2= 1.80, r3= 2.40, r4= 2.90,  &end
#
# 12 ILE O 52 ALA N 2.4 3.4
 &rst
  ixpk= 0, nxpk= 0, iat= 197, 816, r1= 1.90, r2= 2.40, r3= 3.40, r4= 3.90,  &end
#
# 12 ILE H 52 ALA O 1.8 2.4
 &rst
  ixpk= 0, nxpk= 0, iat= 180, 825, r1= 1.30, r2= 1.80, r3= 2.40, r4= 2.90,  &end
#
# 12 ILE N 52 ALA O 2.4 3.4
 &rst
  ixpk= 0, nxpk= 0, iat= 179, 825, r1= 1.90, r2= 2.40, r3= 3.40, r4= 3.90,  &end
#
# 51 PHE O 40 MET H 1.8 2.4
 &rst
  ixpk= 0, nxpk= 0, iat= 815, 615, r1= 1.30, r2= 1.80, r3= 2.40, r4= 2.90,  &end
#
# 51 PHE O 40 MET N 2.4 3.4
 &rst
  ixpk= 0, nxpk= 0, iat= 815, 614, r1= 1.90, r2= 2.40, r3= 3.40, r4= 3.90,  &end
#
# 13 GLY H 80 LYS O 1.8 2.4
 &rst
  ixpk= 0, nxpk= 0, iat= 199,1239, r1= 1.30, r2= 1.80, r3= 2.40, r4= 2.90,  &end
#
# 13 GLY N 80 LYS O 2.4 3.4
 &rst
  ixpk= 0, nxpk= 0, iat= 198,1239, r1= 1.90, r2= 2.40, r3= 3.40, r4= 3.90,  &end
#
# 22 LYS O 26 ALA H 1.8 2.4
 &rst
  ixpk= 0, nxpk= 0, iat= 338, 384, r1= 1.30, r2= 1.80, r3= 2.40, r4= 2.90,  &end
#
# 22 LYS O 26 ALA N 2.4 3.4
 &rst
  ixpk= 0, nxpk= 0, iat= 338, 383, r1= 1.90, r2= 2.40, r3= 3.40, r4= 3.90,  &end
#
# 23 ALA O 27 VAL H 1.8 2.4
 &rst
  ixpk= 0, nxpk= 0, iat= 348, 394, r1= 1.30, r2= 1.80, r3= 2.40, r4= 2.90,  &end
#
# 23 ALA O 27 VAL N 2.4 3.4
 &rst
  ixpk= 0, nxpk= 0, iat= 348, 393, r1= 1.90, r2= 2.40, r3= 3.40, r4= 3.90,  &end
#
# 24 LEU O 28 PHE H 1.8 2.4
 &rst
  ixpk= 0, nxpk= 0, iat= 367, 410, r1= 1.30, r2= 1.80, r3= 2.40, r4= 2.90,  &end
#
# 24 LEU O 28 PHE N 2.4 3.4
 &rst
  ixpk= 0, nxpk= 0, iat= 367, 409, r1= 1.90, r2= 2.40, r3= 3.40, r4= 3.90,  &end
#
# 25 GLU O 29 GLY H 1.8 2.4
 &rst
  ixpk= 0, nxpk= 0, iat= 382, 430, r1= 1.30, r2= 1.80, r3= 2.40, r4= 2.90,  &end
#
# 25 GLU O 29 GLY N 2.4 3.4
 &rst
  ixpk= 0, nxpk= 0, iat= 382, 429, r1= 1.90, r2= 2.40, r3= 3.40, r4= 3.90,  &end
#
# 63 LYS O 67 ARG H 1.8 2.4
 &rst
  ixpk= 0, nxpk= 0, iat= 989,1023, r1= 1.30, r2= 1.80, r3= 2.40, r4= 2.90,  &end
#
# 63 LYS O 67 ARG N 2.4 3.4
 &rst
  ixpk= 0, nxpk= 0, iat= 989,1022, r1= 1.90, r2= 2.40, r3= 3.40, r4= 3.90,  &end
#
# 99 RADE N7 85 THR H 1.8 2.4
 &rst
  ixpk= 0, nxpk= 0, iat=1575,1299, r1= 1.30, r2= 1.80, r3= 2.40, r4= 2.90,  &end
#
# 99 RADE N7 85 THR N 2.4 3.4
 &rst
  ixpk= 0, nxpk= 0, iat=1575,1298, r1= 1.90, r2= 2.40, r3= 3.40, r4= 3.90,  &end
#
# 9 LYS QD 4 ALA QB 6.0 50.0
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 5.50, r2= 6.00, r3=67.40, r4=67.90,
 igr1= 129, 130,
 igr2=  56,  57,  58,
 &end
#
# 9 LYS QG 4 ALA QB 6.0 50.0
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 5.50, r2= 6.00, r3=67.40, r4=67.90,
 igr1= 126, 127,
 igr2=  56,  57,  58,
 &end
#
# 9 LYS QE 2 VAL QG2 6.0 50.0
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 5.50, r2= 6.00, r3=67.40, r4=67.90,
 igr1= 132, 133,
 igr2=  31,  32,  33,
 &end
#
# 100 RADE H4' 101 RADE H8 5.00 50.0
 &rst
  ixpk= 0, nxpk= 0, iat=1601,1640, r1= 4.50, r2= 5.00, r3=50.00, r4=50.50,  &end
# 1659 atoms read from pdb file amber_cycle001.pdb.
# 96 ADE DELTA:  (96 RA5 C5')-(96 RA5 C4')-(96 RA5 C3')-(96 RA5 O3') 130.0 190.0
 &rst     iat =  1470,  1473,  1492,  1498,
   r1 = 129.0, r2 = 130.0, r3 = 190.0, r4 = 191.0,
   rk2 =   1000, rk3 =   1000,    &end

# 97 URA DELTA:  (97 RU C5')-(97 RU C4')-(97 RU C3')-(97 RU O3') 130.0 190.0
 &rst     iat =  1503,  1506,  1522,  1528,
   r1 = 129.0, r2 = 130.0, r3 = 190.0, r4 = 191.0,
 &end

# 98 CYT DELTA:  (98 RC C5')-(98 RC C4')-(98 RC C3')-(98 RC O3') 130.0 190.0
 &rst     iat =  1533,  1536,  1553,  1559,
   r1 = 129.0, r2 = 130.0, r3 = 190.0, r4 = 191.0,
 &end

# 99 ADE DELTA:  (99 RA C5')-(99 RA C4')-(99 RA C3')-(99 RA O3') 130.0 190.0
 &rst     iat =  1564,  1567,  1586,  1592,
   r1 = 129.0, r2 = 130.0, r3 = 190.0, r4 = 191.0,
 &end

# 100 ADE DELTA:  (100 RA C5')-(100 RA C4')-(100 RA C3')-(100 RA O3') 130.0 190.0
 &rst     iat =  1597,  1600,  1619,  1625,
   r1 = 129.0, r2 = 130.0, r3 = 190.0, r4 = 191.0,
 &end

# 101 ADE DELTA:  (101 RA3 C5')-(101 RA3 C4')-(101 RA3 C3')-(101 RA3 O3') 130.0 190.0
 &rst     iat =  1630,  1633,  1652,  1658,
   r1 = 129.0, r2 = 130.0, r3 = 190.0, r4 = 191.0,
 &end

#
#  chirality for residue 1 atoms:  CA CG HB2 HB3
 &rst iat=5,10,8,9, 
   r1=10., r2=60., r3=80., r4=130., rk2 = 200., rk3 = 200.,  &end
#
#  chirality for residue 1 atoms:  CB SD HG2 HG3
 &rst iat=7,13,11,12, &end
#
#  chirality for residue 1 atoms:  N C HA CB
 &rst iat=1,18,6,7, &end
#
#  chirality for residue 2 atoms:  CA CG1 CG2 HB
 &rst iat=22,26,30,25, &end
#
#  chirality for residue 2 atoms:  N C HA CB
 &rst iat=20,34,23,24, &end
#
#  chirality for residue 3 atoms:  CA CG HB2 HB3
 &rst iat=38,43,41,42, &end
#
#  chirality for residue 3 atoms:  CB CD HG2 HG3
 &rst iat=40,46,44,45, &end
#
#  chirality for residue 3 atoms:  N C HA CB
 &rst iat=36,49,39,40, &end
#
#  chirality for residue 4 atoms:  N C HA CB
 &rst iat=51,59,54,55, &end
#
#  chirality for residue 5 atoms:  CA CG HB2 HB3
 &rst iat=63,68,66,67, &end
#
#  chirality for residue 5 atoms:  N C HA CB
 &rst iat=61,71,64,65, &end
#
#  chirality for residue 6 atoms:  CA CG HB2 HB3
 &rst iat=75,80,78,79, &end
#
#  chirality for residue 6 atoms:  CB CD HG2 HG3
 &rst iat=77,83,81,82, &end
#
#  chirality for residue 6 atoms:  CG NE HD2 HD3
 &rst iat=80,86,84,85, &end
#
#  chirality for residue 6 atoms:  N C HA CB
 &rst iat=73,95,76,77, &end
#
#  chirality for residue 7 atoms:  CA CG HB2 HB3
 &rst iat=107,101,105,106, &end
#
#  chirality for residue 7 atoms:  CB CD HG2 HG3
 &rst iat=104,98,102,103, &end
#
#  chirality for residue 7 atoms:  CG N HD2 HD3
 &rst iat=101,97,99,100, &end
#
#  chirality for residue 7 atoms:  N C HA CB
 &rst iat=97,109,108,104, &end
#
#  chirality for residue 8 atoms:  N C HA2 HA3
 &rst iat=111,116,114,115, &end
#
#  chirality for residue 9 atoms:  CA CG HB2 HB3
 &rst iat=120,125,123,124, &end
#
#  chirality for residue 9 atoms:  CB CD HG2 HG3
 &rst iat=122,128,126,127, &end
#
#  chirality for residue 9 atoms:  CD NZ HE2 HE3
 &rst iat=128,134,132,133, &end
#
#  chirality for residue 9 atoms:  CG CE HD2 HD3
 &rst iat=125,131,129,130, &end
#
#  chirality for residue 9 atoms:  N C HA CB
 &rst iat=118,138,121,122, &end
#
#  chirality for residue 10 atoms:  CA CG HB2 HB3
 &rst iat=142,147,145,146, &end
#
#  chirality for residue 10 atoms:  CB CD1 CD2 HG
 &rst iat=144,149,153,148, &end
#
#  chirality for residue 10 atoms:  N C HA CB
 &rst iat=140,157,143,144, &end
#
#  chirality for residue 11 atoms:  CA CG HB2 HB3
 &rst iat=161,166,164,165, &end
#
#  chirality for residue 11 atoms:  N C HA CB
 &rst iat=159,177,162,163, &end
#
#  chirality for residue 12 atoms:  CA CG2 CG1 HB
 &rst iat=181,185,189,184, &end
#
#  chirality for residue 12 atoms:  CB CD1 HG12 HG13
 &rst iat=183,192,190,191, &end
#
#  chirality for residue 12 atoms:  N C HA CB
 &rst iat=179,196,182,183, &end
#
#  chirality for residue 13 atoms:  N C HA2 HA3
 &rst iat=198,203,201,202, &end
#
#  chirality for residue 14 atoms:  N C HA2 HA3
 &rst iat=205,210,208,209, &end
#
#  chirality for residue 15 atoms:  CA CG HB2 HB3
 &rst iat=214,219,217,218, &end
#
#  chirality for residue 15 atoms:  CB CD1 CD2 HG
 &rst iat=216,221,225,220, &end
#
#  chirality for residue 15 atoms:  N C HA CB
 &rst iat=212,229,215,216, &end
#
#  chirality for residue 16 atoms:  CA CG HB2 HB3
 &rst iat=233,238,236,237, &end
#
#  chirality for residue 16 atoms:  N C HA CB
 &rst iat=231,243,234,235, &end
#
#  chirality for residue 17 atoms:  CA CG2 OG1 HB
 &rst iat=247,251,255,250, &end
#
#  chirality for residue 17 atoms:  N C HA CB
 &rst iat=245,257,248,249, &end
#
#  chirality for residue 18 atoms:  CA CG HB2 HB3
 &rst iat=261,266,264,265, &end
#
#  chirality for residue 18 atoms:  CB CD HG2 HG3
 &rst iat=263,269,267,268, &end
#
#  chirality for residue 18 atoms:  N C HA CB
 &rst iat=259,272,262,263, &end
#
#  chirality for residue 19 atoms:  CA CG2 OG1 HB
 &rst iat=276,280,284,279, &end
#
#  chirality for residue 19 atoms:  N C HA CB
 &rst iat=274,286,277,278, &end
#
#  chirality for residue 20 atoms:  CA CG HB2 HB3
 &rst iat=290,295,293,294, &end
#
#  chirality for residue 20 atoms:  N C HA CB
 &rst iat=288,300,291,292, &end
#
#  chirality for residue 21 atoms:  CA CG HB2 HB3
 &rst iat=304,309,307,308, &end
#
#  chirality for residue 21 atoms:  CB CD HG2 HG3
 &rst iat=306,312,310,311, &end
#
#  chirality for residue 21 atoms:  N C HA CB
 &rst iat=302,315,305,306, &end
#
#  chirality for residue 22 atoms:  CA CG HB2 HB3
 &rst iat=319,324,322,323, &end
#
#  chirality for residue 22 atoms:  CB CD HG2 HG3
 &rst iat=321,327,325,326, &end
#
#  chirality for residue 22 atoms:  CD NZ HE2 HE3
 &rst iat=327,333,331,332, &end
#
#  chirality for residue 22 atoms:  CG CE HD2 HD3
 &rst iat=324,330,328,329, &end
#
#  chirality for residue 22 atoms:  N C HA CB
 &rst iat=317,337,320,321, &end
#
#  chirality for residue 23 atoms:  N C HA CB
 &rst iat=339,347,342,343, &end
#
#  chirality for residue 24 atoms:  CA CG HB2 HB3
 &rst iat=351,356,354,355, &end
#
#  chirality for residue 24 atoms:  CB CD1 CD2 HG
 &rst iat=353,358,362,357, &end
#
#  chirality for residue 24 atoms:  N C HA CB
 &rst iat=349,366,352,353, &end
#
#  chirality for residue 25 atoms:  CA CG HB2 HB3
 &rst iat=370,375,373,374, &end
#
#  chirality for residue 25 atoms:  CB CD HG2 HG3
 &rst iat=372,378,376,377, &end
#
#  chirality for residue 25 atoms:  N C HA CB
 &rst iat=368,381,371,372, &end
#
#  chirality for residue 26 atoms:  N C HA CB
 &rst iat=383,391,386,387, &end
#
#  chirality for residue 27 atoms:  CA CG1 CG2 HB
 &rst iat=395,399,403,398, &end
#
#  chirality for residue 27 atoms:  N C HA CB
 &rst iat=393,407,396,397, &end
#
#  chirality for residue 28 atoms:  CA CG HB2 HB3
 &rst iat=411,416,414,415, &end
#
#  chirality for residue 28 atoms:  N C HA CB
 &rst iat=409,427,412,413, &end
#
#  chirality for residue 29 atoms:  N C HA2 HA3
 &rst iat=429,434,432,433, &end
#
#  chirality for residue 30 atoms:  CA CG HB2 HB3
 &rst iat=438,443,441,442, &end
#
#  chirality for residue 30 atoms:  CB CD HG2 HG3
 &rst iat=440,446,444,445, &end
#
#  chirality for residue 30 atoms:  CD NZ HE2 HE3
 &rst iat=446,452,450,451, &end
#
#  chirality for residue 30 atoms:  CG CE HD2 HD3
 &rst iat=443,449,447,448, &end
#
#  chirality for residue 30 atoms:  N C HA CB
 &rst iat=436,456,439,440, &end
#
#  chirality for residue 31 atoms:  CA CG HB2 HB3
 &rst iat=460,465,463,464, &end
#
#  chirality for residue 31 atoms:  N C HA CB
 &rst iat=458,477,461,462, &end
#
#  chirality for residue 32 atoms:  N C HA2 HA3
 &rst iat=479,484,482,483, &end
#
#  chirality for residue 33 atoms:  CA CG HB2 HB3
 &rst iat=488,493,491,492, &end
#
#  chirality for residue 33 atoms:  CB CD HG2 HG3
 &rst iat=490,496,494,495, &end
#
#  chirality for residue 33 atoms:  CG NE HD2 HD3
 &rst iat=493,499,497,498, &end
#
#  chirality for residue 33 atoms:  N C HA CB
 &rst iat=486,508,489,490, &end
#
#  chirality for residue 34 atoms:  CA CG2 CG1 HB
 &rst iat=512,516,520,515, &end
#
#  chirality for residue 34 atoms:  CB CD1 HG12 HG13
 &rst iat=514,523,521,522, &end
#
#  chirality for residue 34 atoms:  N C HA CB
 &rst iat=510,527,513,514, &end
#
#  chirality for residue 35 atoms:  CA CG1 CG2 HB
 &rst iat=531,535,539,534, &end
#
#  chirality for residue 35 atoms:  N C HA CB
 &rst iat=529,543,532,533, &end
#
#  chirality for residue 36 atoms:  CA CG HB2 HB3
 &rst iat=547,552,550,551, &end
#
#  chirality for residue 36 atoms:  CB CD HG2 HG3
 &rst iat=549,555,553,554, &end
#
#  chirality for residue 36 atoms:  N C HA CB
 &rst iat=545,558,548,549, &end
#
#  chirality for residue 37 atoms:  CA CG1 CG2 HB
 &rst iat=562,566,570,565, &end
#
#  chirality for residue 37 atoms:  N C HA CB
 &rst iat=560,574,563,564, &end
#
#  chirality for residue 38 atoms:  CA CG HB2 HB3
 &rst iat=578,583,581,582, &end
#
#  chirality for residue 38 atoms:  CB CD1 CD2 HG
 &rst iat=580,585,589,584, &end
#
#  chirality for residue 38 atoms:  N C HA CB
 &rst iat=576,593,579,580, &end
#
#  chirality for residue 39 atoms:  CA CG HB2 HB3
 &rst iat=597,602,600,601, &end
#
#  chirality for residue 39 atoms:  CB CD1 CD2 HG
 &rst iat=599,604,608,603, &end
#
#  chirality for residue 39 atoms:  N C HA CB
 &rst iat=595,612,598,599, &end
#
#  chirality for residue 40 atoms:  CA CG HB2 HB3
 &rst iat=616,621,619,620, &end
#
#  chirality for residue 40 atoms:  CB SD HG2 HG3
 &rst iat=618,624,622,623, &end
#
#  chirality for residue 40 atoms:  N C HA CB
 &rst iat=614,629,617,618, &end
#
#  chirality for residue 41 atoms:  CA CG HB2 HB3
 &rst iat=633,638,636,637, &end
#
#  chirality for residue 41 atoms:  CB CD HG2 HG3
 &rst iat=635,641,639,640, &end
#
#  chirality for residue 41 atoms:  CD NZ HE2 HE3
 &rst iat=641,647,645,646, &end
#
#  chirality for residue 41 atoms:  CG CE HD2 HD3
 &rst iat=638,644,642,643, &end
#
#  chirality for residue 41 atoms:  N C HA CB
 &rst iat=631,651,634,635, &end
#
#  chirality for residue 42 atoms:  CA CG HB2 HB3
 &rst iat=655,660,658,659, &end
#
#  chirality for residue 42 atoms:  N C HA CB
 &rst iat=653,663,656,657, &end
#
#  chirality for residue 43 atoms:  CA CG HB2 HB3
 &rst iat=667,672,670,671, &end
#
#  chirality for residue 43 atoms:  CB CD HG2 HG3
 &rst iat=669,675,673,674, &end
#
#  chirality for residue 43 atoms:  CG NE HD2 HD3
 &rst iat=672,678,676,677, &end
#
#  chirality for residue 43 atoms:  N C HA CB
 &rst iat=665,687,668,669, &end
#
#  chirality for residue 44 atoms:  CA CG HB2 HB3
 &rst iat=691,696,694,695, &end
#
#  chirality for residue 44 atoms:  CB CD HG2 HG3
 &rst iat=693,699,697,698, &end
#
#  chirality for residue 44 atoms:  N C HA CB
 &rst iat=689,702,692,693, &end
#
#  chirality for residue 45 atoms:  CA CG2 OG1 HB
 &rst iat=706,710,714,709, &end
#
#  chirality for residue 45 atoms:  N C HA CB
 &rst iat=704,716,707,708, &end
#
#  chirality for residue 46 atoms:  CA CG HB2 HB3
 &rst iat=720,725,723,724, &end
#
#  chirality for residue 46 atoms:  N C HA CB
 &rst iat=718,730,721,722, &end
#
#  chirality for residue 47 atoms:  CA CG HB2 HB3
 &rst iat=734,739,737,738, &end
#
#  chirality for residue 47 atoms:  CB CD HG2 HG3
 &rst iat=736,742,740,741, &end
#
#  chirality for residue 47 atoms:  CD NZ HE2 HE3
 &rst iat=742,748,746,747, &end
#
#  chirality for residue 47 atoms:  CG CE HD2 HD3
 &rst iat=739,745,743,744, &end
#
#  chirality for residue 47 atoms:  N C HA CB
 &rst iat=732,752,735,736, &end
#
#  chirality for residue 48 atoms:  CA OG HB2 HB3
 &rst iat=756,761,759,760, &end
#
#  chirality for residue 48 atoms:  N C HA CB
 &rst iat=754,763,757,758, &end
#
#  chirality for residue 49 atoms:  CA CG HB2 HB3
 &rst iat=767,772,770,771, &end
#
#  chirality for residue 49 atoms:  CB CD HG2 HG3
 &rst iat=769,775,773,774, &end
#
#  chirality for residue 49 atoms:  CG NE HD2 HD3
 &rst iat=772,778,776,777, &end
#
#  chirality for residue 49 atoms:  N C HA CB
 &rst iat=765,787,768,769, &end
#
#  chirality for residue 50 atoms:  N C HA2 HA3
 &rst iat=789,794,792,793, &end
#
#  chirality for residue 51 atoms:  CA CG HB2 HB3
 &rst iat=798,803,801,802, &end
#
#  chirality for residue 51 atoms:  N C HA CB
 &rst iat=796,814,799,800, &end
#
#  chirality for residue 52 atoms:  N C HA CB
 &rst iat=816,824,819,820, &end
#
#  chirality for residue 53 atoms:  CA CG HB2 HB3
 &rst iat=828,833,831,832, &end
#
#  chirality for residue 53 atoms:  N C HA CB
 &rst iat=826,844,829,830, &end
#
#  chirality for residue 54 atoms:  CA CG1 CG2 HB
 &rst iat=848,852,856,851, &end
#
#  chirality for residue 54 atoms:  N C HA CB
 &rst iat=846,860,849,850, &end
#
#  chirality for residue 55 atoms:  CA CG2 OG1 HB
 &rst iat=864,868,872,867, &end
#
#  chirality for residue 55 atoms:  N C HA CB
 &rst iat=862,874,865,866, &end
#
#  chirality for residue 56 atoms:  CA CG HB2 HB3
 &rst iat=878,883,881,882, &end
#
#  chirality for residue 56 atoms:  N C HA CB
 &rst iat=876,894,879,880, &end
#
#  chirality for residue 57 atoms:  CA CG HB2 HB3
 &rst iat=898,903,901,902, &end
#
#  chirality for residue 57 atoms:  CB CD HG2 HG3
 &rst iat=900,906,904,905, &end
#
#  chirality for residue 57 atoms:  N C HA CB
 &rst iat=896,909,899,900, &end
#
#  chirality for residue 58 atoms:  CA OG HB2 HB3
 &rst iat=913,918,916,917, &end
#
#  chirality for residue 58 atoms:  N C HA CB
 &rst iat=911,920,914,915, &end
#
#  chirality for residue 59 atoms:  CA CG HB2 HB3
 &rst iat=932,926,930,931, &end
#
#  chirality for residue 59 atoms:  CB CD HG2 HG3
 &rst iat=929,923,927,928, &end
#
#  chirality for residue 59 atoms:  CG N HD2 HD3
 &rst iat=926,922,924,925, &end
#
#  chirality for residue 59 atoms:  N C HA CB
 &rst iat=922,934,933,929, &end
#
#  chirality for residue 60 atoms:  N C HA CB
 &rst iat=936,944,939,940, &end
#
#  chirality for residue 61 atoms:  CA CG HB2 HB3
 &rst iat=948,953,951,952, &end
#
#  chirality for residue 61 atoms:  N C HA CB
 &rst iat=946,956,949,950, &end
#
#  chirality for residue 62 atoms:  N C HA CB
 &rst iat=958,966,961,962, &end
#
#  chirality for residue 63 atoms:  CA CG HB2 HB3
 &rst iat=970,975,973,974, &end
#
#  chirality for residue 63 atoms:  CB CD HG2 HG3
 &rst iat=972,978,976,977, &end
#
#  chirality for residue 63 atoms:  CD NZ HE2 HE3
 &rst iat=978,984,982,983, &end
#
#  chirality for residue 63 atoms:  CG CE HD2 HD3
 &rst iat=975,981,979,980, &end
#
#  chirality for residue 63 atoms:  N C HA CB
 &rst iat=968,988,971,972, &end
#
#  chirality for residue 64 atoms:  CA CG HB2 HB3
 &rst iat=992,997,995,996, &end
#
#  chirality for residue 64 atoms:  N C HA CB
 &rst iat=990,1000,993,994, &end
#
#  chirality for residue 65 atoms:  N C HA CB
 &rst iat=1002,1010,1005,1006, &end
#
#  chirality for residue 66 atoms:  N C HA CB
 &rst iat=1012,1020,1015,1016, &end
#
#  chirality for residue 67 atoms:  CA CG HB2 HB3
 &rst iat=1024,1029,1027,1028, &end
#
#  chirality for residue 67 atoms:  CB CD HG2 HG3
 &rst iat=1026,1032,1030,1031, &end
#
#  chirality for residue 67 atoms:  CG NE HD2 HD3
 &rst iat=1029,1035,1033,1034, &end
#
#  chirality for residue 67 atoms:  N C HA CB
 &rst iat=1022,1044,1025,1026, &end
#
#  chirality for residue 68 atoms:  CA CG HB2 HB3
 &rst iat=1048,1053,1051,1052, &end
#
#  chirality for residue 68 atoms:  N C HA CB
 &rst iat=1046,1056,1049,1050, &end
#
#  chirality for residue 69 atoms:  CA CG HB2 HB3
 &rst iat=1060,1065,1063,1064, &end
#
#  chirality for residue 69 atoms:  CB SD HG2 HG3
 &rst iat=1062,1068,1066,1067, &end
#
#  chirality for residue 69 atoms:  N C HA CB
 &rst iat=1058,1073,1061,1062, &end
#
#  chirality for residue 70 atoms:  CA CG HB2 HB3
 &rst iat=1077,1082,1080,1081, &end
#
#  chirality for residue 70 atoms:  N C HA CB
 &rst iat=1075,1087,1078,1079, &end
#
#  chirality for residue 71 atoms:  N C HA2 HA3
 &rst iat=1089,1094,1092,1093, &end
#
#  chirality for residue 72 atoms:  CA CG HB2 HB3
 &rst iat=1098,1103,1101,1102, &end
#
#  chirality for residue 72 atoms:  CB CD HG2 HG3
 &rst iat=1100,1106,1104,1105, &end
#
#  chirality for residue 72 atoms:  CD NZ HE2 HE3
 &rst iat=1106,1112,1110,1111, &end
#
#  chirality for residue 72 atoms:  CG CE HD2 HD3
 &rst iat=1103,1109,1107,1108, &end
#
#  chirality for residue 72 atoms:  N C HA CB
 &rst iat=1096,1116,1099,1100, &end
#
#  chirality for residue 73 atoms:  CA OG HB2 HB3
 &rst iat=1120,1125,1123,1124, &end
#
#  chirality for residue 73 atoms:  N C HA CB
 &rst iat=1118,1127,1121,1122, &end
#
#  chirality for residue 74 atoms:  CA CG HB2 HB3
 &rst iat=1131,1136,1134,1135, &end
#
#  chirality for residue 74 atoms:  CB CD1 CD2 HG
 &rst iat=1133,1138,1142,1137, &end
#
#  chirality for residue 74 atoms:  N C HA CB
 &rst iat=1129,1146,1132,1133, &end
#
#  chirality for residue 75 atoms:  CA CG HB2 HB3
 &rst iat=1150,1155,1153,1154, &end
#
#  chirality for residue 75 atoms:  N C HA CB
 &rst iat=1148,1158,1151,1152, &end
#
#  chirality for residue 76 atoms:  N C HA2 HA3
 &rst iat=1160,1165,1163,1164, &end
#
#  chirality for residue 77 atoms:  CA CG HB2 HB3
 &rst iat=1169,1174,1172,1173, &end
#
#  chirality for residue 77 atoms:  CB CD HG2 HG3
 &rst iat=1171,1177,1175,1176, &end
#
#  chirality for residue 77 atoms:  CD NZ HE2 HE3
 &rst iat=1177,1183,1181,1182, &end
#
#  chirality for residue 77 atoms:  CG CE HD2 HD3
 &rst iat=1174,1180,1178,1179, &end
#
#  chirality for residue 77 atoms:  N C HA CB
 &rst iat=1167,1187,1170,1171, &end
#
#  chirality for residue 78 atoms:  N C HA CB
 &rst iat=1189,1197,1192,1193, &end
#
#  chirality for residue 79 atoms:  CA CG2 CG1 HB
 &rst iat=1201,1205,1209,1204, &end
#
#  chirality for residue 79 atoms:  CB CD1 HG12 HG13
 &rst iat=1203,1212,1210,1211, &end
#
#  chirality for residue 79 atoms:  N C HA CB
 &rst iat=1199,1216,1202,1203, &end
#
#  chirality for residue 80 atoms:  CA CG HB2 HB3
 &rst iat=1220,1225,1223,1224, &end
#
#  chirality for residue 80 atoms:  CB CD HG2 HG3
 &rst iat=1222,1228,1226,1227, &end
#
#  chirality for residue 80 atoms:  CD NZ HE2 HE3
 &rst iat=1228,1234,1232,1233, &end
#
#  chirality for residue 80 atoms:  CG CE HD2 HD3
 &rst iat=1225,1231,1229,1230, &end
#
#  chirality for residue 80 atoms:  N C HA CB
 &rst iat=1218,1238,1221,1222, &end
#
#  chirality for residue 81 atoms:  CA CG1 CG2 HB
 &rst iat=1242,1246,1250,1245, &end
#
#  chirality for residue 81 atoms:  N C HA CB
 &rst iat=1240,1254,1243,1244, &end
#
#  chirality for residue 82 atoms:  CA CG HB2 HB3
 &rst iat=1258,1263,1261,1262, &end
#
#  chirality for residue 82 atoms:  CB CD HG2 HG3
 &rst iat=1260,1266,1264,1265, &end
#
#  chirality for residue 82 atoms:  N C HA CB
 &rst iat=1256,1269,1259,1260, &end
#
#  chirality for residue 83 atoms:  CA CG HB2 HB3
 &rst iat=1273,1278,1276,1277, &end
#
#  chirality for residue 83 atoms:  CB CD HG2 HG3
 &rst iat=1275,1281,1279,1280, &end
#
#  chirality for residue 83 atoms:  N C HA CB
 &rst iat=1271,1286,1274,1275, &end
#
#  chirality for residue 84 atoms:  N C HA CB
 &rst iat=1288,1296,1291,1292, &end
#
#  chirality for residue 85 atoms:  CA CG2 OG1 HB
 &rst iat=1300,1304,1308,1303, &end
#
#  chirality for residue 85 atoms:  N C HA CB
 &rst iat=1298,1310,1301,1302, &end
#
#  chirality for residue 86 atoms:  CA CG HB2 HB3
 &rst iat=1314,1319,1317,1318, &end
#
#  chirality for residue 86 atoms:  CB CD HG2 HG3
 &rst iat=1316,1322,1320,1321, &end
#
#  chirality for residue 86 atoms:  CD NZ HE2 HE3
 &rst iat=1322,1328,1326,1327, &end
#
#  chirality for residue 86 atoms:  CG CE HD2 HD3
 &rst iat=1319,1325,1323,1324, &end
#
#  chirality for residue 86 atoms:  N C HA CB
 &rst iat=1312,1332,1315,1316, &end
#
#  chirality for residue 87 atoms:  CA CG HB2 HB3
 &rst iat=1344,1338,1342,1343, &end
#
#  chirality for residue 87 atoms:  CB CD HG2 HG3
 &rst iat=1341,1335,1339,1340, &end
#
#  chirality for residue 87 atoms:  CG N HD2 HD3
 &rst iat=1338,1334,1336,1337, &end
#
#  chirality for residue 87 atoms:  N C HA CB
 &rst iat=1334,1346,1345,1341, &end
#
#  chirality for residue 88 atoms:  CA OG HB2 HB3
 &rst iat=1350,1355,1353,1354, &end
#
#  chirality for residue 88 atoms:  N C HA CB
 &rst iat=1348,1357,1351,1352, &end
#
#  chirality for residue 89 atoms:  CA CG HB2 HB3
 &rst iat=1361,1366,1364,1365, &end
#
#  chirality for residue 89 atoms:  N C HA CB
 &rst iat=1359,1377,1362,1363, &end
#
#  chirality for residue 90 atoms:  CA CG HB2 HB3
 &rst iat=1381,1386,1384,1385, &end
#
#  chirality for residue 90 atoms:  CB CD HG2 HG3
 &rst iat=1383,1389,1387,1388, &end
#
#  chirality for residue 90 atoms:  N C HA CB
 &rst iat=1379,1392,1382,1383, &end
#
#  chirality for residue 91 atoms:  CA OG HB2 HB3
 &rst iat=1396,1401,1399,1400, &end
#
#  chirality for residue 91 atoms:  N C HA CB
 &rst iat=1394,1403,1397,1398, &end
#
#  chirality for residue 92 atoms:  N C HA2 HA3
 &rst iat=1405,1410,1408,1409, &end
#
#  chirality for residue 93 atoms:  CA CG HB2 HB3
 &rst iat=1414,1419,1417,1418, &end
#
#  chirality for residue 93 atoms:  CB CD HG2 HG3
 &rst iat=1416,1422,1420,1421, &end
#
#  chirality for residue 93 atoms:  CG NE HD2 HD3
 &rst iat=1419,1425,1423,1424, &end
#
#  chirality for residue 93 atoms:  N C HA CB
 &rst iat=1412,1434,1415,1416, &end
#
#  chirality for residue 94 atoms:  CA CG HB2 HB3
 &rst iat=1438,1443,1441,1442, &end
#
#  chirality for residue 94 atoms:  CB CD HG2 HG3
 &rst iat=1440,1446,1444,1445, &end
#
#  chirality for residue 94 atoms:  CG NE HD2 HD3
 &rst iat=1443,1449,1447,1448, &end
#
#  chirality for residue 94 atoms:  N C HA CB
 &rst iat=1436,1458,1439,1440, &end
#
#  chirality for residue 95 atoms:  N C HA2 HA3
 &rst iat=1460,1465,1463,1464, &end
#
#  chirality for residue 96 atoms:  C2' O4' N9 H1'
 &rst iat=1494,1475,1478,1477, &end
#
#  chirality for residue 96 atoms:  C3' C1' H2'1 O2'
 &rst iat=1492,1476,1495,1496, &end
#
#  chirality for residue 96 atoms:  O3' C2' C4' H3'
 &rst iat=1498,1494,1473,1493, &end
#
#  chirality for residue 96 atoms:  C3' C5' O4' H4'
 &rst iat=1492,1470,1475,1474, &end
#
#  chirality for residue 96 atoms:  C4' O5' H5'1 H5'2
 &rst iat=1473,1469,1471,1472, &end
#
#  chirality for residue 97 atoms:  C2' O4' N1 H1'
 &rst iat=1524,1508,1511,1510, &end
#
#  chirality for residue 97 atoms:  C3' C1' H2'1 O2'
 &rst iat=1522,1509,1525,1526, &end
#
#  chirality for residue 97 atoms:  O3' C2' C4' H3'
 &rst iat=1528,1524,1506,1523, &end
#
#  chirality for residue 97 atoms:  C3' C5' O4' H4'
 &rst iat=1522,1503,1508,1507, &end
#
#  chirality for residue 97 atoms:  C4' O5' H5'1 H5'2
 &rst iat=1506,1502,1504,1505, &end
#
#  chirality for residue 98 atoms:  C2' O4' N1 H1'
 &rst iat=1555,1538,1541,1540, &end
#
#  chirality for residue 98 atoms:  C3' C1' H2'1 O2'
 &rst iat=1553,1539,1556,1557, &end
#
#  chirality for residue 98 atoms:  O3' C2' C4' H3'
 &rst iat=1559,1555,1536,1554, &end
#
#  chirality for residue 98 atoms:  C3' C5' O4' H4'
 &rst iat=1553,1533,1538,1537, &end
#
#  chirality for residue 98 atoms:  C4' O5' H5'1 H5'2
 &rst iat=1536,1532,1534,1535, &end
#
#  chirality for residue 99 atoms:  C2' O4' N9 H1'
 &rst iat=1588,1569,1572,1571, &end
#
#  chirality for residue 99 atoms:  C3' C1' H2'1 O2'
 &rst iat=1586,1570,1589,1590, &end
#
#  chirality for residue 99 atoms:  O3' C2' C4' H3'
 &rst iat=1592,1588,1567,1587, &end
#
#  chirality for residue 99 atoms:  C3' C5' O4' H4'
 &rst iat=1586,1564,1569,1568, &end
#
#  chirality for residue 99 atoms:  C4' O5' H5'1 H5'2
 &rst iat=1567,1563,1565,1566, &end
#
#  chirality for residue 100 atoms:  C2' O4' N9 H1'
 &rst iat=1621,1602,1605,1604, &end
#
#  chirality for residue 100 atoms:  C3' C1' H2'1 O2'
 &rst iat=1619,1603,1622,1623, &end
#
#  chirality for residue 100 atoms:  O3' C2' C4' H3'
 &rst iat=1625,1621,1600,1620, &end
#
#  chirality for residue 100 atoms:  C3' C5' O4' H4'
 &rst iat=1619,1597,1602,1601, &end
#
#  chirality for residue 100 atoms:  C4' O5' H5'1 H5'2
 &rst iat=1600,1596,1598,1599, &end
#
#  chirality for residue 101 atoms:  C2' O4' N9 H1'
 &rst iat=1654,1635,1638,1637, &end
#
#  chirality for residue 101 atoms:  C3' C1' H2'1 O2'
 &rst iat=1652,1636,1655,1656, &end
#
#  chirality for residue 101 atoms:  O3' C2' C4' H3'
 &rst iat=1658,1654,1633,1653, &end
#
#  chirality for residue 101 atoms:  C3' C5' O4' H4'
 &rst iat=1652,1630,1635,1634, &end
#
#  chirality for residue 101 atoms:  C4' O5' H5'1 H5'2
 &rst iat=1633,1629,1631,1632, &end
#
#  trans-omega constraint for residue 2
 &rst iat=22,20,18,5, 
   r1=150., r2=170., r3=190., r4=210., rk2 = 200., rk3=200.,  &end
#
#  trans-omega constraint for residue 3
 &rst iat=38,36,34,22, &end
#
#  trans-omega constraint for residue 4
 &rst iat=53,51,49,38, &end
#
#  trans-omega constraint for residue 5
 &rst iat=63,61,59,53, &end
#
#  trans-omega constraint for residue 6
 &rst iat=75,73,71,63, &end
#
#  trans-omega constraint for residue 7
 &rst iat=107,97,95,75, &end
#
#  trans-omega constraint for residue 8
 &rst iat=113,111,109,107, &end
#
#  trans-omega constraint for residue 9
 &rst iat=120,118,116,113, &end
#
#  trans-omega constraint for residue 10
 &rst iat=142,140,138,120, &end
#
#  trans-omega constraint for residue 11
 &rst iat=161,159,157,142, &end
#
#  trans-omega constraint for residue 12
 &rst iat=181,179,177,161, &end
#
#  trans-omega constraint for residue 13
 &rst iat=200,198,196,181, &end
#
#  trans-omega constraint for residue 14
 &rst iat=207,205,203,200, &end
#
#  trans-omega constraint for residue 15
 &rst iat=214,212,210,207, &end
#
#  trans-omega constraint for residue 16
 &rst iat=233,231,229,214, &end
#
#  trans-omega constraint for residue 17
 &rst iat=247,245,243,233, &end
#
#  trans-omega constraint for residue 18
 &rst iat=261,259,257,247, &end
#
#  trans-omega constraint for residue 19
 &rst iat=276,274,272,261, &end
#
#  trans-omega constraint for residue 20
 &rst iat=290,288,286,276, &end
#
#  trans-omega constraint for residue 21
 &rst iat=304,302,300,290, &end
#
#  trans-omega constraint for residue 22
 &rst iat=319,317,315,304, &end
#
#  trans-omega constraint for residue 23
 &rst iat=341,339,337,319, &end
#
#  trans-omega constraint for residue 24
 &rst iat=351,349,347,341, &end
#
#  trans-omega constraint for residue 25
 &rst iat=370,368,366,351, &end
#
#  trans-omega constraint for residue 26
 &rst iat=385,383,381,370, &end
#
#  trans-omega constraint for residue 27
 &rst iat=395,393,391,385, &end
#
#  trans-omega constraint for residue 28
 &rst iat=411,409,407,395, &end
#
#  trans-omega constraint for residue 29
 &rst iat=431,429,427,411, &end
#
#  trans-omega constraint for residue 30
 &rst iat=438,436,434,431, &end
#
#  trans-omega constraint for residue 31
 &rst iat=460,458,456,438, &end
#
#  trans-omega constraint for residue 32
 &rst iat=481,479,477,460, &end
#
#  trans-omega constraint for residue 33
 &rst iat=488,486,484,481, &end
#
#  trans-omega constraint for residue 34
 &rst iat=512,510,508,488, &end
#
#  trans-omega constraint for residue 35
 &rst iat=531,529,527,512, &end
#
#  trans-omega constraint for residue 36
 &rst iat=547,545,543,531, &end
#
#  trans-omega constraint for residue 37
 &rst iat=562,560,558,547, &end
#
#  trans-omega constraint for residue 38
 &rst iat=578,576,574,562, &end
#
#  trans-omega constraint for residue 39
 &rst iat=597,595,593,578, &end
#
#  trans-omega constraint for residue 40
 &rst iat=616,614,612,597, &end
#
#  trans-omega constraint for residue 41
 &rst iat=633,631,629,616, &end
#
#  trans-omega constraint for residue 42
 &rst iat=655,653,651,633, &end
#
#  trans-omega constraint for residue 43
 &rst iat=667,665,663,655, &end
#
#  trans-omega constraint for residue 44
 &rst iat=691,689,687,667, &end
#
#  trans-omega constraint for residue 45
 &rst iat=706,704,702,691, &end
#
#  trans-omega constraint for residue 46
 &rst iat=720,718,716,706, &end
#
#  trans-omega constraint for residue 47
 &rst iat=734,732,730,720, &end
#
#  trans-omega constraint for residue 48
 &rst iat=756,754,752,734, &end
#
#  trans-omega constraint for residue 49
 &rst iat=767,765,763,756, &end
#
#  trans-omega constraint for residue 50
 &rst iat=791,789,787,767, &end
#
#  trans-omega constraint for residue 51
 &rst iat=798,796,794,791, &end
#
#  trans-omega constraint for residue 52
 &rst iat=818,816,814,798, &end
#
#  trans-omega constraint for residue 53
 &rst iat=828,826,824,818, &end
#
#  trans-omega constraint for residue 54
 &rst iat=848,846,844,828, &end
#
#  trans-omega constraint for residue 55
 &rst iat=864,862,860,848, &end
#
#  trans-omega constraint for residue 56
 &rst iat=878,876,874,864, &end
#
#  trans-omega constraint for residue 57
 &rst iat=898,896,894,878, &end
#
#  trans-omega constraint for residue 58
 &rst iat=913,911,909,898, &end
#
#  trans-omega constraint for residue 59
 &rst iat=932,922,920,913, &end
#
#  trans-omega constraint for residue 60
 &rst iat=938,936,934,932, &end
#
#  trans-omega constraint for residue 61
 &rst iat=948,946,944,938, &end
#
#  trans-omega constraint for residue 62
 &rst iat=960,958,956,948, &end
#
#  trans-omega constraint for residue 63
 &rst iat=970,968,966,960, &end
#
#  trans-omega constraint for residue 64
 &rst iat=992,990,988,970, &end
#
#  trans-omega constraint for residue 65
 &rst iat=1004,1002,1000,992, &end
#
#  trans-omega constraint for residue 66
 &rst iat=1014,1012,1010,1004, &end
#
#  trans-omega constraint for residue 67
 &rst iat=1024,1022,1020,1014, &end
#
#  trans-omega constraint for residue 68
 &rst iat=1048,1046,1044,1024, &end
#
#  trans-omega constraint for residue 69
 &rst iat=1060,1058,1056,1048, &end
#
#  trans-omega constraint for residue 70
 &rst iat=1077,1075,1073,1060, &end
#
#  trans-omega constraint for residue 71
 &rst iat=1091,1089,1087,1077, &end
#
#  trans-omega constraint for residue 72
 &rst iat=1098,1096,1094,1091, &end
#
#  trans-omega constraint for residue 73
 &rst iat=1120,1118,1116,1098, &end
#
#  trans-omega constraint for residue 74
 &rst iat=1131,1129,1127,1120, &end
#
#  trans-omega constraint for residue 75
 &rst iat=1150,1148,1146,1131, &end
#
#  trans-omega constraint for residue 76
 &rst iat=1162,1160,1158,1150, &end
#
#  trans-omega constraint for residue 77
 &rst iat=1169,1167,1165,1162, &end
#
#  trans-omega constraint for residue 78
 &rst iat=1191,1189,1187,1169, &end
#
#  trans-omega constraint for residue 79
 &rst iat=1201,1199,1197,1191, &end
#
#  trans-omega constraint for residue 80
 &rst iat=1220,1218,1216,1201, &end
#
#  trans-omega constraint for residue 81
 &rst iat=1242,1240,1238,1220, &end
#
#  trans-omega constraint for residue 82
 &rst iat=1258,1256,1254,1242, &end
#
#  trans-omega constraint for residue 83
 &rst iat=1273,1271,1269,1258, &end
#
#  trans-omega constraint for residue 84
 &rst iat=1290,1288,1286,1273, &end
#
#  trans-omega constraint for residue 85
 &rst iat=1300,1298,1296,1290, &end
#
#  trans-omega constraint for residue 86
 &rst iat=1314,1312,1310,1300, &end
#
#  trans-omega constraint for residue 87
 &rst iat=1344,1334,1332,1314, &end
#
#  trans-omega constraint for residue 88
 &rst iat=1350,1348,1346,1344, &end
#
#  trans-omega constraint for residue 89
 &rst iat=1361,1359,1357,1350, &end
#
#  trans-omega constraint for residue 90
 &rst iat=1381,1379,1377,1361, &end
#
#  trans-omega constraint for residue 91
 &rst iat=1396,1394,1392,1381, &end
#
#  trans-omega constraint for residue 92
 &rst iat=1407,1405,1403,1396, &end
#
#  trans-omega constraint for residue 93
 &rst iat=1414,1412,1410,1407, &end
#
#  trans-omega constraint for residue 94
 &rst iat=1438,1436,1434,1414, &end
#
#  trans-omega constraint for residue 95
 &rst iat=1462,1460,1458,1438, &end

  Entry H atom name         Submitted Coord H atom name
  Start of MODEL    1
    1    H1   MET   1           H1       MET   1  -3.260   4.898  -0.005
    2    H2   MET   1           H2       MET   1  -2.596   3.407  -0.209
    3    H3   MET   1           H3       MET   1  -4.131   3.695  -0.718
    4    HA   MET   1           HA       MET   1  -3.357   5.235  -2.383
    5    HB2  MET   1           HB2      MET   1  -1.361   5.965  -1.078
    6    HB3  MET   1           HB3      MET   1  -0.587   4.413  -1.446
    7    HG2  MET   1           HG2      MET   1   0.143   6.155  -3.014
    8    HG3  MET   1           HG3      MET   1  -0.759   4.900  -3.865
    9    HE1  MET   1           HE1      MET   1  -1.003   6.474  -5.984
   10    HE2  MET   1           HE2      MET   1  -1.588   8.153  -5.892
   11    HE3  MET   1           HE3      MET   1  -0.058   7.704  -5.110
   12    H    VAL   2           H        VAL   2  -4.168   4.078  -3.990
   13    HA   VAL   2           HA       VAL   2  -2.953   1.443  -4.583
   14    HB   VAL   2           HB       VAL   2  -5.333   1.381  -4.365
   15   HG11  VAL   2          1HG1      VAL   2  -5.535   3.467  -6.579
   16   HG12  VAL   2          HG21      VAL   2  -6.870   2.624  -5.778
   17   HG13  VAL   2          HG31      VAL   2  -5.876   3.768  -4.858
   18   HG21  VAL   2          HG32      VAL   2  -4.532   1.308  -7.295
   19   HG22  VAL   2          1HG2      VAL   2  -4.261   0.006  -6.107
   20   HG23  VAL   2          HG22      VAL   2  -5.917   0.470  -6.562
   21    H    GLU   3           H        GLU   3  -1.241   1.569  -5.808
   22    HA   GLU   3           HA       GLU   3  -1.228   3.462  -8.111
   23    HB2  GLU   3           HB2      GLU   3   1.140   3.964  -7.584
   24    HB3  GLU   3           HB3      GLU   3   0.005   4.534  -6.345
   25    HG2  GLU   3           HG2      GLU   3   0.512   2.414  -5.037
   26    HG3  GLU   3           HG3      GLU   3   1.783   2.066  -6.222
   27    H    ALA   4           H        ALA   4  -0.538   2.756  -9.940
   28    HA   ALA   4           HA       ALA   4   1.088   0.297 -10.088
   29    HB1  ALA   4           1HB      ALA   4  -1.496   0.802 -11.622
   30    HB2  ALA   4           HB2      ALA   4  -0.368  -0.547 -11.903
   31    HB3  ALA   4           HB3      ALA   4  -1.243  -0.422 -10.359
   32    H    ASP   5           H        ASP   5   2.805   0.859 -11.112
   33    HA   ASP   5           HA       ASP   5   3.080   3.357 -12.519
   34    HB2  ASP   5           HB2      ASP   5   4.785   2.407 -11.051
   35    HB3  ASP   5           HB3      ASP   5   4.984   1.028 -12.127
   36    H    ARG   6           H        ARG   6   1.406   2.867 -14.080
   37    HA   ARG   6           HA       ARG   6   0.577   2.512 -16.057
   38    HB2  ARG   6           HB2      ARG   6   1.999   3.066 -17.998
   39    HB3  ARG   6           HB3      ARG   6   1.990   4.208 -16.664
   40    HG2  ARG   6           HG2      ARG   6   4.199   4.106 -17.494
   41    HG3  ARG   6           HG3      ARG   6   4.201   3.349 -15.908
   42    HD2  ARG   6           2HD      ARG   6   5.604   2.098 -17.472
   43    HD3  ARG   6           3HD      ARG   6   4.235   1.103 -16.988
   44    HE   ARG   6           HE       ARG   6   3.446   1.121 -19.162
   45   HH11  ARG   6          1HH1      ARG   6   5.950   3.597 -18.844
   46   HH12  ARG   6          2HH1      ARG   6   6.021   3.907 -20.565
   47   HH21  ARG   6          1HH2      ARG   6   3.550   1.538 -21.376
   48   HH22  ARG   6          2HH2      ARG   6   4.655   2.740 -21.999
   49    HA   PRO   7           HA       PRO   7   0.242  -1.574 -17.467
   50    HB2  PRO   7           HB2      PRO   7  -0.019  -0.271 -20.172
   51    HB3  PRO   7           HB3      PRO   7  -1.058  -1.556 -19.470
   52    HG2  PRO   7           HG2      PRO   7  -1.894   0.979 -19.540
   53    HG3  PRO   7           HG3      PRO   7  -2.089   0.055 -18.006
   54    HD2  PRO   7           2HD      PRO   7   0.068   2.067 -18.737
   55    HD3  PRO   7           3HD      PRO   7  -0.847   1.899 -17.205
   56    H    GLY   8           H        GLY   8   1.584  -3.209 -18.304
   57    HA2  GLY   8           2HA      GLY   8   2.947  -4.033 -20.083
   58    HA3  GLY   8           3HA      GLY   8   3.624  -2.398 -20.308
   59    H    LYS   9           H        LYS   9   3.636  -2.319 -17.116
   60    HA   LYS   9           HA       LYS   9   6.302  -3.606 -17.020
   61    HB2  LYS   9           HB2      LYS   9   6.236  -1.227 -16.404
   62    HB3  LYS   9           HB3      LYS   9   5.095  -1.602 -15.094
   63    HG2  LYS   9           HG2      LYS   9   6.744  -3.194 -14.123
   64    HG3  LYS   9           HG3      LYS   9   7.876  -2.845 -15.434
   65    HD2  LYS   9           2HD      LYS   9   6.842  -0.764 -13.473
   66    HD3  LYS   9           3HD      LYS   9   8.370  -1.659 -13.291
   67    HE2  LYS   9           HE2      LYS   9   9.165  -0.783 -15.452
   68    HE3  LYS   9           HE3      LYS   9   7.653   0.117 -15.660
   69    HZ1  LYS   9           3HZ      LYS   9   9.529   0.516 -13.422
   70    HZ2  LYS   9           1HZ      LYS   9   9.458   1.461 -14.770
   71    HZ3  LYS   9           2HZ      LYS   9   8.181   1.398 -13.739
   72    H    LEU  10           H        LEU  10   6.633  -5.407 -15.880
   73    HA   LEU  10           HA       LEU  10   4.327  -6.422 -14.283
   74    HB2  LEU  10           HB2      LEU  10   6.491  -7.802 -15.877
   75    HB3  LEU  10           HB3      LEU  10   5.400  -8.691 -14.867
   76    HG   LEU  10           HG       LEU  10   4.624  -7.018 -17.301
   77   HD11  LEU  10          1HD1      LEU  10   4.404 -10.013 -16.742
   78   HD12  LEU  10          2HD1      LEU  10   4.211  -9.192 -18.305
   79   HD13  LEU  10          3HD1      LEU  10   5.817  -9.297 -17.524
   80   HD21  LEU  10          3HD2      LEU  10   2.374  -8.073 -16.997
   81   HD22  LEU  10          1HD2      LEU  10   2.891  -8.639 -15.397
   82   HD23  LEU  10          2HD2      LEU  10   2.782  -6.885 -15.745
   83    H    PHE  11           H        PHE  11   4.773  -7.587 -12.403
   84    HA   PHE  11           HA       PHE  11   7.444  -7.151 -11.150
   85    HB2  PHE  11           HB2      PHE  11   5.736  -6.117  -9.838
   86    HB3  PHE  11           HB3      PHE  11   4.637  -7.487 -10.048
   87    HD1  PHE  11           HD1      PHE  11   7.892  -6.500  -8.494
   88    HD2  PHE  11           HD2      PHE  11   4.629  -9.305  -8.542
   89    HE1  PHE  11           HE1      PHE  11   8.722  -7.519  -6.384
   90    HE2  PHE  11           HE2      PHE  11   5.484 -10.333  -6.445
   91    HZ   PHE  11           HZ       PHE  11   7.537  -9.423  -5.375
   92    H    ILE  12           H        ILE  12   8.642  -8.937 -10.764
   93    HA   ILE  12           HA       ILE  12   7.363 -11.580 -11.297
   94    HB   ILE  12           HB       ILE  12  10.259 -10.936 -11.853
   95   HG12  ILE  12          HG21      ILE  12   9.132  -9.298 -13.234
   96   HG13  ILE  12          HG31      ILE  12   9.800 -10.601 -14.207
   97   HG21  ILE  12          1HG2      ILE  12   8.264 -12.961 -12.932
   98   HG22  ILE  12          HG22      ILE  12   9.976 -12.854 -13.398
   99   HG23  ILE  12          HG32      ILE  12   9.526 -13.272 -11.720
  100   HD11  ILE  12          3HD1      ILE  12   7.493 -11.614 -14.343
  101   HD12  ILE  12          1HD1      ILE  12   6.872 -10.174 -13.509
  102   HD13  ILE  12          2HD1      ILE  12   7.661 -10.017 -15.097
  103    H    GLY  13           H        GLY  13   6.972 -11.757  -8.948
  104    HA2  GLY  13           2HA      GLY  13   9.408 -11.669  -7.257
  105    HA3  GLY  13           3HA      GLY  13   7.749 -11.729  -6.686
  106    H    GLY  14           H        GLY  14  10.247 -13.437  -6.131
  107    HA2  GLY  14           2HA      GLY  14   9.993 -15.546  -5.052
  108    HA3  GLY  14           3HA      GLY  14   8.761 -16.010  -6.246
  109    H    LEU  15           H        LEU  15  11.391 -14.378  -7.667
  110    HA   LEU  15           HA       LEU  15  12.114 -16.639  -9.263
  111    HB2  LEU  15           HB2      LEU  15  13.527 -13.988  -8.752
  112    HB3  LEU  15           HB3      LEU  15  13.907 -15.157 -10.054
  113    HG   LEU  15           HG       LEU  15  11.151 -13.937  -9.857
  114   HD11  LEU  15          1HD1      LEU  15  13.629 -12.904 -11.313
  115   HD12  LEU  15          2HD1      LEU  15  11.963 -12.325 -11.577
  116   HD13  LEU  15          3HD1      LEU  15  12.759 -12.073 -10.003
  117   HD21  LEU  15          3HD2      LEU  15  12.859 -15.035 -12.137
  118   HD22  LEU  15          1HD2      LEU  15  11.660 -15.995 -11.247
  119   HD23  LEU  15          2HD2      LEU  15  11.137 -14.598 -12.227
  120    H    ASN  16           H        ASN  16  14.306 -17.490  -9.544
  121    HA   ASN  16           HA       ASN  16  15.430 -18.435  -7.084
  122    HB2  ASN  16           HB2      ASN  16  15.179 -19.638  -9.247
  123    HB3  ASN  16           HB3      ASN  16  16.462 -18.588  -9.914
  124   HD21  ASN  16          2HD2      ASN  16  17.101 -20.949 -10.292
  125   HD22  ASN  16          1HD2      ASN  16  18.196 -21.607  -9.122
  126    H    THR  17           H        THR  17  17.735 -18.115  -6.480
  127    HA   THR  17           HA       THR  17  18.561 -15.347  -6.673
  128    HB   THR  17           HB       THR  17  20.419 -16.026  -5.292
  129    HG1  THR  17           1HG      THR  17  20.768 -18.236  -4.887
  130   HG21  THR  17          1HG2      THR  17  18.154 -15.920  -4.211
  131   HG22  THR  17          HG22      THR  17  17.995 -17.678  -4.477
  132   HG23  THR  17          HG32      THR  17  19.266 -17.049  -3.404
  133    H    GLU  18           H        GLU  18  18.826 -18.020  -8.703
  134    HA   GLU  18           HA       GLU  18  21.500 -17.364  -9.759
  135    HB2  GLU  18           HB2      GLU  18  19.701 -19.596 -10.672
  136    HB3  GLU  18           HB3      GLU  18  21.469 -19.536 -10.693
  137    HG2  GLU  18           HG2      GLU  18  19.695 -19.730  -8.214
  138    HG3  GLU  18           HG3      GLU  18  20.523 -21.073  -8.971
  139    H    THR  19           H        THR  19  18.238 -16.569 -10.320
  140    HA   THR  19           HA       THR  19  18.315 -16.449 -13.222
  141    HB   THR  19           HB       THR  19  16.452 -15.090 -11.231
  142    HG1  THR  19           1HG      THR  19  16.277 -17.588 -12.552
  143   HG21  THR  19          1HG2      THR  19  16.149 -15.783 -14.183
  144   HG22  THR  19          HG22      THR  19  14.849 -15.163 -13.142
  145   HG23  THR  19          HG32      THR  19  16.257 -14.148 -13.490
  146    H    ASN  20           H        ASN  20  18.643 -14.676 -14.526
  147    HA   ASN  20           HA       ASN  20  19.293 -12.107 -13.197
  148    HB2  ASN  20           HB2      ASN  20  20.831 -12.749 -15.628
  149    HB3  ASN  20           HB3      ASN  20  21.304 -11.812 -14.208
  150   HD21  ASN  20          2HD2      ASN  20  21.160 -14.966 -15.714
  151   HD22  ASN  20          1HD2      ASN  20  22.142 -15.807 -14.534
  152    H    GLU  21           H        GLU  21  19.866 -10.693 -15.467
  153    HA   GLU  21           HA       GLU  21  17.183 -10.082 -16.327
  154    HB2  GLU  21           HB2      GLU  21  19.913  -9.067 -17.184
  155    HB3  GLU  21           HB3      GLU  21  18.373  -8.367 -17.726
  156    HG2  GLU  21           HG2      GLU  21  17.745  -7.804 -15.453
  157    HG3  GLU  21           HG3      GLU  21  19.082  -8.749 -14.803
  158    H    LYS  22           H        LYS  22  19.948 -11.825 -17.818
  159    HA   LYS  22           HA       LYS  22  18.886 -11.759 -20.474
  160    HB2  LYS  22           HB2      LYS  22  21.232 -12.173 -19.985
  161    HB3  LYS  22           HB3      LYS  22  20.835 -13.652 -19.097
  162    HG2  LYS  22           HG2      LYS  22  21.680 -14.070 -21.411
  163    HG3  LYS  22           HG3      LYS  22  20.078 -14.756 -21.112
  164    HD2  LYS  22           2HD      LYS  22  19.010 -12.872 -22.264
  165    HD3  LYS  22           3HD      LYS  22  20.584 -12.082 -22.496
  166    HE2  LYS  22           HE2      LYS  22  19.783 -14.797 -23.616
  167    HE3  LYS  22           HE3      LYS  22  19.775 -13.280 -24.529
  168    HZ1  LYS  22           3HZ      LYS  22  21.787 -14.511 -24.911
  169    HZ2  LYS  22           1HZ      LYS  22  22.136 -13.098 -24.142
  170    HZ3  LYS  22           2HZ      LYS  22  22.149 -14.520 -23.314
  171    H    ALA  23           H        ALA  23  18.228 -13.795 -17.677
  172    HA   ALA  23           HA       ALA  23  16.929 -15.877 -19.301
  173    HB1  ALA  23           1HB      ALA  23  17.104 -15.436 -16.286
  174    HB2  ALA  23           HB2      ALA  23  16.463 -16.891 -17.092
  175    HB3  ALA  23           HB3      ALA  23  18.183 -16.460 -17.255
  176    H    LEU  24           H        LEU  24  16.218 -12.895 -17.736
  177    HA   LEU  24           HA       LEU  24  13.364 -13.370 -17.374
  178    HB2  LEU  24           HB2      LEU  24  15.569 -11.635 -16.492
  179    HB3  LEU  24           HB3      LEU  24  14.185 -10.646 -16.883
  180    HG   LEU  24           HG       LEU  24  14.000 -13.184 -15.229
  181   HD11  LEU  24          1HD1      LEU  24  15.647 -11.745 -14.122
  182   HD12  LEU  24          2HD1      LEU  24  14.524 -10.362 -14.199
  183   HD13  LEU  24          3HD1      LEU  24  14.132 -11.787 -13.196
  184   HD21  LEU  24          3HD2      LEU  24  11.970 -12.107 -14.303
  185   HD22  LEU  24          1HD2      LEU  24  12.320 -10.630 -15.234
  186   HD23  LEU  24          2HD2      LEU  24  11.889 -12.133 -16.086
  187    H    GLU  25           H        GLU  25  15.607 -11.794 -19.598
  188    HA   GLU  25           HA       GLU  25  13.466 -10.502 -21.081
  189    HB2  GLU  25           HB2      GLU  25  16.407 -11.094 -21.712
  190    HB3  GLU  25           HB3      GLU  25  15.326 -10.253 -22.840
  191    HG2  GLU  25           HG2      GLU  25  14.811  -8.609 -21.096
  192    HG3  GLU  25           HG3      GLU  25  16.019  -9.344 -20.030
  193    H    ALA  26           H        ALA  26  15.144 -13.523 -21.000
  194    HA   ALA  26           HA       ALA  26  14.492 -14.382 -23.703
  195    HB1  ALA  26           1HB      ALA  26  15.611 -15.811 -21.274
  196    HB2  ALA  26           HB2      ALA  26  15.558 -16.492 -22.923
  197    HB3  ALA  26           HB3      ALA  26  16.552 -15.051 -22.586
  198    H    VAL  27           H        VAL  27  12.993 -14.536 -20.543
  199    HA   VAL  27           HA       VAL  27  11.305 -16.829 -21.339
  200    HB   VAL  27           HB       VAL  27  12.674 -16.695 -19.282
  201   HG11  VAL  27          1HG1      VAL  27  10.449 -14.916 -18.281
  202   HG12  VAL  27          HG21      VAL  27  11.879 -15.480 -17.364
  203   HG13  VAL  27          HG31      VAL  27  12.095 -14.345 -18.716
  204   HG21  VAL  27          HG32      VAL  27   9.669 -17.050 -18.923
  205   HG22  VAL  27          1HG2      VAL  27  10.797 -18.290 -19.552
  206   HG23  VAL  27          HG22      VAL  27  10.940 -17.719 -17.863
  207    H    PHE  28           H        PHE  28  11.120 -13.431 -20.317
  208    HA   PHE  28           HA       PHE  28   8.184 -13.480 -20.691
  209    HB2  PHE  28           HB2      PHE  28  10.044 -11.304 -19.725
  210    HB3  PHE  28           HB3      PHE  28   8.305 -11.100 -19.996
  211    HD1  PHE  28           HD1      PHE  28   6.635 -12.353 -18.658
  212    HD2  PHE  28           HD2      PHE  28  10.833 -12.502 -17.780
  213    HE1  PHE  28           HE1      PHE  28   6.131 -13.307 -16.437
  214    HE2  PHE  28           HE2      PHE  28  10.343 -13.465 -15.555
  215    HZ   PHE  28           HZ       PHE  28   7.977 -13.859 -14.869
  216    H    GLY  29           H        GLY  29  10.962 -12.966 -22.597
  217    HA2  GLY  29           2HA      GLY  29   9.760 -11.036 -24.426
  218    HA3  GLY  29           3HA      GLY  29  11.227 -11.991 -24.712
  219    H    LYS  30           H        LYS  30   9.027 -14.171 -23.662
  220    HA   LYS  30           HA       LYS  30   8.518 -15.252 -26.310
  221    HB2  LYS  30           HB2      LYS  30   7.704 -16.163 -23.501
  222    HB3  LYS  30           HB3      LYS  30   7.662 -17.160 -24.975
  223    HG2  LYS  30           HG2      LYS  30  10.086 -16.964 -25.204
  224    HG3  LYS  30           HG3      LYS  30  10.175 -15.884 -23.810
  225    HD2  LYS  30           2HD      LYS  30  10.846 -18.201 -23.215
  226    HD3  LYS  30           3HD      LYS  30   9.485 -17.596 -22.274
  227    HE2  LYS  30           HE2      LYS  30   9.076 -19.891 -22.901
  228    HE3  LYS  30           HE3      LYS  30   7.910 -18.841 -23.716
  229    HZ1  LYS  30           3HZ      LYS  30   9.271 -18.985 -25.702
  230    HZ2  LYS  30           1HZ      LYS  30  10.356 -19.954 -24.935
  231    HZ3  LYS  30           2HZ      LYS  30   8.829 -20.487 -25.209
  232    H    TYR  31           H        TYR  31   6.972 -13.121 -24.225
  233    HA   TYR  31           HA       TYR  31   4.265 -13.755 -25.322
  234    HB2  TYR  31           HB2      TYR  31   5.124 -12.265 -22.830
  235    HB3  TYR  31           HB3      TYR  31   3.453 -12.567 -23.306
  236    HD1  TYR  31           HD2      TYR  31   2.801 -15.102 -23.558
  237    HD2  TYR  31           HD1      TYR  31   6.322 -13.727 -21.509
  238    HE1  TYR  31           HE2      TYR  31   2.996 -17.303 -22.431
  239    HE2  TYR  31           HE1      TYR  31   6.499 -15.919 -20.329
  240    HH   TYR  31           HH       TYR  31   5.681 -18.082 -20.206
  241    H    GLY  32           H        GLY  32   6.809 -11.328 -25.317
  242    HA2  GLY  32           2HA      GLY  32   5.462  -9.722 -27.252
  243    HA3  GLY  32           3HA      GLY  32   5.332  -8.969 -25.640
  244    H    ARG  33           H        ARG  33   6.588  -7.684 -27.737
  245    HA   ARG  33           HA       ARG  33   9.418  -8.103 -27.593
  246    HB2  ARG  33           HB2      ARG  33   7.872  -6.979 -29.424
  247    HB3  ARG  33           HB3      ARG  33   8.134  -5.506 -28.451
  248    HG2  ARG  33           HG2      ARG  33  10.586  -5.852 -28.648
  249    HG3  ARG  33           HG3      ARG  33  10.269  -7.363 -29.549
  250    HD2  ARG  33           2HD      ARG  33   9.042  -6.032 -31.272
  251    HD3  ARG  33           3HD      ARG  33   9.481  -4.548 -30.415
  252    HE   ARG  33           HE       ARG  33  11.254  -6.305 -32.004
  253   HH11  ARG  33          1HH1      ARG  33  11.005  -3.488 -29.860
  254   HH12  ARG  33          2HH1      ARG  33  12.577  -2.879 -30.300
  255   HH21  ARG  33          1HH2      ARG  33  13.289  -5.468 -32.553
  256   HH22  ARG  33          2HH2      ARG  33  13.866  -3.994 -31.815
  257    H    ILE  34           H        ILE  34  10.586  -7.671 -25.929
  258    HA   ILE  34           HA       ILE  34   9.675  -6.000 -23.731
  259    HB   ILE  34           HB       ILE  34  12.281  -7.442 -24.314
  260   HG12  ILE  34          HG21      ILE  34   9.855  -8.012 -22.564
  261   HG13  ILE  34          HG31      ILE  34  10.358  -8.902 -24.009
  262   HG21  ILE  34          1HG2      ILE  34  11.400  -6.095 -21.728
  263   HG22  ILE  34          HG22      ILE  34  12.894  -7.035 -21.985
  264   HG23  ILE  34          HG32      ILE  34  12.684  -5.499 -22.815
  265   HD11  ILE  34          3HD1      ILE  34  12.454  -9.576 -22.858
  266   HD12  ILE  34          1HD1      ILE  34  11.869  -8.786 -21.369
  267   HD13  ILE  34          2HD1      ILE  34  10.985 -10.164 -22.043
  268    H    VAL  35           H        VAL  35  10.295  -3.990 -23.126
  269    HA   VAL  35           HA       VAL  35  12.095  -2.513 -24.984
  270    HB   VAL  35           HB       VAL  35  10.677  -0.703 -23.302
  271   HG11  VAL  35          1HG1      VAL  35  10.396  -1.357 -26.257
  272   HG12  VAL  35          HG21      VAL  35   9.862   0.138 -25.455
  273   HG13  VAL  35          HG31      VAL  35  11.591  -0.256 -25.527
  274   HG21  VAL  35          HG32      VAL  35   8.796  -2.634 -24.726
  275   HG22  VAL  35          1HG2      VAL  35   8.900  -2.373 -22.968
  276   HG23  VAL  35          HG22      VAL  35   8.345  -1.071 -24.036
  277    H    GLU  36           H        GLU  36  11.560  -3.623 -21.722
  278    HA   GLU  36           HA       GLU  36  14.267  -2.845 -20.987
  279    HB2  GLU  36           HB2      GLU  36  13.013  -0.747 -20.537
  280    HB3  GLU  36           HB3      GLU  36  11.858  -1.646 -19.538
  281    HG2  GLU  36           HG2      GLU  36  13.621  -2.219 -17.943
  282    HG3  GLU  36           HG3      GLU  36  14.840  -1.479 -18.996
  283    H    VAL  37           H        VAL  37  15.023  -4.095 -19.230
  284    HA   VAL  37           HA       VAL  37  12.995  -5.626 -17.718
  285    HB   VAL  37           HB       VAL  37  15.221  -6.805 -19.341
  286   HG11  VAL  37          1HG1      VAL  37  16.009  -7.341 -17.070
  287   HG12  VAL  37          HG21      VAL  37  14.379  -7.938 -16.640
  288   HG13  VAL  37          HG31      VAL  37  15.349  -8.777 -17.865
  289   HG21  VAL  37          HG32      VAL  37  12.825  -7.101 -19.891
  290   HG22  VAL  37          1HG2      VAL  37  13.544  -8.658 -19.420
  291   HG23  VAL  37          HG22      VAL  37  12.531  -7.775 -18.266
  292    H    LEU  38           H        LEU  38  13.430  -5.951 -15.623
  293    HA   LEU  38           HA       LEU  38  15.957  -4.783 -14.479
  294    HB2  LEU  38           HB2      LEU  38  13.078  -4.567 -13.866
  295    HB3  LEU  38           HB3      LEU  38  14.118  -4.718 -12.466
  296    HG   LEU  38           HG       LEU  38  14.448  -2.583 -14.630
  297   HD11  LEU  38          1HD1      LEU  38  12.429  -2.266 -13.249
  298   HD12  LEU  38          2HD1      LEU  38  13.405  -2.445 -11.770
  299   HD13  LEU  38          3HD1      LEU  38  13.667  -1.054 -12.847
  300   HD21  LEU  38          3HD2      LEU  38  15.831  -2.996 -11.950
  301   HD22  LEU  38          1HD2      LEU  38  16.601  -3.104 -13.551
  302   HD23  LEU  38          2HD2      LEU  38  15.989  -1.543 -12.968
  303    H    LEU  39           H        LEU  39  16.834  -5.910 -12.748
  304    HA   LEU  39           HA       LEU  39  15.416  -8.238 -11.747
  305    HB2  LEU  39           HB2      LEU  39  16.742  -9.104 -13.648
  306    HB3  LEU  39           HB3      LEU  39  18.203  -8.354 -12.991
  307    HG   LEU  39           HG       LEU  39  17.867 -10.862 -12.765
  308   HD11  LEU  39          1HD1      LEU  39  18.497  -9.316 -10.228
  309   HD12  LEU  39          2HD1      LEU  39  19.021 -10.963 -10.614
  310   HD13  LEU  39          3HD1      LEU  39  19.617  -9.595 -11.593
  311   HD21  LEU  39          3HD2      LEU  39  16.162 -10.076 -10.382
  312   HD22  LEU  39          1HD2      LEU  39  15.565 -10.831 -11.892
  313   HD23  LEU  39          2HD2      LEU  39  16.706 -11.710 -10.855
  314    H    MET  40           H        MET  40  15.545  -7.983  -9.566
  315    HA   MET  40           HA       MET  40  17.393  -5.878  -8.665
  316    HB2  MET  40           HB2      MET  40  15.290  -7.301  -7.014
  317    HB3  MET  40           HB3      MET  40  16.044  -5.739  -6.702
  318    HG2  MET  40           HG2      MET  40  13.802  -6.506  -8.502
  319    HG3  MET  40           HG3      MET  40  14.026  -5.041  -7.563
  320    HE1  MET  40           HE3      MET  40  15.528  -2.878  -8.556
  321    HE2  MET  40           HE1      MET  40  16.853  -4.061  -8.587
  322    HE3  MET  40           HE2      MET  40  16.496  -3.088 -10.042
  323    H    LYS  41           H        LYS  41  19.044  -6.157  -7.110
  324    HA   LYS  41           HA       LYS  41  19.357  -8.857  -6.036
  325    HB2  LYS  41           HB2      LYS  41  21.940  -8.357  -6.976
  326    HB3  LYS  41           HB3      LYS  41  20.789  -9.581  -7.536
  327    HG2  LYS  41           HG2      LYS  41  19.967  -8.157  -9.264
  328    HG3  LYS  41           HG3      LYS  41  20.954  -6.774  -8.686
  329    HD2  LYS  41           2HD      LYS  41  23.002  -8.139  -9.107
  330    HD3  LYS  41           3HD      LYS  41  21.980  -9.441  -9.754
  331    HE2  LYS  41           HE2      LYS  41  21.145  -7.895 -11.511
  332    HE3  LYS  41           HE3      LYS  41  22.172  -6.609 -10.854
  333    HZ1  LYS  41           3HZ      LYS  41  23.221  -7.703 -12.705
  334    HZ2  LYS  41           1HZ      LYS  41  24.081  -8.001 -11.331
  335    HZ3  LYS  41           2HZ      LYS  41  23.119  -9.168 -11.970
  336    H    ASP  42           H        ASP  42  20.966  -9.159  -4.525
  337    HA   ASP  42           HA       ASP  42  21.292  -7.191  -2.555
  338    HB2  ASP  42           HB2      ASP  42  21.566  -9.768  -2.497
  339    HB3  ASP  42           HB3      ASP  42  23.190  -9.483  -3.120
  340    H    ARG  43           H        ARG  43  23.080  -5.853  -1.974
  341    HA   ARG  43           HA       ARG  43  24.603  -4.940  -4.322
  342    HB2  ARG  43           HB2      ARG  43  25.060  -2.960  -3.009
  343    HB3  ARG  43           HB3      ARG  43  23.322  -3.339  -2.969
  344    HG2  ARG  43           HG2      ARG  43  23.624  -4.391  -0.736
  345    HG3  ARG  43           HG3      ARG  43  25.353  -3.964  -0.790
  346    HD2  ARG  43           2HD      ARG  43  24.744  -1.567  -0.978
  347    HD3  ARG  43           3HD      ARG  43  23.030  -1.999  -0.913
  348    HE   ARG  43           HE       ARG  43  23.181  -2.389   1.372
  349   HH11  ARG  43          1HH1      ARG  43  26.423  -1.915   0.022
  350   HH12  ARG  43          2HH1      ARG  43  27.178  -1.780   1.593
  351   HH21  ARG  43          1HH2      ARG  43  24.204  -2.209   3.401
  352   HH22  ARG  43          2HH2      ARG  43  25.929  -1.953   3.496
  353    H    GLU  44           H        GLU  44  25.159  -7.189  -1.949
  354    HA   GLU  44           HA       GLU  44  28.104  -6.676  -1.987
  355    HB2  GLU  44           HB2      GLU  44  26.400  -8.117   0.074
  356    HB3  GLU  44           HB3      GLU  44  28.171  -7.987   0.109
  357    HG2  GLU  44           HG2      GLU  44  27.948  -5.492   0.166
  358    HG3  GLU  44           HG3      GLU  44  26.186  -5.680   0.256
  359    H    THR  45           H        THR  45  25.587  -8.822  -3.021
  360    HA   THR  45           HA       THR  45  27.695 -10.829  -3.702
  361    HB   THR  45           HB       THR  45  26.206 -12.636  -3.258
  362    HG1  THR  45           1HG      THR  45  24.053 -12.213  -2.598
  363   HG21  THR  45          1HG2      THR  45  25.769 -10.619  -1.029
  364   HG22  THR  45          HG22      THR  45  25.754 -12.398  -0.885
  365   HG23  THR  45          HG32      THR  45  27.273 -11.543  -1.268
  366    H    ASN  46           H        ASN  46  25.099  -8.810  -4.749
  367    HA   ASN  46           HA       ASN  46  24.238  -8.422  -6.784
  368    HB2  ASN  46           HB2      ASN  46  26.841  -8.398  -7.012
  369    HB3  ASN  46           HB3      ASN  46  26.597  -9.794  -8.067
  370   HD21  ASN  46          2HD2      ASN  46  25.645  -6.376  -7.551
  371   HD22  ASN  46          1HD2      ASN  46  25.297  -6.031  -9.229
  372    H    LYS  47           H        LYS  47  23.678 -11.072  -5.478
  373    HA   LYS  47           HA       LYS  47  23.229 -13.009  -7.596
  374    HB2  LYS  47           HB2      LYS  47  22.564 -12.731  -4.667
  375    HB3  LYS  47           HB3      LYS  47  21.720 -13.944  -5.623
  376    HG2  LYS  47           HG2      LYS  47  24.756 -13.748  -5.475
  377    HG3  LYS  47           HG3      LYS  47  23.760 -14.813  -4.460
  378    HD2  LYS  47           2HD      LYS  47  22.831 -15.869  -6.530
  379    HD3  LYS  47           3HD      LYS  47  23.956 -14.901  -7.503
  380    HE2  LYS  47           HE2      LYS  47  25.858 -15.902  -6.260
  381    HE3  LYS  47           HE3      LYS  47  24.719 -16.904  -5.338
  382    HZ1  LYS  47           3HZ      LYS  47  25.611 -18.117  -7.179
  383    HZ2  LYS  47           1HZ      LYS  47  24.003 -17.877  -7.419
  384    HZ3  LYS  47           2HZ      LYS  47  25.094 -16.983  -8.255
  385    H    SER  48           H        SER  48  20.711 -12.113  -5.465
  386    HA   SER  48           HA       SER  48  19.037 -10.685  -7.345
  387    HB2  SER  48           HB2      SER  48  18.841 -13.080  -8.175
  388    HB3  SER  48           HB3      SER  48  18.186 -13.494  -6.574
  389    HG   SER  48           HG       SER  48  16.579 -12.988  -8.173
  390    H    ARG  49           H        ARG  49  17.182  -9.852  -6.269
  391    HA   ARG  49           HA       ARG  49  17.118 -10.136  -3.323
  392    HB2  ARG  49           HB2      ARG  49  15.547  -8.414  -5.267
  393    HB3  ARG  49           HB3      ARG  49  15.384  -8.324  -3.502
  394    HG2  ARG  49           HG2      ARG  49  18.173  -8.066  -4.390
  395    HG3  ARG  49           HG3      ARG  49  17.132  -6.852  -5.138
  396    HD2  ARG  49           2HD      ARG  49  17.291  -7.350  -2.144
  397    HD3  ARG  49           3HD      ARG  49  18.207  -6.114  -3.038
  398    HE   ARG  49           HE       ARG  49  16.165  -4.986  -3.609
  399   HH11  ARG  49          1HH1      ARG  49  15.821  -7.459  -1.089
  400   HH12  ARG  49          2HH1      ARG  49  14.369  -6.740  -0.436
  401   HH21  ARG  49          1HH2      ARG  49  14.309  -4.078  -2.724
  402   HH22  ARG  49          2HH2      ARG  49  13.502  -4.831  -1.372
  403    H    GLY  50           H        GLY  50  15.992 -11.807  -5.943
  404    HA2  GLY  50           2HA      GLY  50  14.587 -13.643  -5.961
  405    HA3  GLY  50           3HA      GLY  50  13.884 -13.159  -4.409
  406    H    PHE  51           H        PHE  51  13.867 -10.386  -6.334
  407    HA   PHE  51           HA       PHE  51  11.495 -11.201  -7.895
  408    HB2  PHE  51           HB2      PHE  51  10.136  -9.412  -7.156
  409    HB3  PHE  51           HB3      PHE  51  10.633 -10.338  -5.745
  410    HD1  PHE  51           HD1      PHE  51  12.457  -9.403  -4.245
  411    HD2  PHE  51           HD2      PHE  51  10.618  -7.103  -7.377
  412    HE1  PHE  51           HE1      PHE  51  13.220  -7.298  -3.160
  413    HE2  PHE  51           HE2      PHE  51  11.326  -5.008  -6.258
  414    HZ   PHE  51           HZ       PHE  51  12.671  -5.101  -4.194
  415    H    ALA  52           H        ALA  52  10.884  -9.534  -9.508
  416    HA   ALA  52           HA       ALA  52  13.040  -7.703 -10.304
  417    HB1  ALA  52           1HB      ALA  52  13.401  -8.898 -12.446
  418    HB2  ALA  52           HB2      ALA  52  13.770  -9.959 -11.060
  419    HB3  ALA  52           HB3      ALA  52  12.242 -10.142 -11.962
  420    H    PHE  53           H        PHE  53  12.429  -7.028 -12.780
  421    HA   PHE  53           HA       PHE  53   9.510  -6.730 -13.032
  422    HB2  PHE  53           HB2      PHE  53  11.456  -4.383 -12.972
  423    HB3  PHE  53           HB3      PHE  53   9.771  -4.270 -13.402
  424    HD1  PHE  53           HD1      PHE  53  12.181  -5.019 -10.721
  425    HD2  PHE  53           HD2      PHE  53   8.091  -4.153 -11.669
  426    HE1  PHE  53           HE1      PHE  53  11.692  -4.722  -8.299
  427    HE2  PHE  53           HE2      PHE  53   7.584  -3.848  -9.254
  428    HZ   PHE  53           HZ       PHE  53   9.386  -4.151  -7.564
  429    H    VAL  54           H        VAL  54   8.896  -5.923 -15.201
  430    HA   VAL  54           HA       VAL  54  10.980  -5.833 -17.257
  431    HB   VAL  54           HB       VAL  54  10.626  -8.258 -17.113
  432   HG11  VAL  54          1HG1      VAL  54   7.727  -7.793 -17.435
  433   HG12  VAL  54          HG21      VAL  54   8.629  -9.351 -17.429
  434   HG13  VAL  54          HG31      VAL  54   8.638  -8.339 -15.966
  435   HG21  VAL  54          HG32      VAL  54   9.911  -8.721 -19.396
  436   HG22  VAL  54          1HG2      VAL  54   8.957  -7.228 -19.469
  437   HG23  VAL  54          HG22      VAL  54  10.728  -7.139 -19.445
  438    H    THR  55           H        THR  55  10.344  -4.627 -18.993
  439    HA   THR  55           HA       THR  55   7.520  -3.664 -18.949
  440    HB   THR  55           HB       THR  55   9.943  -2.199 -20.047
  441    HG1  THR  55           1HG      THR  55   9.983  -2.336 -17.794
  442   HG21  THR  55          1HG2      THR  55   7.025  -1.423 -19.566
  443   HG22  THR  55          HG22      THR  55   8.321  -0.295 -20.045
  444   HG23  THR  55          HG32      THR  55   7.814  -1.597 -21.139
  445    H    PHE  56           H        PHE  56   6.298  -4.336 -20.531
  446    HA   PHE  56           HA       PHE  56   7.448  -5.428 -23.011
  447    HB2  PHE  56           HB2      PHE  56   4.679  -5.306 -21.789
  448    HB3  PHE  56           HB3      PHE  56   4.992  -5.922 -23.412
  449    HD1  PHE  56           HD2      PHE  56   6.388  -6.468 -19.905
  450    HD2  PHE  56           HD1      PHE  56   5.181  -8.145 -23.684
  451    HE1  PHE  56           HE2      PHE  56   6.903  -8.738 -19.073
  452    HE2  PHE  56           HE1      PHE  56   5.616 -10.402 -22.826
  453    HZ   PHE  56           HZ       PHE  56   6.420 -10.723 -20.493
  454    H    GLU  57           H        GLU  57   6.753  -4.733 -25.144
  455    HA   GLU  57           HA       GLU  57   6.331  -1.894 -25.419
  456    HB2  GLU  57           HB2      GLU  57   6.519  -4.301 -27.247
  457    HB3  GLU  57           HB3      GLU  57   5.934  -2.744 -27.841
  458    HG2  GLU  57           HG2      GLU  57   8.023  -1.668 -26.891
  459    HG3  GLU  57           HG3      GLU  57   8.650  -3.306 -26.603
  460    H    SER  58           H        SER  58   4.190  -4.717 -25.153
  461    HA   SER  58           HA       SER  58   1.909  -2.842 -25.645
  462    HB2  SER  58           HB2      SER  58   1.949  -4.490 -27.401
  463    HB3  SER  58           HB3      SER  58   2.187  -5.803 -26.221
  464    HG   SER  58           HG       SER  58  -0.013  -5.539 -26.924
  465    HA   PRO  59           HA       PRO  59   1.044  -3.624 -21.426
  466    HB2  PRO  59           HB2      PRO  59  -1.526  -2.774 -21.255
  467    HB3  PRO  59           HB3      PRO  59  -0.195  -1.613 -21.623
  468    HG2  PRO  59           HG2      PRO  59  -2.004  -3.067 -23.575
  469    HG3  PRO  59           HG3      PRO  59  -1.730  -1.298 -23.462
  470    HD2  PRO  59           2HD      PRO  59  -0.296  -2.811 -25.209
  471    HD3  PRO  59           3HD      PRO  59   0.531  -1.535 -24.256
  472    H    ALA  60           H        ALA  60  -0.386  -5.319 -24.075
  473    HA   ALA  60           HA       ALA  60  -1.901  -7.064 -22.209
  474    HB1  ALA  60           1HB      ALA  60  -2.309  -6.585 -25.181
  475    HB2  ALA  60           HB2      ALA  60  -3.270  -7.676 -24.149
  476    HB3  ALA  60           HB3      ALA  60  -3.299  -5.921 -23.848
  477    H    ASP  61           H        ASP  61   0.850  -6.871 -24.336
  478    HA   ASP  61           HA       ASP  61   1.159  -9.742 -24.647
  479    HB2  ASP  61           HB2      ASP  61   3.128  -7.404 -24.659
  480    HB3  ASP  61           HB3      ASP  61   3.589  -9.038 -24.915
  481    H    ALA  62           H        ALA  62   1.744  -7.277 -22.204
  482    HA   ALA  62           HA       ALA  62   3.273  -8.979 -20.420
  483    HB1  ALA  62           1HB      ALA  62   1.751  -6.374 -20.000
  484    HB2  ALA  62           HB2      ALA  62   2.843  -7.131 -18.821
  485    HB3  ALA  62           HB3      ALA  62   3.482  -6.539 -20.382
  486    H    LYS  63           H        LYS  63  -0.180  -8.191 -20.950
  487    HA   LYS  63           HA       LYS  63  -1.145  -9.482 -18.552
  488    HB2  LYS  63           HB2      LYS  63  -2.416  -8.934 -21.264
  489    HB3  LYS  63           HB3      LYS  63  -3.291  -9.639 -19.900
  490    HG2  LYS  63           HG2      LYS  63  -2.897  -7.668 -18.526
  491    HG3  LYS  63           HG3      LYS  63  -1.864  -6.959 -19.776
  492    HD2  LYS  63           2HD      LYS  63  -4.098  -5.935 -19.815
  493    HD3  LYS  63           3HD      LYS  63  -3.783  -6.796 -21.322
  494    HE2  LYS  63           HE2      LYS  63  -5.064  -8.758 -20.473
  495    HE3  LYS  63           HE3      LYS  63  -5.369  -7.895 -18.956
  496    HZ1  LYS  63           3HZ      LYS  63  -6.267  -7.023 -21.622
  497    HZ2  LYS  63           1HZ      LYS  63  -7.213  -7.713 -20.466
  498    HZ3  LYS  63           2HZ      LYS  63  -6.548  -6.230 -20.210
  499    H    ASP  64           H        ASP  64  -0.367 -10.568 -21.871
  500    HA   ASP  64           HA       ASP  64  -1.555 -13.153 -21.540
  501    HB2  ASP  64           HB2      ASP  64  -0.960 -11.911 -23.692
  502    HB3  ASP  64           HB3      ASP  64   0.730 -12.301 -23.365
  503    H    ALA  65           H        ALA  65   1.656 -11.792 -20.884
  504    HA   ALA  65           HA       ALA  65   2.836 -14.358 -20.191
  505    HB1  ALA  65           1HB      ALA  65   4.139 -12.314 -20.889
  506    HB2  ALA  65           HB2      ALA  65   3.692 -11.564 -19.343
  507    HB3  ALA  65           HB3      ALA  65   4.679 -13.048 -19.361
  508    H    ALA  66           H        ALA  66   1.347 -11.614 -18.383
  509    HA   ALA  66           HA       ALA  66   1.850 -12.812 -15.829
  510    HB1  ALA  66           1HB      ALA  66  -0.130 -10.629 -16.658
  511    HB2  ALA  66           HB2      ALA  66   0.451 -10.939 -15.005
  512    HB3  ALA  66           HB3      ALA  66   1.567 -10.346 -16.260
  513    H    ARG  67           H        ARG  67  -0.325 -13.612 -18.257
  514    HA   ARG  67           HA       ARG  67  -2.181 -14.973 -16.371
  515    HB2  ARG  67           HB2      ARG  67  -2.336 -14.278 -19.316
  516    HB3  ARG  67           HB3      ARG  67  -3.510 -15.335 -18.513
  517    HG2  ARG  67           HG2      ARG  67  -4.196 -13.604 -16.999
  518    HG3  ARG  67           HG3      ARG  67  -2.871 -12.541 -17.484
  519    HD2  ARG  67           2HD      ARG  67  -4.937 -11.795 -18.497
  520    HD3  ARG  67           3HD      ARG  67  -3.843 -12.347 -19.755
  521    HE   ARG  67           HE       ARG  67  -6.275 -13.777 -18.768
  522   HH11  ARG  67          1HH1      ARG  67  -3.699 -13.468 -21.179
  523   HH12  ARG  67          2HH1      ARG  67  -4.454 -14.588 -22.288
  524   HH21  ARG  67          1HH2      ARG  67  -7.216 -15.237 -20.229
  525   HH22  ARG  67          2HH2      ARG  67  -6.433 -15.592 -21.752
  526    H    ASP  68           H        ASP  68   0.770 -15.742 -17.682
  527    HA   ASP  68           HA       ASP  68  -0.055 -18.546 -18.301
  528    HB2  ASP  68           HB2      ASP  68   1.556 -16.472 -19.735
  529    HB3  ASP  68           HB3      ASP  68   2.335 -18.001 -19.557
  530    H    MET  69           H        MET  69   2.579 -16.308 -17.536
  531    HA   MET  69           HA       MET  69   4.278 -18.332 -16.352
  532    HB2  MET  69           HB2      MET  69   4.335 -15.477 -17.255
  533    HB3  MET  69           HB3      MET  69   5.407 -15.874 -15.949
  534    HG2  MET  69           HG2      MET  69   5.169 -17.256 -18.658
  535    HG3  MET  69           HG3      MET  69   6.454 -16.133 -18.188
  536    HE1  MET  69           HE3      MET  69   8.100 -16.558 -16.305
  537    HE2  MET  69           HE1      MET  69   6.891 -17.199 -15.159
  538    HE3  MET  69           HE2      MET  69   8.397 -18.103 -15.462
  539    H    ASN  70           H        ASN  70   1.693 -16.390 -15.162
  540    HA   ASN  70           HA       ASN  70   2.844 -15.868 -12.552
  541    HB2  ASN  70           HB2      ASN  70   1.027 -14.493 -13.551
  542    HB3  ASN  70           HB3      ASN  70  -0.055 -15.889 -13.480
  543   HD21  ASN  70          2HD2      ASN  70  -1.405 -14.403 -12.161
  544   HD22  ASN  70          1HD2      ASN  70  -1.060 -14.260 -10.446
  545    H    GLY  71           H        GLY  71   3.098 -17.275 -10.942
  546    HA2  GLY  71           2HA      GLY  71   2.487 -18.961  -9.447
  547    HA3  GLY  71           3HA      GLY  71   1.205 -19.490 -10.551
  548    H    LYS  72           H        LYS  72   3.755 -19.198 -12.631
  549    HA   LYS  72           HA       LYS  72   4.540 -22.002 -12.549
  550    HB2  LYS  72           HB2      LYS  72   5.480 -19.665 -14.219
  551    HB3  LYS  72           HB3      LYS  72   5.672 -21.386 -14.562
  552    HG2  LYS  72           HG2      LYS  72   3.020 -19.895 -14.512
  553    HG3  LYS  72           HG3      LYS  72   3.882 -20.481 -15.947
  554    HD2  LYS  72           2HD      LYS  72   3.660 -22.815 -15.126
  555    HD3  LYS  72           3HD      LYS  72   2.736 -22.222 -13.719
  556    HE2  LYS  72           HE2      LYS  72   1.054 -21.241 -15.247
  557    HE3  LYS  72           HE3      LYS  72   1.965 -21.842 -16.641
  558    HZ1  LYS  72           3HZ      LYS  72   0.762 -23.519 -14.538
  559    HZ2  LYS  72           1HZ      LYS  72   0.169 -23.309 -16.059
  560    HZ3  LYS  72           2HZ      LYS  72   1.607 -24.074 -15.837
  561    H    SER  73           H        SER  73   7.155 -21.350 -13.570
  562    HA   SER  73           HA       SER  73   8.623 -20.485 -11.117
  563    HB2  SER  73           HB2      SER  73   8.033 -22.910 -11.041
  564    HB3  SER  73           HB3      SER  73   8.911 -23.154 -12.563
  565    HG   SER  73           HG       SER  73  10.191 -23.620 -10.713
  566    H    LEU  74           H        LEU  74  10.782 -20.198 -11.307
  567    HA   LEU  74           HA       LEU  74  11.876 -19.913 -14.045
  568    HB2  LEU  74           HB2      LEU  74  11.136 -17.682 -12.409
  569    HB3  LEU  74           HB3      LEU  74  12.815 -17.901 -12.119
  570    HG   LEU  74           HG       LEU  74  12.581 -16.355 -13.909
  571   HD11  LEU  74          1HD1      LEU  74  13.790 -17.352 -15.768
  572   HD12  LEU  74          2HD1      LEU  74  14.467 -17.913 -14.223
  573   HD13  LEU  74          3HD1      LEU  74  13.413 -18.981 -15.200
  574   HD21  LEU  74          3HD2      LEU  74  11.376 -16.891 -15.978
  575   HD22  LEU  74          1HD2      LEU  74  11.049 -18.540 -15.386
  576   HD23  LEU  74          2HD2      LEU  74  10.285 -17.138 -14.591
  577    H    ASP  75           H        ASP  75  13.834 -20.839 -14.165
  578    HA   ASP  75           HA       ASP  75  15.626 -22.018 -13.519
  579    HB2  ASP  75           HB2      ASP  75  15.983 -19.416 -12.752
  580    HB3  ASP  75           HB3      ASP  75  15.915 -20.080 -11.210
  581    H    GLY  76           H        GLY  76  13.013 -22.655 -12.188
  582    HA2  GLY  76           2HA      GLY  76  12.733 -24.725 -11.152
  583    HA3  GLY  76           3HA      GLY  76  14.233 -24.504 -10.230
  584    H    LYS  77           H        LYS  77  12.723 -21.548 -10.000
  585    HA   LYS  77           HA       LYS  77  11.504 -22.311  -7.389
  586    HB2  LYS  77           HB2      LYS  77  12.848 -19.685  -8.094
  587    HB3  LYS  77           HB3      LYS  77  12.261 -20.201  -6.503
  588    HG2  LYS  77           HG2      LYS  77  14.506 -21.481  -8.110
  589    HG3  LYS  77           HG3      LYS  77  14.716 -20.458  -6.683
  590    HD2  LYS  77           2HD      LYS  77  13.718 -22.100  -5.239
  591    HD3  LYS  77           3HD      LYS  77  13.161 -23.088  -6.601
  592    HE2  LYS  77           HE2      LYS  77  15.443 -23.525  -7.309
  593    HE3  LYS  77           HE3      LYS  77  16.078 -22.514  -5.995
  594    HZ1  LYS  77           3HZ      LYS  77  14.496 -24.978  -5.658
  595    HZ2  LYS  77           1HZ      LYS  77  16.118 -24.843  -5.432
  596    HZ3  LYS  77           2HZ      LYS  77  15.087 -24.047  -4.434
  597    H    ALA  78           H        ALA  78   9.471 -21.731  -6.980
  598    HA   ALA  78           HA       ALA  78   7.883 -20.947  -9.236
  599    HB1  ALA  78           1HB      ALA  78   7.096 -21.259  -6.317
  600    HB2  ALA  78           HB2      ALA  78   5.987 -21.170  -7.704
  601    HB3  ALA  78           HB3      ALA  78   7.099 -22.546  -7.552
  602    H    ILE  79           H        ILE  79   6.776 -19.101  -9.701
  603    HA   ILE  79           HA       ILE  79   7.517 -16.698  -8.095
  604    HB   ILE  79           HB       ILE  79   7.849 -15.461 -10.097
  605   HG12  ILE  79          HG21      ILE  79   7.070 -17.920 -11.726
  606   HG13  ILE  79          HG31      ILE  79   6.002 -16.539 -11.417
  607   HG21  ILE  79          1HG2      ILE  79   9.738 -16.896  -9.347
  608   HG22  ILE  79          HG22      ILE  79   9.210 -18.151 -10.497
  609   HG23  ILE  79          HG32      ILE  79   9.747 -16.575 -11.102
  610   HD11  ILE  79          3HD1      ILE  79   6.962 -16.137 -13.537
  611   HD12  ILE  79          1HD1      ILE  79   7.779 -15.040 -12.413
  612   HD13  ILE  79          2HD1      ILE  79   8.609 -16.516 -12.968
  613    H    LYS  80           H        LYS  80   6.349 -14.749  -8.764
  614    HA   LYS  80           HA       LYS  80   3.471 -15.170  -9.392
  615    HB2  LYS  80           HB2      LYS  80   4.003 -14.329  -7.063
  616    HB3  LYS  80           HB3      LYS  80   4.808 -12.943  -7.800
  617    HG2  LYS  80           HG2      LYS  80   2.619 -12.389  -8.980
  618    HG3  LYS  80           HG3      LYS  80   1.851 -13.654  -7.995
  619    HD2  LYS  80           2HD      LYS  80   2.581 -12.450  -5.937
  620    HD3  LYS  80           3HD      LYS  80   3.351 -11.211  -6.957
  621    HE2  LYS  80           HE2      LYS  80   1.149 -10.710  -7.984
  622    HE3  LYS  80           HE3      LYS  80   0.382 -11.889  -6.910
  623    HZ1  LYS  80           3HZ      LYS  80   1.057 -10.570  -5.045
  624    HZ2  LYS  80           1HZ      LYS  80   1.876  -9.512  -6.008
  625    HZ3  LYS  80           2HZ      LYS  80   0.245  -9.608  -6.112
  626    H    VAL  81           H        VAL  81   2.649 -13.810 -11.042
  627    HA   VAL  81           HA       VAL  81   4.470 -11.694 -12.058
  628    HB   VAL  81           HB       VAL  81   2.966 -13.643 -13.843
  629   HG11  VAL  81          1HG1      VAL  81   4.133 -12.441 -15.656
  630   HG12  VAL  81          HG21      VAL  81   3.107 -11.327 -14.725
  631   HG13  VAL  81          HG31      VAL  81   4.865 -11.338 -14.465
  632   HG21  VAL  81          HG32      VAL  81   4.957 -14.698 -12.868
  633   HG22  VAL  81          1HG2      VAL  81   5.259 -14.301 -14.569
  634   HG23  VAL  81          HG22      VAL  81   5.942 -13.279 -13.287
  635    H    GLU  82           H        GLU  82   3.484  -9.796 -12.254
  636    HA   GLU  82           HA       GLU  82   0.583  -9.557 -12.626
  637    HB2  GLU  82           HB2      GLU  82   0.934 -10.161 -10.181
  638    HB3  GLU  82           HB3      GLU  82   1.894  -8.689 -10.008
  639    HG2  GLU  82           HG2      GLU  82  -0.052  -7.306 -10.528
  640    HG3  GLU  82           HG3      GLU  82  -0.995  -8.741 -10.969
  641    H    GLN  83           H        GLN  83  -0.014  -7.151 -12.743
  642    HA   GLN  83           HA       GLN  83   2.028  -5.581 -13.993
  643    HB2  GLN  83           HB2      GLN  83  -0.249  -5.056 -14.476
  644    HB3  GLN  83           HB3      GLN  83  -0.676  -4.997 -12.759
  645    HG2  GLN  83           HG2      GLN  83  -0.657  -2.770 -13.619
  646    HG3  GLN  83           HG3      GLN  83   0.651  -2.953 -12.451
  647   HE21  GLN  83          HE22      GLN  83   2.149  -1.527 -13.070
  648   HE22  GLN  83          HE12      GLN  83   2.808  -1.374 -14.679
  649    H    ALA  84           H        ALA  84   3.426  -4.049 -13.157
  650    HA   ALA  84           HA       ALA  84   4.232  -4.597 -10.439
  651    HB1  ALA  84           1HB      ALA  84   5.283  -2.607 -12.479
  652    HB2  ALA  84           HB2      ALA  84   6.100  -3.088 -10.975
  653    HB3  ALA  84           HB3      ALA  84   5.845  -4.284 -12.267
  654    H    THR  85           H        THR  85   4.505  -3.181  -8.735
  655    HA   THR  85           HA       THR  85   2.947  -0.637  -8.850
  656    HB   THR  85           HB       THR  85   2.825  -0.771  -6.422
  657    HG1  THR  85           1HG      THR  85   3.966  -3.346  -6.738
  658   HG21  THR  85          1HG2      THR  85   1.017  -1.786  -7.835
  659   HG22  THR  85          HG22      THR  85   1.840  -3.355  -7.729
  660   HG23  THR  85          HG32      THR  85   1.185  -2.600  -6.259
  661    H    LYS  86           H        LYS  86   3.903   0.810  -6.942
  662    HA   LYS  86           HA       LYS  86   6.606   1.443  -7.862
  663    HB2  LYS  86           HB2      LYS  86   4.690   2.887  -5.989
  664    HB3  LYS  86           HB3      LYS  86   6.196   3.546  -6.659
  665    HG2  LYS  86           HG2      LYS  86   5.273   2.999  -8.979
  666    HG3  LYS  86           HG3      LYS  86   3.722   2.647  -8.193
  667    HD2  LYS  86           2HD      LYS  86   3.732   4.993  -7.278
  668    HD3  LYS  86           3HD      LYS  86   5.188   5.308  -8.255
  669    HE2  LYS  86           HE2      LYS  86   3.888   4.492 -10.277
  670    HE3  LYS  86           HE3      LYS  86   2.448   4.419  -9.250
  671    HZ1  LYS  86           3HZ      LYS  86   4.026   6.845  -9.807
  672    HZ2  LYS  86           1HZ      LYS  86   2.553   6.493 -10.445
  673    HZ3  LYS  86           2HZ      LYS  86   2.706   6.775  -8.834
  674    HA   PRO  87           HA       PRO  87   8.845  -0.291  -4.549
  675    HB2  PRO  87           HB2      PRO  87  10.923   1.447  -4.167
  676    HB3  PRO  87           HB3      PRO  87  10.743   0.509  -5.674
  677    HG2  PRO  87           HG2      PRO  87   9.815   3.352  -5.189
  678    HG3  PRO  87           HG3      PRO  87  10.826   2.734  -6.537
  679    HD2  PRO  87           2HD      PRO  87   8.157   3.034  -6.831
  680    HD3  PRO  87           3HD      PRO  87   8.973   1.588  -7.503
  681    H    SER  88           H        SER  88   9.594  -0.010  -2.280
  682    HA   SER  88           HA       SER  88   7.962   2.056  -0.922
  683    HB2  SER  88           HB2      SER  88   6.785  -0.152  -1.082
  684    HB3  SER  88           HB3      SER  88   8.094  -0.873  -0.121
  685    HG   SER  88           HG       SER  88   7.577   0.664   1.515
  686    H    PHE  89           H        PHE  89  11.058   1.253  -1.367
  687    HA   PHE  89           HA       PHE  89  11.918   1.170   1.425
  688    HB2  PHE  89           HB2      PHE  89  14.160   1.261   0.521
  689    HB3  PHE  89           HB3      PHE  89  13.199  -0.006  -0.265
  690    HD1  PHE  89           HD1      PHE  89  14.860   3.256  -0.679
  691    HD2  PHE  89           HD2      PHE  89  12.568   0.185  -2.600
  692    HE1  PHE  89           HE1      PHE  89  15.452   4.214  -2.899
  693    HE2  PHE  89           HE2      PHE  89  13.149   1.148  -4.831
  694    HZ   PHE  89           HZ       PHE  89  14.576   3.155  -4.973
  695    H    GLU  90           H        GLU  90  10.549   3.615  -0.287
  696    HA   GLU  90           HA       GLU  90  12.023   5.676   1.237
  697    HB2  GLU  90           HB2      GLU  90  12.995   5.339  -1.133
  698    HB3  GLU  90           HB3      GLU  90  11.457   5.985  -1.730
  699    HG2  GLU  90           HG2      GLU  90  11.853   8.061  -0.403
  700    HG3  GLU  90           HG3      GLU  90  13.359   7.360   0.215
  701    H    SER  91           H        SER  91  10.881   7.706   1.356
  702    HA   SER  91           HA       SER  91   7.952   7.547   0.894
  703    HB2  SER  91           HB2      SER  91   9.416   7.841   3.531
  704    HB3  SER  91           HB3      SER  91   7.705   8.307   3.316
  705    HG   SER  91           HG       SER  91   7.935   6.159   4.079
  706    H    GLY  92           H        GLY  92   6.898   9.652   1.469
  707    HA2  GLY  92           2HA      GLY  92   8.251  11.865   0.274
  708    HA3  GLY  92           3HA      GLY  92   6.726  11.927   1.168
  709    H    ARG  93           H        ARG  93   8.799  13.894   1.278
  710    HA   ARG  93           HA       ARG  93   9.386  13.879   4.162
  711    HB2  ARG  93           HB2      ARG  93  11.703  14.250   3.954
  712    HB3  ARG  93           HB3      ARG  93  11.347  12.820   2.992
  713    HG2  ARG  93           HG2      ARG  93  11.847  15.647   1.960
  714    HG3  ARG  93           HG3      ARG  93  12.959  14.283   1.876
  715    HD2  ARG  93           2HD      ARG  93  10.307  14.532   0.405
  716    HD3  ARG  93           3HD      ARG  93  11.924  14.664  -0.286
  717    HE   ARG  93           HE       ARG  93  10.928  12.146   0.999
  718   HH11  ARG  93          1HH1      ARG  93  12.577  13.788  -1.671
  719   HH12  ARG  93          2HH1      ARG  93  12.939  12.292  -2.506
  720   HH21  ARG  93          1HH2      ARG  93  11.363  10.251  -0.129
  721   HH22  ARG  93          2HH2      ARG  93  12.265  10.282  -1.624
  722    H    ARG  94           H        ARG  94  10.127  15.962   4.944
  723    HA   ARG  94           HA       ARG  94   9.716  18.159   5.296
  724    HB2  ARG  94           HB2      ARG  94  10.297  18.350   2.322
  725    HB3  ARG  94           HB3      ARG  94  10.274  19.708   3.463
  726    HG2  ARG  94           HG2      ARG  94  12.065  18.631   4.795
  727    HG3  ARG  94           HG3      ARG  94  12.137  17.302   3.620
  728    HD2  ARG  94           2HD      ARG  94  12.657  20.242   3.010
  729    HD3  ARG  94           3HD      ARG  94  13.897  19.000   3.228
  730    HE   ARG  94           HE       ARG  94  13.191  17.923   1.198
  731   HH11  ARG  94          1HH1      ARG  94  11.674  21.072   1.767
  732   HH12  ARG  94          2HH1      ARG  94  11.217  21.277   0.091
  733   HH21  ARG  94          1HH2      ARG  94  12.590  18.231  -0.977
  734   HH22  ARG  94          2HH2      ARG  94  11.732  19.676  -1.452
  735    H    GLY  95           H        GLY  95   8.464  20.202   4.354
  736    HA2  GLY  95           2HA      GLY  95   6.428  21.164   3.891
  737    HA3  GLY  95           3HA      GLY  95   5.984  19.703   2.991
  738    H5'    A  96           H5'        A  96   8.133 -17.080   0.561
  739   H5''    A  96          H5''        A  96   6.490 -16.618   1.026
  740    H4'    A  96           H4'        A  96   7.722 -19.408   1.352
  741    H3'    A  96           H3'        A  96   6.272 -18.068  -0.856
  742    H2'    A  96           H2'        A  96   4.352 -19.414  -0.905
  743   HO2'    A  96          HO2'        A  96   5.606 -21.409  -0.731
  744    H1'    A  96           H1'        A  96   3.890 -19.763   1.713
  745    H8     A  96           H8         A  96   5.007 -16.492   2.420
  746    H61    A  96           H61        A  96   0.343 -14.054  -0.857
  747    H62    A  96           H62        A  96   1.549 -13.737   0.375
  748    H2     A  96           H2         A  96   0.789 -18.302  -2.054
  749   HO5'    A  96          H5T         A  96   8.081 -16.126   2.633
  750    H5'    U  97           H5'        U  97   6.078 -18.927  -3.155
  751   H5''    U  97          H5''        U  97   7.289 -19.129  -4.431
  752    H4'    U  97           H4'        U  97   7.391 -16.562  -4.527
  753    H3'    U  97           H3'        U  97   5.474 -16.734  -2.417
  754    H2'    U  97           H2'        U  97   3.418 -16.570  -3.435
  755   HO2'    U  97          HO2'        U  97   4.254 -14.388  -4.165
  756    H1'    U  97           H1'        U  97   3.844 -17.068  -6.101
  757    H3     U  97           H3         U  97   2.806 -21.466  -6.220
  758    H5     U  97           H5         U  97   3.223 -20.593  -2.139
  759    H6     U  97           H6         U  97   4.127 -18.415  -2.753
  760    H5'    C  98           H5'        C  98   6.912 -12.181  -3.912
  761   H5''    C  98          H5''        C  98   8.499 -12.182  -3.122
  762    H4'    C  98           H4'        C  98   7.967  -9.993  -2.888
  763    H3'    C  98           H3'        C  98   7.848 -11.353  -0.491
  764    H2'    C  98           H2'        C  98   5.529 -11.765  -0.528
  765   HO2'    C  98          HO2'        C  98   5.956 -10.520   1.376
  766    H1'    C  98           H1'        C  98   4.872  -9.000  -1.490
  767    H41    C  98           H41        C  98  -0.509 -12.165  -2.723
  768    H42    C  98           H42        C  98   0.368 -13.609  -3.198
  769    H5     C  98           H5         C  98   2.800 -13.747  -3.140
  770    H6     C  98           H6         C  98   4.853 -12.488  -2.652
  771    H5'    A  99           H5'        A  99   9.261  -6.110  -0.979
  772   H5''    A  99          H5''        A  99   7.699  -6.651  -1.640
  773    H4'    A  99           H4'        A  99  10.103  -5.933  -3.369
  774    H3'    A  99           H3'        A  99   8.578  -4.110  -1.809
  775    H2'    A  99           H2'        A  99   6.617  -4.365  -3.137
  776   HO2'    A  99          HO2'        A  99   7.288  -2.175  -3.443
  777    H1'    A  99           H1'        A  99   8.521  -4.710  -5.464
  778    H8     A  99           H8         A  99   6.790  -3.853  -7.132
  779    H61    A  99           H61        A  99   1.698  -7.396  -7.285
  780    H62    A  99           H62        A  99   2.583  -6.126  -8.096
  781    H2     A  99           H2         A  99   4.079  -8.518  -3.687
  782    H5'    A 100           H5'        A 100  12.449  -1.268  -4.200
  783   H5''    A 100          H5''        A 100  11.297  -2.373  -4.975
  784    H4'    A 100           H4'        A 100  13.860  -3.638  -5.152
  785    H3'    A 100           H3'        A 100  14.505  -1.035  -4.852
  786    H2'    A 100           H2'        A 100  12.590  -0.306  -6.091
  787   HO2'    A 100          HO2'        A 100  13.464   0.625  -8.044
  788    H1'    A 100           H1'        A 100  13.338  -2.041  -8.423
  789    H8     A 100           H8         A 100  10.121  -1.713  -6.213
  790    H61    A 100           H61        A 100   7.446   0.297 -11.434
  791    H62    A 100           H62        A 100   7.165  -0.185  -9.767
  792    H2     A 100           H2         A 100  11.757  -0.338 -12.256
  793    H5'    A 101           H5'        A 101  16.362   0.432  -6.006
  794   H5''    A 101          H5''        A 101  17.872  -0.202  -6.668
  795    H4'    A 101           H4'        A 101  18.158   2.052  -5.733
  796    H3'    A 101           H3'        A 101  19.879  -0.067  -5.401
  797   HO3'    A 101          H3T         A 101  21.297   1.622  -4.578
  798    H2'    A 101           H2'        A 101  19.138  -0.718  -3.282
  799   HO2'    A 101          HO2'        A 101  20.605   0.145  -1.733
  800    H1'    A 101           H1'        A 101  18.871   2.158  -2.390
  801    H8     A 101           H8         A 101  17.260  -1.356  -2.529
  802    H61    A 101           H61        A 101  15.518  -0.203   3.329
  803    H62    A 101           H62        A 101  15.526  -1.407   2.049
  804    H2     A 101           H2         A 101  17.405   3.456   1.697
  Start of MODEL    2
    1    H1   MET   1           H1       MET   1  -3.355   4.429  -1.703
    2    H2   MET   1           H2       MET   1  -2.108   4.202  -0.656
    3    H3   MET   1           H3       MET   1  -3.381   3.158  -0.655
    4    HA   MET   1           HA       MET   1  -1.468   3.520  -2.858
    5    HB2  MET   1           HB2      MET   1  -0.638   2.363  -0.749
    6    HB3  MET   1           HB3      MET   1  -1.815   1.082  -1.076
    7    HG2  MET   1           HG2      MET   1   0.379   2.032  -2.963
    8    HG3  MET   1           HG3      MET   1   0.471   0.597  -1.940
    9    HE1  MET   1           HE1      MET   1   1.036   0.807  -5.066
   10    HE2  MET   1           HE2      MET   1   1.254  -0.714  -4.164
   11    HE3  MET   1           HE3      MET   1   0.294  -0.691  -5.668
   12    H    VAL   2           H        VAL   2  -2.774   3.642  -4.551
   13    HA   VAL   2           HA       VAL   2  -4.253   1.190  -5.252
   14    HB   VAL   2           HB       VAL   2  -5.952   2.831  -4.686
   15   HG11  VAL   2          1HG1      VAL   2  -4.441   4.759  -6.501
   16   HG12  VAL   2          HG21      VAL   2  -6.023   5.071  -5.764
   17   HG13  VAL   2          HG31      VAL   2  -4.592   4.879  -4.731
   18   HG21  VAL   2          HG32      VAL   2  -7.144   3.069  -6.743
   19   HG22  VAL   2          1HG2      VAL   2  -5.648   3.054  -7.693
   20   HG23  VAL   2          HG22      VAL   2  -6.202   1.561  -6.884
   21    H    GLU   3           H        GLU   3  -1.539   2.498  -5.537
   22    HA   GLU   3           HA       GLU   3  -1.448   3.639  -8.157
   23    HB2  GLU   3           HB2      GLU   3   0.721   2.819  -6.168
   24    HB3  GLU   3           HB3      GLU   3   1.015   3.787  -7.617
   25    HG2  GLU   3           HG2      GLU   3  -0.867   4.555  -5.353
   26    HG3  GLU   3           HG3      GLU   3   0.787   5.158  -5.567
   27    H    ALA   4           H        ALA   4  -0.613   2.991  -9.985
   28    HA   ALA   4           HA       ALA   4   0.751   0.406 -10.296
   29    HB1  ALA   4           1HB      ALA   4  -1.809   1.183 -11.772
   30    HB2  ALA   4           HB2      ALA   4  -0.788  -0.230 -12.141
   31    HB3  ALA   4           HB3      ALA   4  -1.645  -0.129 -10.583
   32    H    ASP   5           H        ASP   5   2.580   1.224 -11.109
   33    HA   ASP   5           HA       ASP   5   2.898   3.835 -11.948
   34    HB2  ASP   5           HB2      ASP   5   4.685   2.489 -11.072
   35    HB3  ASP   5           HB3      ASP   5   4.607   1.397 -12.449
   36    H    ARG   6           H        ARG   6   3.385   1.144 -14.337
   37    HA   ARG   6           HA       ARG   6   1.831   2.735 -16.287
   38    HB2  ARG   6           HB2      ARG   6   4.739   1.928 -16.715
   39    HB3  ARG   6           HB3      ARG   6   3.648   2.523 -17.978
   40    HG2  ARG   6           HG2      ARG   6   3.387   4.663 -16.719
   41    HG3  ARG   6           HG3      ARG   6   4.532   4.068 -15.501
   42    HD2  ARG   6           2HD      ARG   6   5.710   5.498 -17.060
   43    HD3  ARG   6           3HD      ARG   6   6.264   3.828 -17.264
   44    HE   ARG   6           HE       ARG   6   4.113   4.352 -19.078
   45   HH11  ARG   6          1HH1      ARG   6   7.524   5.151 -18.554
   46   HH12  ARG   6          2HH1      ARG   6   7.838   5.416 -20.251
   47   HH21  ARG   6          1HH2      ARG   6   4.559   4.718 -21.285
   48   HH22  ARG   6          2HH2      ARG   6   6.167   5.186 -21.786
   49    HA   PRO   7           HA       PRO   7   0.505  -1.378 -17.418
   50    HB2  PRO   7           HB2      PRO   7   0.356  -0.037 -20.113
   51    HB3  PRO   7           HB3      PRO   7  -0.867  -1.112 -19.345
   52    HG2  PRO   7           HG2      PRO   7  -1.217   1.538 -19.413
   53    HG3  PRO   7           HG3      PRO   7  -1.532   0.657 -17.871
   54    HD2  PRO   7           2HD      PRO   7   0.915   2.267 -18.658
   55    HD3  PRO   7           3HD      PRO   7   0.049   2.228 -17.092
   56    H    GLY   8           H        GLY   8   1.599  -3.194 -18.278
   57    HA2  GLY   8           2HA      GLY   8   2.939  -4.259 -19.907
   58    HA3  GLY   8           3HA      GLY   8   3.683  -2.693 -20.321
   59    H    LYS   9           H        LYS   9   3.695  -2.347 -17.094
   60    HA   LYS   9           HA       LYS   9   6.379  -3.581 -16.940
   61    HB2  LYS   9           HB2      LYS   9   6.207  -1.195 -16.331
   62    HB3  LYS   9           HB3      LYS   9   5.065  -1.626 -15.032
   63    HG2  LYS   9           HG2      LYS   9   6.778  -3.182 -14.078
   64    HG3  LYS   9           HG3      LYS   9   7.921  -2.690 -15.334
   65    HD2  LYS   9           2HD      LYS   9   6.665  -0.793 -13.314
   66    HD3  LYS   9           3HD      LYS   9   8.242  -1.585 -13.109
   67    HE2  LYS   9           HE2      LYS   9   9.080  -0.524 -15.155
   68    HE3  LYS   9           HE3      LYS   9   7.502   0.219 -15.456
   69    HZ1  LYS   9           3HZ      LYS   9   9.102   1.706 -14.403
   70    HZ2  LYS   9           1HZ      LYS   9   7.751   1.512 -13.498
   71    HZ3  LYS   9           2HZ      LYS   9   9.147   0.741 -13.072
   72    H    LEU  10           H        LEU  10   6.725  -5.382 -15.823
   73    HA   LEU  10           HA       LEU  10   4.429  -6.441 -14.232
   74    HB2  LEU  10           HB2      LEU  10   6.576  -7.794 -15.873
   75    HB3  LEU  10           HB3      LEU  10   5.493  -8.694 -14.861
   76    HG   LEU  10           HG       LEU  10   4.677  -6.988 -17.251
   77   HD11  LEU  10          1HD1      LEU  10   5.837  -9.276 -17.532
   78   HD12  LEU  10          2HD1      LEU  10   4.449  -9.988 -16.702
   79   HD13  LEU  10          3HD1      LEU  10   4.209  -9.156 -18.256
   80   HD21  LEU  10          3HD2      LEU  10   2.982  -8.605 -15.311
   81   HD22  LEU  10          1HD2      LEU  10   2.873  -6.848 -15.650
   82   HD23  LEU  10          2HD2      LEU  10   2.424  -8.030 -16.895
   83    H    PHE  11           H        PHE  11   4.858  -7.567 -12.349
   84    HA   PHE  11           HA       PHE  11   7.531  -7.133 -11.113
   85    HB2  PHE  11           HB2      PHE  11   5.731  -6.156  -9.821
   86    HB3  PHE  11           HB3      PHE  11   4.753  -7.624  -9.982
   87    HD1  PHE  11           HD1      PHE  11   8.020  -6.397  -8.642
   88    HD2  PHE  11           HD2      PHE  11   4.868  -9.299  -8.345
   89    HE1  PHE  11           HE1      PHE  11   9.039  -7.287  -6.555
   90    HE2  PHE  11           HE2      PHE  11   5.891 -10.195  -6.262
   91    HZ   PHE  11           HZ       PHE  11   7.986  -9.175  -5.378
   92    H    ILE  12           H        ILE  12   8.774  -8.901 -10.804
   93    HA   ILE  12           HA       ILE  12   7.517 -11.563 -11.296
   94    HB   ILE  12           HB       ILE  12  10.391 -10.905 -11.930
   95   HG12  ILE  12          HG21      ILE  12   9.219  -9.269 -13.273
   96   HG13  ILE  12          HG31      ILE  12   9.884 -10.563 -14.266
   97   HG21  ILE  12          1HG2      ILE  12   8.375 -12.937 -12.955
   98   HG22  ILE  12          HG22      ILE  12  10.079 -12.818 -13.465
   99   HG23  ILE  12          HG32      ILE  12   9.669 -13.248 -11.783
  100   HD11  ILE  12          3HD1      ILE  12   6.965 -10.173 -13.522
  101   HD12  ILE  12          1HD1      ILE  12   7.730  -9.980 -15.115
  102   HD13  ILE  12          2HD1      ILE  12   7.595 -11.594 -14.392
  103    H    GLY  13           H        GLY  13   7.180 -11.641  -8.920
  104    HA2  GLY  13           2HA      GLY  13   9.651 -11.623  -7.279
  105    HA3  GLY  13           3HA      GLY  13   8.002 -11.705  -6.685
  106    H    GLY  14           H        GLY  14  10.570 -13.444  -6.325
  107    HA2  GLY  14           2HA      GLY  14  10.303 -15.552  -5.230
  108    HA3  GLY  14           3HA      GLY  14   9.028 -15.987  -6.380
  109    H    LEU  15           H        LEU  15  11.639 -14.391  -7.894
  110    HA   LEU  15           HA       LEU  15  12.252 -16.669  -9.516
  111    HB2  LEU  15           HB2      LEU  15  13.736 -14.046  -9.114
  112    HB3  LEU  15           HB3      LEU  15  14.021 -15.232 -10.422
  113    HG   LEU  15           HG       LEU  15  11.293 -13.991 -10.092
  114   HD11  LEU  15          1HD1      LEU  15  13.735 -12.934 -11.588
  115   HD12  LEU  15          2HD1      LEU  15  12.068 -12.365 -11.843
  116   HD13  LEU  15          3HD1      LEU  15  12.869 -12.121 -10.267
  117   HD21  LEU  15          3HD2      LEU  15  11.765 -16.035 -11.531
  118   HD22  LEU  15          1HD2      LEU  15  11.176 -14.635 -12.466
  119   HD23  LEU  15          2HD2      LEU  15  12.906 -15.042 -12.459
  120    H    ASN  16           H        ASN  16  14.451 -17.535  -9.893
  121    HA   ASN  16           HA       ASN  16  15.607 -18.499  -7.445
  122    HB2  ASN  16           HB2      ASN  16  15.199 -19.764  -9.546
  123    HB3  ASN  16           HB3      ASN  16  16.505 -18.829 -10.308
  124   HD21  ASN  16          2HD2      ASN  16  17.150 -21.154 -10.627
  125   HD22  ASN  16          1HD2      ASN  16  18.160 -21.856  -9.413
  126    H    THR  17           H        THR  17  17.916 -18.300  -6.914
  127    HA   THR  17           HA       THR  17  18.985 -15.627  -7.187
  128    HB   THR  17           HB       THR  17  20.846 -16.527  -5.876
  129    HG1  THR  17           1HG      THR  17  21.005 -18.571  -6.855
  130   HG21  THR  17          1HG2      THR  17  18.215 -17.745  -4.947
  131   HG22  THR  17          HG22      THR  17  19.607 -17.329  -3.927
  132   HG23  THR  17          HG32      THR  17  18.672 -16.035  -4.721
  133    H    GLU  18           H        GLU  18  18.845 -18.222  -9.256
  134    HA   GLU  18           HA       GLU  18  21.547 -17.898 -10.414
  135    HB2  GLU  18           HB2      GLU  18  19.401 -19.908 -11.136
  136    HB3  GLU  18           HB3      GLU  18  21.151 -20.048 -11.395
  137    HG2  GLU  18           HG2      GLU  18  19.726 -20.021  -8.694
  138    HG3  GLU  18           HG3      GLU  18  20.304 -21.460  -9.489
  139    H    THR  19           H        THR  19  18.369 -16.774 -10.792
  140    HA   THR  19           HA       THR  19  18.344 -16.641 -13.711
  141    HB   THR  19           HB       THR  19  16.522 -15.330 -11.660
  142    HG1  THR  19           1HG      THR  19  16.294 -17.803 -13.023
  143   HG21  THR  19          1HG2      THR  19  14.887 -15.382 -13.539
  144   HG22  THR  19          HG22      THR  19  16.295 -14.361 -13.900
  145   HG23  THR  19          HG32      THR  19  16.167 -15.985 -14.616
  146    H    ASN  20           H        ASN  20  18.661 -14.812 -14.953
  147    HA   ASN  20           HA       ASN  20  19.286 -12.280 -13.544
  148    HB2  ASN  20           HB2      ASN  20  20.886 -12.803 -15.957
  149    HB3  ASN  20           HB3      ASN  20  21.325 -11.948 -14.475
  150   HD21  ASN  20          2HD2      ASN  20  21.170 -15.025 -16.155
  151   HD22  ASN  20          1HD2      ASN  20  22.145 -15.932 -15.013
  152    H    GLU  21           H        GLU  21  19.864 -10.783 -15.750
  153    HA   GLU  21           HA       GLU  21  17.196 -10.152 -16.586
  154    HB2  GLU  21           HB2      GLU  21  19.923  -9.148 -17.466
  155    HB3  GLU  21           HB3      GLU  21  18.382  -8.420 -17.977
  156    HG2  GLU  21           HG2      GLU  21  17.781  -7.911 -15.679
  157    HG3  GLU  21           HG3      GLU  21  19.126  -8.860 -15.067
  158    H    LYS  22           H        LYS  22  19.911 -11.885 -18.172
  159    HA   LYS  22           HA       LYS  22  18.793 -11.744 -20.808
  160    HB2  LYS  22           HB2      LYS  22  21.152 -12.152 -20.389
  161    HB3  LYS  22           HB3      LYS  22  20.795 -13.656 -19.525
  162    HG2  LYS  22           HG2      LYS  22  21.585 -14.003 -21.869
  163    HG3  LYS  22           HG3      LYS  22  19.997 -14.719 -21.544
  164    HD2  LYS  22           2HD      LYS  22  18.873 -12.844 -22.660
  165    HD3  LYS  22           3HD      LYS  22  20.419 -11.995 -22.841
  166    HE2  LYS  22           HE2      LYS  22  19.798 -13.059 -24.953
  167    HE3  LYS  22           HE3      LYS  22  21.248 -13.822 -24.294
  168    HZ1  LYS  22           3HZ      LYS  22  19.861 -15.597 -23.467
  169    HZ2  LYS  22           1HZ      LYS  22  18.503 -14.869 -24.052
  170    HZ3  LYS  22           2HZ      LYS  22  19.647 -15.428 -25.088
  171    H    ALA  23           H        ALA  23  18.202 -13.845 -18.059
  172    HA   ALA  23           HA       ALA  23  16.869 -15.885 -19.724
  173    HB1  ALA  23           1HB      ALA  23  17.124 -15.571 -16.704
  174    HB2  ALA  23           HB2      ALA  23  16.469 -16.990 -17.543
  175    HB3  ALA  23           HB3      ALA  23  18.182 -16.556 -17.742
  176    H    LEU  24           H        LEU  24  16.210 -12.955 -18.065
  177    HA   LEU  24           HA       LEU  24  13.371 -13.431 -17.608
  178    HB2  LEU  24           HB2      LEU  24  15.609 -11.698 -16.786
  179    HB3  LEU  24           HB3      LEU  24  14.196 -10.720 -17.078
  180    HG   LEU  24           HG       LEU  24  14.088 -13.312 -15.498
  181   HD11  LEU  24          1HD1      LEU  24  14.698 -10.540 -14.399
  182   HD12  LEU  24          2HD1      LEU  24  14.349 -11.993 -13.425
  183   HD13  LEU  24          3HD1      LEU  24  15.811 -11.931 -14.433
  184   HD21  LEU  24          3HD2      LEU  24  12.120 -12.244 -14.446
  185   HD22  LEU  24          1HD2      LEU  24  12.448 -10.734 -15.331
  186   HD23  LEU  24          2HD2      LEU  24  11.964 -12.191 -16.224
  187    H    GLU  25           H        GLU  25  15.545 -11.827 -19.872
  188    HA   GLU  25           HA       GLU  25  13.344 -10.548 -21.293
  189    HB2  GLU  25           HB2      GLU  25  16.276 -11.086 -22.008
  190    HB3  GLU  25           HB3      GLU  25  15.151 -10.236 -23.087
  191    HG2  GLU  25           HG2      GLU  25  14.672  -8.632 -21.291
  192    HG3  GLU  25           HG3      GLU  25  15.903  -9.397 -20.271
  193    H    ALA  26           H        ALA  26  15.039 -13.553 -21.257
  194    HA   ALA  26           HA       ALA  26  14.313 -14.403 -23.948
  195    HB1  ALA  26           1HB      ALA  26  15.517 -15.850 -21.571
  196    HB2  ALA  26           HB2      ALA  26  15.414 -16.510 -23.224
  197    HB3  ALA  26           HB3      ALA  26  16.416 -15.070 -22.904
  198    H    VAL  27           H        VAL  27  12.898 -14.556 -20.763
  199    HA   VAL  27           HA       VAL  27  11.188 -16.850 -21.523
  200    HB   VAL  27           HB       VAL  27  12.602 -16.755 -19.487
  201   HG11  VAL  27          1HG1      VAL  27  12.056 -14.391 -18.918
  202   HG12  VAL  27          HG21      VAL  27  10.440 -14.964 -18.394
  203   HG13  VAL  27          HG31      VAL  27  11.904 -15.545 -17.558
  204   HG21  VAL  27          HG32      VAL  27  10.696 -18.320 -19.694
  205   HG22  VAL  27          1HG2      VAL  27  10.868 -17.729 -18.019
  206   HG23  VAL  27          HG22      VAL  27   9.592 -17.052 -19.076
  207    H    PHE  28           H        PHE  28  11.035 -13.470 -20.416
  208    HA   PHE  28           HA       PHE  28   8.095 -13.513 -20.718
  209    HB2  PHE  28           HB2      PHE  28   9.989 -11.343 -19.794
  210    HB3  PHE  28           HB3      PHE  28   8.247 -11.131 -20.011
  211    HD1  PHE  28           HD2      PHE  28   6.611 -12.386 -18.614
  212    HD2  PHE  28           HD1      PHE  28  10.839 -12.552 -17.885
  213    HE1  PHE  28           HE2      PHE  28   6.190 -13.336 -16.365
  214    HE2  PHE  28           HE1      PHE  28  10.420 -13.504 -15.634
  215    HZ   PHE  28           HZ       PHE  28   8.091 -13.874 -14.865
  216    H    GLY  29           H        GLY  29  10.833 -12.966 -22.693
  217    HA2  GLY  29           2HA      GLY  29   9.592 -11.022 -24.471
  218    HA3  GLY  29           3HA      GLY  29  11.038 -11.992 -24.809
  219    H    LYS  30           H        LYS  30   8.868 -14.167 -23.722
  220    HA   LYS  30           HA       LYS  30   8.274 -15.212 -26.370
  221    HB2  LYS  30           HB2      LYS  30   7.540 -16.154 -23.549
  222    HB3  LYS  30           HB3      LYS  30   7.433 -17.131 -25.026
  223    HG2  LYS  30           HG2      LYS  30   9.850 -16.965 -25.337
  224    HG3  LYS  30           HG3      LYS  30  10.014 -15.901 -23.939
  225    HD2  LYS  30           2HD      LYS  30  10.671 -18.228 -23.396
  226    HD3  LYS  30           3HD      LYS  30   9.355 -17.625 -22.392
  227    HE2  LYS  30           HE2      LYS  30   8.886 -19.900 -23.028
  228    HE3  LYS  30           HE3      LYS  30   7.711 -18.826 -23.793
  229    HZ1  LYS  30           3HZ      LYS  30  10.094 -19.951 -25.113
  230    HZ2  LYS  30           1HZ      LYS  30   8.548 -20.464 -25.331
  231    HZ3  LYS  30           2HZ      LYS  30   8.989 -18.963 -25.826
  232    H    TYR  31           H        TYR  31   6.810 -13.084 -24.229
  233    HA   TYR  31           HA       TYR  31   4.073 -13.698 -25.256
  234    HB2  TYR  31           HB2      TYR  31   4.993 -12.220 -22.777
  235    HB3  TYR  31           HB3      TYR  31   3.310 -12.500 -23.231
  236    HD1  TYR  31           HD1      TYR  31   2.575 -14.984 -23.447
  237    HD2  TYR  31           HD2      TYR  31   6.210 -13.743 -21.514
  238    HE1  TYR  31           HE1      TYR  31   2.721 -17.190 -22.320
  239    HE2  TYR  31           HE2      TYR  31   6.346 -15.940 -20.346
  240    HH   TYR  31           HH       TYR  31   3.952 -18.555 -20.990
  241    H    GLY  32           H        GLY  32   6.622 -11.290 -25.320
  242    HA2  GLY  32           2HA      GLY  32   5.265  -9.694 -27.252
  243    HA3  GLY  32           3HA      GLY  32   5.124  -8.929 -25.650
  244    H    ARG  33           H        ARG  33   6.373  -7.626 -27.723
  245    HA   ARG  33           HA       ARG  33   9.209  -8.059 -27.611
  246    HB2  ARG  33           HB2      ARG  33   7.658  -6.938 -29.432
  247    HB3  ARG  33           HB3      ARG  33   7.900  -5.467 -28.460
  248    HG2  ARG  33           HG2      ARG  33  10.366  -5.789 -28.658
  249    HG3  ARG  33           HG3      ARG  33  10.048  -7.295 -29.568
  250    HD2  ARG  33           2HD      ARG  33   8.832  -5.957 -31.286
  251    HD3  ARG  33           3HD      ARG  33   9.249  -4.478 -30.413
  252    HE   ARG  33           HE       ARG  33  11.036  -6.200 -32.018
  253   HH11  ARG  33          1HH1      ARG  33  10.779  -3.420 -29.824
  254   HH12  ARG  33          2HH1      ARG  33  12.377  -2.837 -30.217
  255   HH21  ARG  33          1HH2      ARG  33  13.098  -5.391 -32.504
  256   HH22  ARG  33          2HH2      ARG  33  13.674  -3.934 -31.731
  257    H    ILE  34           H        ILE  34  10.405  -7.630 -25.976
  258    HA   ILE  34           HA       ILE  34   9.553  -5.963 -23.747
  259    HB   ILE  34           HB       ILE  34  12.141  -7.408 -24.402
  260   HG12  ILE  34          HG21      ILE  34   9.743  -7.980 -22.603
  261   HG13  ILE  34          HG31      ILE  34  10.215  -8.867 -24.061
  262   HG21  ILE  34          1HG2      ILE  34  12.800  -7.015 -22.088
  263   HG22  ILE  34          HG22      ILE  34  12.579  -5.477 -22.905
  264   HG23  ILE  34          HG32      ILE  34  11.311  -6.075 -21.795
  265   HD11  ILE  34          3HD1      ILE  34  12.331  -9.545 -22.949
  266   HD12  ILE  34          1HD1      ILE  34  11.768  -8.762 -21.450
  267   HD13  ILE  34          2HD1      ILE  34  10.875 -10.143 -22.119
  268    H    VAL  35           H        VAL  35  10.212  -3.970 -23.145
  269    HA   VAL  35           HA       VAL  35  11.963  -2.483 -25.043
  270    HB   VAL  35           HB       VAL  35  10.568  -0.682 -23.332
  271   HG11  VAL  35          1HG1      VAL  35  10.250  -1.345 -26.278
  272   HG12  VAL  35          HG21      VAL  35   9.732   0.160 -25.478
  273   HG13  VAL  35          HG31      VAL  35  11.461  -0.242 -25.576
  274   HG21  VAL  35          HG32      VAL  35   8.686  -2.617 -24.742
  275   HG22  VAL  35          1HG2      VAL  35   8.807  -2.357 -22.985
  276   HG23  VAL  35          HG22      VAL  35   8.230  -1.059 -24.045
  277    H    GLU  36           H        GLU  36  11.512  -3.619 -21.768
  278    HA   GLU  36           HA       GLU  36  14.218  -2.823 -21.082
  279    HB2  GLU  36           HB2      GLU  36  12.981  -0.724 -20.623
  280    HB3  GLU  36           HB3      GLU  36  11.839  -1.616 -19.599
  281    HG2  GLU  36           HG2      GLU  36  13.622  -2.185 -18.032
  282    HG3  GLU  36           HG3      GLU  36  14.827  -1.445 -19.105
  283    H    VAL  37           H        VAL  37  15.009  -4.044 -19.299
  284    HA   VAL  37           HA       VAL  37  13.013  -5.594 -17.778
  285    HB   VAL  37           HB       VAL  37  15.222  -6.742 -19.444
  286   HG11  VAL  37          1HG1      VAL  37  14.398  -7.948 -16.772
  287   HG12  VAL  37          HG21      VAL  37  15.381  -8.738 -18.014
  288   HG13  VAL  37          HG31      VAL  37  16.015  -7.314 -17.174
  289   HG21  VAL  37          HG32      VAL  37  12.528  -7.727 -18.380
  290   HG22  VAL  37          1HG2      VAL  37  12.822  -7.051 -19.996
  291   HG23  VAL  37          HG22      VAL  37  13.538  -8.616 -19.523
  292    H    LEU  38           H        LEU  38  13.489  -5.988 -15.724
  293    HA   LEU  38           HA       LEU  38  16.000  -4.806 -14.545
  294    HB2  LEU  38           HB2      LEU  38  13.122  -4.653 -13.926
  295    HB3  LEU  38           HB3      LEU  38  14.150  -4.849 -12.523
  296    HG   LEU  38           HG       LEU  38  14.463  -2.615 -14.588
  297   HD11  LEU  38          1HD1      LEU  38  13.407  -2.606 -11.724
  298   HD12  LEU  38          2HD1      LEU  38  13.663  -1.169 -12.735
  299   HD13  LEU  38          3HD1      LEU  38  12.436  -2.368 -13.200
  300   HD21  LEU  38          3HD2      LEU  38  16.619  -3.150 -13.527
  301   HD22  LEU  38          1HD2      LEU  38  15.974  -1.619 -12.906
  302   HD23  LEU  38          2HD2      LEU  38  15.841  -3.092 -11.923
  303    H    LEU  39           H        LEU  39  16.909  -5.965 -12.851
  304    HA   LEU  39           HA       LEU  39  15.537  -8.323 -11.883
  305    HB2  LEU  39           HB2      LEU  39  16.798  -9.132 -13.858
  306    HB3  LEU  39           HB3      LEU  39  18.281  -8.418 -13.219
  307    HG   LEU  39           HG       LEU  39  17.944 -10.925 -13.058
  308   HD11  LEU  39          1HD1      LEU  39  18.617  -9.458 -10.485
  309   HD12  LEU  39          2HD1      LEU  39  19.095 -11.105 -10.914
  310   HD13  LEU  39          3HD1      LEU  39  19.714  -9.726 -11.873
  311   HD21  LEU  39          3HD2      LEU  39  16.295 -10.250 -10.608
  312   HD22  LEU  39          1HD2      LEU  39  15.643 -10.897 -12.150
  313   HD23  LEU  39          2HD2      LEU  39  16.796 -11.855 -11.193
  314    H    MET  40           H        MET  40  15.772  -8.149  -9.685
  315    HA   MET  40           HA       MET  40  17.648  -6.039  -8.841
  316    HB2  MET  40           HB2      MET  40  15.573  -7.399  -7.105
  317    HB3  MET  40           HB3      MET  40  16.339  -5.826  -6.877
  318    HG2  MET  40           HG2      MET  40  14.081  -6.655  -8.645
  319    HG3  MET  40           HG3      MET  40  14.256  -5.212  -7.657
  320    HE1  MET  40           HE3      MET  40  16.733  -3.157 -10.072
  321    HE2  MET  40           HE1      MET  40  15.785  -2.991  -8.571
  322    HE3  MET  40           HE2      MET  40  17.096  -4.186  -8.655
  323    H    LYS  41           H        LYS  41  19.376  -6.325  -7.419
  324    HA   LYS  41           HA       LYS  41  19.581  -9.013  -6.240
  325    HB2  LYS  41           HB2      LYS  41  22.199  -8.001  -7.080
  326    HB3  LYS  41           HB3      LYS  41  21.451  -9.618  -7.105
  327    HG2  LYS  41           HG2      LYS  41  20.351  -9.165  -9.195
  328    HG3  LYS  41           HG3      LYS  41  20.842  -7.450  -9.153
  329    HD2  LYS  41           2HD      LYS  41  23.234  -8.169  -9.190
  330    HD3  LYS  41           3HD      LYS  41  22.704  -9.854  -9.374
  331    HE2  LYS  41           HE2      LYS  41  21.534  -9.256 -11.459
  332    HE3  LYS  41           HE3      LYS  41  22.012  -7.564 -11.255
  333    HZ1  LYS  41           3HZ      LYS  41  23.871  -9.821 -11.608
  334    HZ2  LYS  41           1HZ      LYS  41  23.472  -8.724 -12.763
  335    HZ3  LYS  41           2HZ      LYS  41  24.302  -8.245 -11.432
  336    H    ASP  42           H        ASP  42  20.886  -9.245  -4.436
  337    HA   ASP  42           HA       ASP  42  20.600  -7.203  -2.527
  338    HB2  ASP  42           HB2      ASP  42  20.789  -9.745  -2.317
  339    HB3  ASP  42           HB3      ASP  42  22.537  -9.527  -2.449
  340    H    ARG  43           H        ARG  43  22.063  -5.782  -1.551
  341    HA   ARG  43           HA       ARG  43  24.055  -4.800  -3.433
  342    HB2  ARG  43           HB2      ARG  43  22.320  -3.437  -2.118
  343    HB3  ARG  43           HB3      ARG  43  23.340  -3.691  -0.701
  344    HG2  ARG  43           HG2      ARG  43  23.797  -1.516  -1.734
  345    HG3  ARG  43           HG3      ARG  43  25.222  -2.556  -1.855
  346    HD2  ARG  43           2HD      ARG  43  24.774  -1.318  -3.961
  347    HD3  ARG  43           3HD      ARG  43  24.690  -3.066  -4.197
  348    HE   ARG  43           HE       ARG  43  22.110  -1.858  -3.583
  349   HH11  ARG  43          1HH1      ARG  43  24.395  -2.562  -6.185
  350   HH12  ARG  43          2HH1      ARG  43  23.155  -2.598  -7.421
  351   HH21  ARG  43          1HH2      ARG  43  20.515  -1.910  -5.211
  352   HH22  ARG  43          2HH2      ARG  43  20.966  -2.203  -6.870
  353    H    GLU  44           H        GLU  44  24.166  -7.048  -0.928
  354    HA   GLU  44           HA       GLU  44  27.031  -6.429  -0.349
  355    HB2  GLU  44           HB2      GLU  44  24.927  -7.826   1.328
  356    HB3  GLU  44           HB3      GLU  44  26.637  -7.648   1.773
  357    HG2  GLU  44           HG2      GLU  44  26.394  -5.172   1.676
  358    HG3  GLU  44           HG3      GLU  44  24.672  -5.362   1.313
  359    H    THR  45           H        THR  45  24.901  -8.696  -1.853
  360    HA   THR  45           HA       THR  45  27.140 -10.671  -1.884
  361    HB   THR  45           HB       THR  45  25.646 -12.501  -1.671
  362    HG1  THR  45           1HG      THR  45  23.394 -12.154  -1.575
  363   HG21  THR  45          1HG2      THR  45  24.638 -10.379   0.260
  364   HG22  THR  45          HG22      THR  45  24.628 -12.140   0.510
  365   HG23  THR  45          HG32      THR  45  26.180 -11.266   0.437
  366    H    ASN  46           H        ASN  46  24.842  -8.799  -3.626
  367    HA   ASN  46           HA       ASN  46  24.479  -8.542  -5.841
  368    HB2  ASN  46           HB2      ASN  46  27.052  -8.445  -5.444
  369    HB3  ASN  46           HB3      ASN  46  27.088  -9.948  -6.369
  370   HD21  ASN  46          2HD2      ASN  46  28.489  -8.347  -7.703
  371   HD22  ASN  46          1HD2      ASN  46  27.643  -7.495  -8.983
  372    H    LYS  47           H        LYS  47  23.684 -11.132  -4.531
  373    HA   LYS  47           HA       LYS  47  23.722 -13.208  -6.575
  374    HB2  LYS  47           HB2      LYS  47  22.294 -12.746  -3.935
  375    HB3  LYS  47           HB3      LYS  47  21.969 -14.167  -4.924
  376    HG2  LYS  47           HG2      LYS  47  24.722 -13.372  -3.901
  377    HG3  LYS  47           HG3      LYS  47  23.658 -14.555  -3.124
  378    HD2  LYS  47           2HD      LYS  47  23.695 -15.950  -5.167
  379    HD3  LYS  47           3HD      LYS  47  24.798 -14.799  -5.949
  380    HE2  LYS  47           HE2      LYS  47  25.379 -16.283  -3.358
  381    HE3  LYS  47           HE3      LYS  47  25.964 -16.768  -4.954
  382    HZ1  LYS  47           3HZ      LYS  47  26.578 -14.212  -3.627
  383    HZ2  LYS  47           1HZ      LYS  47  27.604 -15.486  -3.772
  384    HZ3  LYS  47           2HZ      LYS  47  27.116 -14.672  -5.112
  385    H    SER  48           H        SER  48  20.707 -12.859  -5.251
  386    HA   SER  48           HA       SER  48  19.568 -10.976  -7.190
  387    HB2  SER  48           HB2      SER  48  19.443 -13.253  -8.322
  388    HB3  SER  48           HB3      SER  48  18.459 -13.792  -6.946
  389    HG   SER  48           HG       SER  48  17.208 -13.015  -8.709
  390    H    ARG  49           H        ARG  49  17.728  -9.994  -6.267
  391    HA   ARG  49           HA       ARG  49  17.313 -10.433  -3.409
  392    HB2  ARG  49           HB2      ARG  49  15.738  -8.762  -5.406
  393    HB3  ARG  49           HB3      ARG  49  15.637  -8.647  -3.637
  394    HG2  ARG  49           HG2      ARG  49  18.373  -8.361  -4.752
  395    HG3  ARG  49           HG3      ARG  49  17.234  -7.097  -5.253
  396    HD2  ARG  49           2HD      ARG  49  18.381  -6.357  -3.286
  397    HD3  ARG  49           3HD      ARG  49  16.688  -6.632  -2.920
  398    HE   ARG  49           HE       ARG  49  18.969  -8.444  -2.151
  399   HH11  ARG  49          1HH1      ARG  49  15.661  -7.312  -1.588
  400   HH12  ARG  49          2HH1      ARG  49  15.514  -8.174  -0.075
  401   HH21  ARG  49          1HH2      ARG  49  18.768  -9.482  -0.148
  402   HH22  ARG  49          2HH2      ARG  49  17.248  -9.441   0.704
  403    H    GLY  50           H        GLY  50  16.354 -12.001  -6.184
  404    HA2  GLY  50           2HA      GLY  50  14.900 -13.801  -6.412
  405    HA3  GLY  50           3HA      GLY  50  14.229 -13.460  -4.800
  406    H    PHE  51           H        PHE  51  14.254 -10.541  -6.570
  407    HA   PHE  51           HA       PHE  51  11.710 -11.160  -7.938
  408    HB2  PHE  51           HB2      PHE  51  10.530  -9.357  -7.020
  409    HB3  PHE  51           HB3      PHE  51  11.181 -10.277  -5.667
  410    HD1  PHE  51           HD1      PHE  51  13.240  -9.341  -4.437
  411    HD2  PHE  51           HD2      PHE  51  10.993  -7.070  -7.316
  412    HE1  PHE  51           HE1      PHE  51  14.197  -7.210  -3.533
  413    HE2  PHE  51           HE2      PHE  51  11.892  -4.972  -6.358
  414    HZ   PHE  51           HZ       PHE  51  13.517  -5.051  -4.511
  415    H    ALA  52           H        ALA  52  11.116  -9.514  -9.543
  416    HA   ALA  52           HA       ALA  52  13.269  -7.752 -10.476
  417    HB1  ALA  52           1HB      ALA  52  12.376 -10.206 -12.057
  418    HB2  ALA  52           HB2      ALA  52  13.550  -8.992 -12.588
  419    HB3  ALA  52           HB3      ALA  52  13.929 -10.048 -11.203
  420    H    PHE  53           H        PHE  53  12.569  -7.055 -12.884
  421    HA   PHE  53           HA       PHE  53   9.637  -6.846 -13.090
  422    HB2  PHE  53           HB2      PHE  53  11.484  -4.413 -13.092
  423    HB3  PHE  53           HB3      PHE  53   9.778  -4.393 -13.445
  424    HD1  PHE  53           HD1      PHE  53  12.312  -5.107 -10.844
  425    HD2  PHE  53           HD2      PHE  53   8.199  -4.206 -11.673
  426    HE1  PHE  53           HE1      PHE  53  11.898  -4.804  -8.418
  427    HE2  PHE  53           HE2      PHE  53   7.769  -3.911  -9.242
  428    HZ   PHE  53           HZ       PHE  53   9.619  -4.235  -7.612
  429    H    VAL  54           H        VAL  54   8.968  -5.981 -15.239
  430    HA   VAL  54           HA       VAL  54  11.020  -5.849 -17.326
  431    HB   VAL  54           HB       VAL  54  10.656  -8.282 -17.216
  432   HG11  VAL  54          1HG1      VAL  54   7.757  -7.787 -17.479
  433   HG12  VAL  54          HG21      VAL  54   8.650  -9.353 -17.511
  434   HG13  VAL  54          HG31      VAL  54   8.687  -8.360 -16.036
  435   HG21  VAL  54          HG32      VAL  54   8.964  -7.212 -19.526
  436   HG22  VAL  54          1HG2      VAL  54  10.735  -7.112 -19.526
  437   HG23  VAL  54          HG22      VAL  54   9.930  -8.701 -19.494
  438    H    THR  55           H        THR  55  10.349  -4.631 -19.042
  439    HA   THR  55           HA       THR  55   7.530  -3.662 -18.920
  440    HB   THR  55           HB       THR  55   9.918  -2.183 -20.067
  441    HG1  THR  55           1HG      THR  55  10.009  -2.339 -17.804
  442   HG21  THR  55          1HG2      THR  55   7.007  -1.430 -19.513
  443   HG22  THR  55          HG22      THR  55   8.272  -0.287 -20.021
  444   HG23  THR  55          HG32      THR  55   7.763  -1.588 -21.111
  445    H    PHE  56           H        PHE  56   6.269  -4.285 -20.484
  446    HA   PHE  56           HA       PHE  56   7.359  -5.393 -22.996
  447    HB2  PHE  56           HB2      PHE  56   4.626  -5.269 -21.699
  448    HB3  PHE  56           HB3      PHE  56   4.885  -5.864 -23.336
  449    HD1  PHE  56           HD2      PHE  56   6.376  -6.477 -19.884
  450    HD2  PHE  56           HD1      PHE  56   5.054  -8.069 -23.657
  451    HE1  PHE  56           HE2      PHE  56   6.897  -8.752 -19.104
  452    HE2  PHE  56           HE1      PHE  56   5.517 -10.363 -22.851
  453    HZ   PHE  56           HZ       PHE  56   6.381 -10.717 -20.555
  454    H    GLU  57           H        GLU  57   6.592  -4.694 -25.102
  455    HA   GLU  57           HA       GLU  57   6.174  -1.852 -25.362
  456    HB2  GLU  57           HB2      GLU  57   6.305  -4.264 -27.194
  457    HB3  GLU  57           HB3      GLU  57   5.698  -2.711 -27.774
  458    HG2  GLU  57           HG2      GLU  57   7.820  -1.635 -26.873
  459    HG3  GLU  57           HG3      GLU  57   8.441  -3.278 -26.608
  460    H    SER  58           H        SER  58   4.020  -4.670 -25.046
  461    HA   SER  58           HA       SER  58   1.751  -2.773 -25.457
  462    HB2  SER  58           HB2      SER  58   1.719  -4.421 -27.217
  463    HB3  SER  58           HB3      SER  58   1.973  -5.739 -26.052
  464    HG   SER  58           HG       SER  58  -0.238  -5.452 -26.692
  465    HA   PRO  59           HA       PRO  59   0.938  -3.581 -21.227
  466    HB2  PRO  59           HB2      PRO  59  -1.531  -2.514 -20.980
  467    HB3  PRO  59           HB3      PRO  59  -0.137  -1.466 -21.412
  468    HG2  PRO  59           HG2      PRO  59  -2.094  -2.833 -23.286
  469    HG3  PRO  59           HG3      PRO  59  -1.732  -1.079 -23.195
  470    HD2  PRO  59           2HD      PRO  59  -0.429  -2.665 -24.981
  471    HD3  PRO  59           3HD      PRO  59   0.488  -1.431 -24.061
  472    H    ALA  60           H        ALA  60  -0.410  -5.245 -23.827
  473    HA   ALA  60           HA       ALA  60  -2.021  -6.956 -21.995
  474    HB1  ALA  60           1HB      ALA  60  -3.423  -5.788 -23.621
  475    HB2  ALA  60           HB2      ALA  60  -2.433  -6.429 -24.958
  476    HB3  ALA  60           HB3      ALA  60  -3.394  -7.536 -23.941
  477    H    ASP  61           H        ASP  61   0.696  -6.793 -24.196
  478    HA   ASP  61           HA       ASP  61   0.968  -9.672 -24.498
  479    HB2  ASP  61           HB2      ASP  61   2.967  -7.356 -24.580
  480    HB3  ASP  61           HB3      ASP  61   3.399  -8.994 -24.854
  481    H    ALA  62           H        ALA  62   1.663  -7.221 -22.076
  482    HA   ALA  62           HA       ALA  62   3.281  -8.924 -20.390
  483    HB1  ALA  62           1HB      ALA  62   1.765  -6.326 -19.891
  484    HB2  ALA  62           HB2      ALA  62   2.920  -7.078 -18.759
  485    HB3  ALA  62           HB3      ALA  62   3.474  -6.485 -20.349
  486    H    LYS  63           H        LYS  63  -0.185  -8.270 -20.804
  487    HA   LYS  63           HA       LYS  63  -0.971  -9.525 -18.299
  488    HB2  LYS  63           HB2      LYS  63  -2.511  -8.985 -20.874
  489    HB3  LYS  63           HB3      LYS  63  -3.241  -9.495 -19.338
  490    HG2  LYS  63           HG2      LYS  63  -2.438  -7.445 -18.240
  491    HG3  LYS  63           HG3      LYS  63  -1.591  -6.976 -19.726
  492    HD2  LYS  63           2HD      LYS  63  -3.655  -5.703 -19.601
  493    HD3  LYS  63           3HD      LYS  63  -3.789  -6.863 -20.918
  494    HE2  LYS  63           HE2      LYS  63  -5.863  -6.928 -19.700
  495    HE3  LYS  63           HE3      LYS  63  -4.999  -8.432 -19.340
  496    HZ1  LYS  63           3HZ      LYS  63  -5.064  -6.042 -17.621
  497    HZ2  LYS  63           1HZ      LYS  63  -5.914  -7.421 -17.366
  498    HZ3  LYS  63           2HZ      LYS  63  -4.273  -7.445 -17.274
  499    H    ASP  64           H        ASP  64  -0.479 -10.527 -21.679
  500    HA   ASP  64           HA       ASP  64  -1.624 -13.136 -21.352
  501    HB2  ASP  64           HB2      ASP  64  -1.168 -11.796 -23.485
  502    HB3  ASP  64           HB3      ASP  64   0.537 -12.176 -23.272
  503    H    ALA  65           H        ALA  65   1.489 -11.730 -20.652
  504    HA   ALA  65           HA       ALA  65   2.733 -14.329 -20.074
  505    HB1  ALA  65           1HB      ALA  65   3.642 -11.532 -19.272
  506    HB2  ALA  65           HB2      ALA  65   4.622 -13.017 -19.320
  507    HB3  ALA  65           HB3      ALA  65   4.022 -12.286 -20.830
  508    H    ALA  66           H        ALA  66   1.300 -11.570 -18.259
  509    HA   ALA  66           HA       ALA  66   1.971 -12.714 -15.716
  510    HB1  ALA  66           1HB      ALA  66   0.007 -10.491 -16.450
  511    HB2  ALA  66           HB2      ALA  66   0.681 -10.797 -14.834
  512    HB3  ALA  66           HB3      ALA  66   1.738 -10.266 -16.165
  513    H    ARG  67           H        ARG  67  -0.473 -13.526 -17.934
  514    HA   ARG  67           HA       ARG  67  -2.021 -14.858 -15.771
  515    HB2  ARG  67           HB2      ARG  67  -2.711 -13.995 -18.594
  516    HB3  ARG  67           HB3      ARG  67  -3.623 -15.257 -17.755
  517    HG2  ARG  67           HG2      ARG  67  -4.824 -13.326 -17.214
  518    HG3  ARG  67           HG3      ARG  67  -3.814 -13.665 -15.786
  519    HD2  ARG  67           2HD      ARG  67  -2.198 -11.913 -16.626
  520    HD3  ARG  67           3HD      ARG  67  -3.395 -11.518 -17.882
  521    HE   ARG  67           HE       ARG  67  -4.832 -10.622 -16.254
  522   HH11  ARG  67          1HH2      ARG  67  -1.921 -11.967 -14.705
  523   HH12  ARG  67          2HH2      ARG  67  -2.182 -11.062 -13.235
  524   HH21  ARG  67          1HH1      ARG  67  -5.127  -9.525 -14.298
  525   HH22  ARG  67          2HH1      ARG  67  -3.969  -9.719 -12.996
  526    H    ASP  68           H        ASP  68   0.692 -15.647 -17.385
  527    HA   ASP  68           HA       ASP  68  -0.238 -18.416 -18.014
  528    HB2  ASP  68           HB2      ASP  68   1.286 -16.302 -19.482
  529    HB3  ASP  68           HB3      ASP  68   2.055 -17.848 -19.439
  530    H    MET  69           H        MET  69   2.509 -16.266 -17.408
  531    HA   MET  69           HA       MET  69   4.221 -18.338 -16.327
  532    HB2  MET  69           HB2      MET  69   4.297 -15.489 -17.248
  533    HB3  MET  69           HB3      MET  69   5.401 -15.875 -15.965
  534    HG2  MET  69           HG2      MET  69   5.080 -17.307 -18.636
  535    HG3  MET  69           HG3      MET  69   6.393 -16.189 -18.214
  536    HE1  MET  69           HE3      MET  69   6.860 -17.246 -15.169
  537    HE2  MET  69           HE1      MET  69   8.375 -18.123 -15.519
  538    HE3  MET  69           HE2      MET  69   8.027 -16.572 -16.335
  539    H    ASN  70           H        ASN  70   1.736 -16.369 -15.031
  540    HA   ASN  70           HA       ASN  70   2.989 -15.886 -12.462
  541    HB2  ASN  70           HB2      ASN  70   1.180 -14.470 -13.394
  542    HB3  ASN  70           HB3      ASN  70   0.063 -15.833 -13.301
  543   HD21  ASN  70          2HD2      ASN  70  -1.198 -14.292 -11.961
  544   HD22  ASN  70          1HD2      ASN  70  -0.831 -14.186 -10.250
  545    H    GLY  71           H        GLY  71   3.217 -17.263 -10.816
  546    HA2  GLY  71           2HA      GLY  71   2.627 -18.947  -9.318
  547    HA3  GLY  71           3HA      GLY  71   1.324 -19.467 -10.403
  548    H    LYS  72           H        LYS  72   3.793 -19.219 -12.544
  549    HA   LYS  72           HA       LYS  72   4.572 -22.017 -12.456
  550    HB2  LYS  72           HB2      LYS  72   5.512 -19.703 -14.158
  551    HB3  LYS  72           HB3      LYS  72   5.666 -21.421 -14.508
  552    HG2  LYS  72           HG2      LYS  72   3.035 -19.884 -14.392
  553    HG3  LYS  72           HG3      LYS  72   3.851 -20.488 -15.848
  554    HD2  LYS  72           2HD      LYS  72   3.607 -22.813 -15.006
  555    HD3  LYS  72           3HD      LYS  72   2.729 -22.200 -13.584
  556    HE2  LYS  72           HE2      LYS  72   1.024 -21.195 -15.069
  557    HE3  LYS  72           HE3      LYS  72   1.888 -21.814 -16.485
  558    HZ1  LYS  72           3HZ      LYS  72   0.081 -23.254 -15.841
  559    HZ2  LYS  72           1HZ      LYS  72   1.514 -24.041 -15.649
  560    HZ3  LYS  72           2HZ      LYS  72   0.706 -23.459 -14.340
  561    H    SER  73           H        SER  73   7.172 -21.429 -13.534
  562    HA   SER  73           HA       SER  73   8.697 -20.497 -11.144
  563    HB2  SER  73           HB2      SER  73   8.133 -22.914 -10.957
  564    HB3  SER  73           HB3      SER  73   8.930 -23.212 -12.512
  565    HG   SER  73           HG       SER  73  10.304 -23.623 -10.728
  566    H    LEU  74           H        LEU  74  10.870 -20.228 -11.421
  567    HA   LEU  74           HA       LEU  74  11.799 -19.973 -14.239
  568    HB2  LEU  74           HB2      LEU  74  11.185 -17.759 -12.590
  569    HB3  LEU  74           HB3      LEU  74  12.870 -17.995 -12.321
  570    HG   LEU  74           HG       LEU  74  12.708 -16.459 -14.092
  571   HD11  LEU  74          1HD1      LEU  74  13.302 -19.104 -15.465
  572   HD12  LEU  74          2HD1      LEU  74  13.763 -17.478 -16.006
  573   HD13  LEU  74          3HD1      LEU  74  14.462 -18.133 -14.510
  574   HD21  LEU  74          3HD2      LEU  74  11.379 -16.877 -16.125
  575   HD22  LEU  74          1HD2      LEU  74  10.926 -18.488 -15.518
  576   HD23  LEU  74          2HD2      LEU  74  10.345 -17.020 -14.686
  577    H    ASP  75           H        ASP  75  13.670 -20.966 -14.502
  578    HA   ASP  75           HA       ASP  75  15.555 -22.104 -14.134
  579    HB2  ASP  75           HB2      ASP  75  16.036 -19.656 -13.074
  580    HB3  ASP  75           HB3      ASP  75  15.892 -20.471 -11.597
  581    H    GLY  76           H        GLY  76  13.247 -22.079 -11.575
  582    HA2  GLY  76           2HA      GLY  76  13.130 -24.678 -11.110
  583    HA3  GLY  76           3HA      GLY  76  14.578 -24.262 -10.156
  584    H    LYS  77           H        LYS  77  12.810 -21.481  -9.983
  585    HA   LYS  77           HA       LYS  77  11.603 -22.324  -7.398
  586    HB2  LYS  77           HB2      LYS  77  12.900 -19.659  -8.049
  587    HB3  LYS  77           HB3      LYS  77  12.296 -20.197  -6.473
  588    HG2  LYS  77           HG2      LYS  77  14.604 -21.432  -8.028
  589    HG3  LYS  77           HG3      LYS  77  14.757 -20.375  -6.618
  590    HD2  LYS  77           2HD      LYS  77  13.771 -22.012  -5.161
  591    HD3  LYS  77           3HD      LYS  77  13.285 -23.043  -6.524
  592    HE2  LYS  77           HE2      LYS  77  15.606 -23.416  -7.155
  593    HE3  LYS  77           HE3      LYS  77  16.162 -22.356  -5.847
  594    HZ1  LYS  77           3HZ      LYS  77  16.268 -24.666  -5.214
  595    HZ2  LYS  77           1HZ      LYS  77  15.169 -23.883  -4.277
  596    HZ3  LYS  77           2HZ      LYS  77  14.661 -24.866  -5.495
  597    H    ALA  78           H        ALA  78   9.574 -21.681  -6.953
  598    HA   ALA  78           HA       ALA  78   7.980 -20.921  -9.221
  599    HB1  ALA  78           1HB      ALA  78   7.228 -21.225  -6.294
  600    HB2  ALA  78           HB2      ALA  78   6.094 -21.118  -7.662
  601    HB3  ALA  78           HB3      ALA  78   7.201 -22.505  -7.534
  602    H    ILE  79           H        ILE  79   6.933 -19.052  -9.715
  603    HA   ILE  79           HA       ILE  79   7.720 -16.659  -8.115
  604    HB   ILE  79           HB       ILE  79   8.000 -15.437 -10.135
  605   HG12  ILE  79          HG21      ILE  79   7.102 -17.902 -11.685
  606   HG13  ILE  79          HG31      ILE  79   6.098 -16.474 -11.387
  607   HG21  ILE  79          1HG2      ILE  79   9.860 -16.585 -11.174
  608   HG22  ILE  79          HG22      ILE  79   9.880 -16.927  -9.428
  609   HG23  ILE  79          HG32      ILE  79   9.300 -18.158 -10.574
  610   HD11  ILE  79          3HD1      ILE  79   8.657 -16.579 -13.006
  611   HD12  ILE  79          1HD1      ILE  79   7.004 -16.177 -13.547
  612   HD13  ILE  79          2HD1      ILE  79   7.879 -15.065 -12.484
  613    H    LYS  80           H        LYS  80   6.527 -14.702  -8.744
  614    HA   LYS  80           HA       LYS  80   3.628 -15.119  -9.278
  615    HB2  LYS  80           HB2      LYS  80   4.301 -14.236  -6.951
  616    HB3  LYS  80           HB3      LYS  80   4.975 -12.831  -7.781
  617    HG2  LYS  80           HG2      LYS  80   2.615 -12.582  -8.880
  618    HG3  LYS  80           HG3      LYS  80   2.074 -13.711  -7.618
  619    HD2  LYS  80           2HD      LYS  80   3.094 -12.124  -5.917
  620    HD3  LYS  80           3HD      LYS  80   3.393 -10.996  -7.268
  621    HE2  LYS  80           HE2      LYS  80   0.960 -11.008  -7.784
  622    HE3  LYS  80           HE3      LYS  80   0.689 -12.069  -6.389
  623    HZ1  LYS  80           3HZ      LYS  80   1.604 -10.313  -4.993
  624    HZ2  LYS  80           1HZ      LYS  80   1.809  -9.343  -6.291
  625    HZ3  LYS  80           2HZ      LYS  80   0.290  -9.781  -5.822
  626    H    VAL  81           H        VAL  81   2.795 -13.778 -10.957
  627    HA   VAL  81           HA       VAL  81   4.604 -11.674 -12.014
  628    HB   VAL  81           HB       VAL  81   3.149 -13.690 -13.773
  629   HG11  VAL  81          1HG1      VAL  81   5.096 -11.440 -14.441
  630   HG12  VAL  81          HG21      VAL  81   4.300 -12.541 -15.597
  631   HG13  VAL  81          HG31      VAL  81   3.337 -11.364 -14.680
  632   HG21  VAL  81          HG32      VAL  81   6.110 -13.327 -13.170
  633   HG22  VAL  81          1HG2      VAL  81   5.107 -14.725 -12.723
  634   HG23  VAL  81          HG22      VAL  81   5.435 -14.386 -14.435
  635    H    GLU  82           H        GLU  82   3.577  -9.794 -12.209
  636    HA   GLU  82           HA       GLU  82   0.757  -9.624 -12.897
  637    HB2  GLU  82           HB2      GLU  82   0.812 -10.287 -10.425
  638    HB3  GLU  82           HB3      GLU  82   1.644  -8.775 -10.098
  639    HG2  GLU  82           HG2      GLU  82  -0.845  -8.709  -9.707
  640    HG3  GLU  82           HG3      GLU  82  -0.260  -7.473 -10.819
  641    H    GLN  83           H        GLN  83   0.068  -7.231 -12.999
  642    HA   GLN  83           HA       GLN  83   2.114  -5.572 -14.056
  643    HB2  GLN  83           HB2      GLN  83  -0.156  -5.064 -14.604
  644    HB3  GLN  83           HB3      GLN  83  -0.641  -5.082 -12.901
  645    HG2  GLN  83           HG2      GLN  83  -0.649  -2.826 -13.640
  646    HG3  GLN  83           HG3      GLN  83   0.663  -3.032 -12.478
  647   HE21  GLN  83          HE22      GLN  83   1.866  -1.319 -13.095
  648   HE22  GLN  83          HE12      GLN  83   2.599  -1.126 -14.672
  649    H    ALA  84           H        ALA  84   3.522  -4.151 -13.121
  650    HA   ALA  84           HA       ALA  84   4.182  -4.692 -10.367
  651    HB1  ALA  84           1HB      ALA  84   5.871  -4.369 -12.125
  652    HB2  ALA  84           HB2      ALA  84   5.317  -2.690 -12.351
  653    HB3  ALA  84           HB3      ALA  84   6.067  -3.176 -10.817
  654    H    THR  85           H        THR  85   4.514  -3.148  -8.700
  655    HA   THR  85           HA       THR  85   2.892  -0.659  -8.945
  656    HB   THR  85           HB       THR  85   2.593  -0.747  -6.523
  657    HG1  THR  85           1HG      THR  85   4.340  -2.116  -6.010
  658   HG21  THR  85          1HG2      THR  85   0.837  -1.680  -8.018
  659   HG22  THR  85          HG22      THR  85   1.630  -3.271  -7.967
  660   HG23  THR  85          HG32      THR  85   0.915  -2.594  -6.492
  661    H    LYS  86           H        LYS  86   3.648   1.005  -7.328
  662    HA   LYS  86           HA       LYS  86   6.318   1.680  -8.083
  663    HB2  LYS  86           HB2      LYS  86   4.318   2.922  -6.148
  664    HB3  LYS  86           HB3      LYS  86   5.821   3.696  -6.688
  665    HG2  LYS  86           HG2      LYS  86   5.070   3.384  -9.068
  666    HG3  LYS  86           HG3      LYS  86   3.543   2.714  -8.477
  667    HD2  LYS  86           2HD      LYS  86   3.123   4.901  -7.290
  668    HD3  LYS  86           3HD      LYS  86   4.570   5.546  -8.114
  669    HE2  LYS  86           HE2      LYS  86   3.565   4.826 -10.303
  670    HE3  LYS  86           HE3      LYS  86   2.108   4.331  -9.431
  671    HZ1  LYS  86           3HZ      LYS  86   3.179   7.077  -9.443
  672    HZ2  LYS  86           1HZ      LYS  86   1.921   6.551 -10.367
  673    HZ3  LYS  86           2HZ      LYS  86   1.781   6.574  -8.733
  674    HA   PRO  87           HA       PRO  87   8.722  -0.016  -4.864
  675    HB2  PRO  87           HB2      PRO  87  10.832   1.679  -4.701
  676    HB3  PRO  87           HB3      PRO  87  10.533   0.743  -6.182
  677    HG2  PRO  87           HG2      PRO  87   9.658   3.588  -5.635
  678    HG3  PRO  87           HG3      PRO  87  10.562   2.962  -7.061
  679    HD2  PRO  87           2HD      PRO  87   7.874   3.265  -7.155
  680    HD3  PRO  87           3HD      PRO  87   8.644   1.823  -7.884
  681    H    SER  88           H        SER  88   9.673   0.440  -2.681
  682    HA   SER  88           HA       SER  88   7.893   2.349  -1.260
  683    HB2  SER  88           HB2      SER  88   8.760  -0.456  -0.469
  684    HB3  SER  88           HB3      SER  88   7.817   0.643   0.561
  685    HG   SER  88           HG       SER  88   6.494  -0.788  -0.638
  686    H    PHE  89           H        PHE  89  11.097   1.963  -2.019
  687    HA   PHE  89           HA       PHE  89  12.103   2.688   0.654
  688    HB2  PHE  89           HB2      PHE  89  14.281   2.639  -0.328
  689    HB3  PHE  89           HB3      PHE  89  13.402   1.178  -0.800
  690    HD1  PHE  89           HD2      PHE  89  12.416   1.043  -3.123
  691    HD2  PHE  89           HD1      PHE  89  15.130   4.151  -1.934
  692    HE1  PHE  89           HE2      PHE  89  12.855   1.585  -5.518
  693    HE2  PHE  89           HE1      PHE  89  15.623   4.638  -4.319
  694    HZ   PHE  89           HZ       PHE  89  14.458   3.359  -6.111
  695    H    GLU  90           H        GLU  90  10.471   4.303  -1.715
  696    HA   GLU  90           HA       GLU  90  12.028   6.784  -1.696
  697    HB2  GLU  90           HB2      GLU  90  10.257   7.606  -3.166
  698    HB3  GLU  90           HB3      GLU  90  10.859   6.030  -3.724
  699    HG2  GLU  90           HG2      GLU  90   8.935   4.893  -2.776
  700    HG3  GLU  90           HG3      GLU  90   8.370   6.386  -2.009
  701    H    SER  91           H        SER  91  10.545   8.842  -1.399
  702    HA   SER  91           HA       SER  91   8.860   8.615   1.025
  703    HB2  SER  91           HB2      SER  91  11.289   8.856   1.698
  704    HB3  SER  91           HB3      SER  91  11.276  10.439   0.879
  705    HG   SER  91           HG       SER  91  10.796  10.582   3.126
  706    H    GLY  92           H        GLY  92   7.843  10.774   1.543
  707    HA2  GLY  92           2HA      GLY  92   6.715  11.936  -0.810
  708    HA3  GLY  92           3HA      GLY  92   6.538  12.541   0.847
  709    H    ARG  93           H        ARG  93   7.409  13.541  -2.073
  710    HA   ARG  93           HA       ARG  93   9.157  15.667  -1.044
  711    HB2  ARG  93           HB2      ARG  93  10.864  15.316  -2.766
  712    HB3  ARG  93           HB3      ARG  93  10.745  13.907  -1.705
  713    HG2  ARG  93           HG2      ARG  93   9.325  12.759  -3.414
  714    HG3  ARG  93           HG3      ARG  93   9.504  14.171  -4.480
  715    HD2  ARG  93           2HD      ARG  93  11.101  12.457  -5.129
  716    HD3  ARG  93           3HD      ARG  93  11.967  13.855  -4.461
  717    HE   ARG  93           HE       ARG  93  11.415  11.908  -2.410
  718   HH11  ARG  93          1HH1      ARG  93  13.533  12.537  -5.165
  719   HH12  ARG  93          2HH1      ARG  93  14.848  11.574  -4.531
  720   HH21  ARG  93          1HH2      ARG  93  13.152  10.682  -1.585
  721   HH22  ARG  93          2HH2      ARG  93  14.623  10.512  -2.512
  722    H    ARG  94           H        ARG  94   9.546  17.326  -2.781
  723    HA   ARG  94           HA       ARG  94   8.647  18.907  -4.114
  724    HB2  ARG  94           HB2      ARG  94   9.369  17.038  -5.682
  725    HB3  ARG  94           HB3      ARG  94   7.655  16.631  -5.849
  726    HG2  ARG  94           HG2      ARG  94   7.212  18.944  -6.690
  727    HG3  ARG  94           HG3      ARG  94   8.930  19.337  -6.451
  728    HD2  ARG  94           2HD      ARG  94   8.535  18.812  -8.790
  729    HD3  ARG  94           3HD      ARG  94   9.543  17.549  -8.061
  730    HE   ARG  94           HE       ARG  94   6.791  16.798  -7.870
  731   HH11  ARG  94          1HH1      ARG  94   9.358  17.158 -10.273
  732   HH12  ARG  94          2HH1      ARG  94   8.693  15.940 -11.340
  733   HH21  ARG  94          1HH2      ARG  94   5.944  15.222  -9.280
  734   HH22  ARG  94          2HH2      ARG  94   6.761  14.858 -10.783
  735    H    GLY  95           H        GLY  95   6.957  18.008  -1.916
  736    HA2  GLY  95           2HA      GLY  95   4.601  19.469  -2.453
  737    HA3  GLY  95           3HA      GLY  95   4.227  17.751  -2.657
  738    H5'    A  96           H5'        A  96   4.172  -7.529   1.490
  739   H5''    A  96          H5''        A  96   3.559  -6.352   0.325
  740    H4'    A  96           H4'        A  96   3.598  -5.983   3.369
  741    H3'    A  96           H3'        A  96   1.743  -7.342   1.552
  742    H2'    A  96           H2'        A  96  -0.083  -5.892   1.581
  743   HO2'    A  96          HO2'        A  96  -0.055  -5.787   3.944
  744    H1'    A  96           H1'        A  96   1.089  -3.465   1.740
  745    H8     A  96           H8         A  96   3.655  -4.267  -0.410
  746    H61    A  96           H61        A  96  -0.221  -5.476  -5.096
  747    H62    A  96           H62        A  96   1.442  -5.102  -4.663
  748    H2     A  96           H2         A  96  -2.553  -5.551  -1.327
  749   HO5'    A  96          H5T         A  96   5.140  -4.874   1.217
  750    H5'    U  97           H5'        U  97  -0.017  -8.955   2.208
  751   H5''    U  97          H5''        U  97   0.068 -10.518   3.030
  752    H4'    U  97           H4'        U  97   1.291 -11.429   0.994
  753    H3'    U  97           H3'        U  97   1.277  -8.712   0.200
  754    H2'    U  97           H2'        U  97  -0.533  -8.489  -1.256
  755   HO2'    U  97          HO2'        U  97   0.588 -10.006  -2.711
  756    H1'    U  97           H1'        U  97  -2.081 -10.721  -0.851
  757    H3     U  97           H3         U  97  -5.123  -8.989   1.987
  758    H5     U  97           H5         U  97  -2.033  -6.155   1.923
  759    H6     U  97           H6         U  97  -0.660  -7.760   0.698
  760    H5'    C  98           H5'        C  98   4.360  -9.744   0.208
  761   H5''    C  98          H5''        C  98   5.090  -8.325  -0.561
  762    H4'    C  98           H4'        C  98   6.835  -9.664   0.345
  763    H3'    C  98           H3'        C  98   6.979  -8.868  -2.259
  764    H2'    C  98           H2'        C  98   5.803 -10.764  -3.148
  765   HO2'    C  98          HO2'        C  98   8.579 -11.384  -3.178
  766    H1'    C  98           H1'        C  98   7.429 -12.696  -1.532
  767    H41    C  98           H41        C  98   2.600 -16.173  -3.811
  768    H42    C  98           H42        C  98   1.425 -15.148  -3.003
  769    H5     C  98           H5         C  98   2.070 -13.155  -1.733
  770    H6     C  98           H6         C  98   3.963 -11.774  -1.049
  771    H5'    A  99           H5'        A  99   9.641  -5.954  -0.981
  772   H5''    A  99          H5''        A  99   8.185  -6.429  -1.879
  773    H4'    A  99           H4'        A  99  10.833  -5.954  -3.291
  774    H3'    A  99           H3'        A  99   9.600  -3.904  -1.860
  775    H2'    A  99           H2'        A  99   7.543  -4.040  -3.109
  776   HO2'    A  99          HO2'        A  99   8.946  -1.950  -3.608
  777    H1'    A  99           H1'        A  99   9.321  -4.458  -5.519
  778    H8     A  99           H8         A  99   7.581  -3.522  -7.121
  779    H61    A  99           H61        A  99   2.206  -6.638  -6.881
  780    H62    A  99           H62        A  99   3.134  -5.449  -7.783
  781    H2     A  99           H2         A  99   4.718  -7.918  -3.455
  782    H5'    A 100           H5'        A 100  13.516  -3.478  -3.604
  783   H5''    A 100          H5''        A 100  14.444  -1.990  -3.418
  784    H4'    A 100           H4'        A 100  14.995  -3.399  -5.491
  785    H3'    A 100           H3'        A 100  15.041  -0.674  -5.055
  786    H2'    A 100           H2'        A 100  12.905  -0.288  -6.027
  787   HO2'    A 100          HO2'        A 100  13.306   0.538  -8.167
  788    H1'    A 100           H1'        A 100  13.639  -2.218  -8.230
  789    H8     A 100           H8         A 100  10.605  -1.978  -5.852
  790    H61    A 100           H61        A 100   7.426  -0.251 -10.921
  791    H62    A 100           H62        A 100   7.279  -0.707  -9.233
  792    H2     A 100           H2         A 100  11.708  -0.571 -12.002
  793    H5'    A 101           H5'        A 101  16.596   0.983  -6.983
  794   H5''    A 101          H5''        A 101  18.091   0.424  -7.750
  795    H4'    A 101           H4'        A 101  18.181   2.799  -7.292
  796    H3'    A 101           H3'        A 101  20.218   1.043  -6.768
  797   HO3'    A 101          H3T         A 101  20.506   3.166  -7.583
  798    H2'    A 101           H2'        A 101  19.729   0.655  -4.512
  799   HO2'    A 101          HO2'        A 101  21.856   1.581  -4.585
  800    H1'    A 101           H1'        A 101  19.133   3.557  -3.992
  801    H8     A 101           H8         A 101  18.130  -0.137  -3.466
  802    H61    A 101           H61        A 101  16.126   1.780   2.097
  803    H62    A 101           H62        A 101  16.375   0.376   1.074
  804    H2     A 101           H2         A 101  17.386   5.338  -0.214
  Start of MODEL    3
    1    H1   MET   1           H1       MET   1  -2.025   4.943  -1.419
    2    H2   MET   1           H2       MET   1  -0.688   4.869  -0.458
    3    H3   MET   1           H3       MET   1  -1.923   3.795  -0.249
    4    HA   MET   1           HA       MET   1  -0.208   3.977  -2.635
    5    HB2  MET   1           HB2      MET   1   0.988   3.074  -0.674
    6    HB3  MET   1           HB3      MET   1  -0.283   1.858  -0.444
    7    HG2  MET   1           HG2      MET   1   1.653   0.942  -1.669
    8    HG3  MET   1           HG3      MET   1   0.186   0.909  -2.655
    9    HE1  MET   1           HE1      MET   1   2.759   0.338  -4.078
   10    HE2  MET   1           HE2      MET   1   1.206   0.590  -4.909
   11    HE3  MET   1           HE3      MET   1   2.669   1.417  -5.493
   12    H    VAL   2           H        VAL   2  -1.926   4.079  -4.026
   13    HA   VAL   2           HA       VAL   2  -3.208   1.453  -4.497
   14    HB   VAL   2           HB       VAL   2  -4.946   2.946  -3.733
   15   HG11  VAL   2          1HG1      VAL   2  -3.906   4.960  -5.774
   16   HG12  VAL   2          HG21      VAL   2  -5.385   5.139  -4.807
   17   HG13  VAL   2          HG31      VAL   2  -3.803   5.111  -4.008
   18   HG21  VAL   2          HG32      VAL   2  -5.346   1.591  -5.870
   19   HG22  VAL   2          1HG2      VAL   2  -6.434   2.984  -5.596
   20   HG23  VAL   2          HG22      VAL   2  -5.098   3.124  -6.750
   21    H    GLU   3           H        GLU   3  -0.655   2.913  -5.211
   22    HA   GLU   3           HA       GLU   3  -1.041   3.901  -7.892
   23    HB2  GLU   3           HB2      GLU   3   1.510   3.408  -6.296
   24    HB3  GLU   3           HB3      GLU   3   1.357   4.421  -7.741
   25    HG2  GLU   3           HG2      GLU   3  -0.001   4.900  -5.061
   26    HG3  GLU   3           HG3      GLU   3   1.394   5.782  -5.709
   27    H    ALA   4           H        ALA   4  -0.478   3.177  -9.749
   28    HA   ALA   4           HA       ALA   4   0.761   0.488  -9.996
   29    HB1  ALA   4           1HB      ALA   4  -1.687   0.301 -10.234
   30    HB2  ALA   4           HB2      ALA   4  -1.675   1.571 -11.474
   31    HB3  ALA   4           HB3      ALA   4  -0.871   0.013 -11.792
   32    H    ASP   5           H        ASP   5   2.533   0.755 -10.980
   33    HA   ASP   5           HA       ASP   5   3.338   3.242 -12.144
   34    HB2  ASP   5           HB2      ASP   5   4.711   1.766 -10.695
   35    HB3  ASP   5           HB3      ASP   5   4.783   0.581 -12.001
   36    H    ARG   6           H        ARG   6   1.323   2.632 -13.702
   37    HA   ARG   6           HA       ARG   6   0.560   2.527 -15.772
   38    HB2  ARG   6           HB2      ARG   6   3.455   2.902 -16.581
   39    HB3  ARG   6           HB3      ARG   6   2.050   3.095 -17.636
   40    HG2  ARG   6           HG2      ARG   6   1.164   4.873 -16.145
   41    HG3  ARG   6           HG3      ARG   6   2.586   4.690 -15.093
   42    HD2  ARG   6           2HD      ARG   6   2.940   6.576 -16.581
   43    HD3  ARG   6           3HD      ARG   6   4.062   5.274 -16.994
   44    HE   ARG   6           HE       ARG   6   1.661   5.073 -18.568
   45   HH11  ARG   6          1HH1      ARG   6   4.647   6.947 -18.276
   46   HH12  ARG   6          2HH1      ARG   6   4.678   7.380 -19.969
   47   HH21  ARG   6          1HH2      ARG   6   1.720   5.667 -20.769
   48   HH22  ARG   6          2HH2      ARG   6   3.022   6.659 -21.375
   49    HA   PRO   7           HA       PRO   7   0.309  -1.590 -17.236
   50    HB2  PRO   7           HB2      PRO   7   0.015  -0.227 -19.912
   51    HB3  PRO   7           HB3      PRO   7  -0.989  -1.557 -19.241
   52    HG2  PRO   7           HG2      PRO   7  -1.890   0.957 -19.243
   53    HG3  PRO   7           HG3      PRO   7  -2.060  -0.017 -17.737
   54    HD2  PRO   7           2HD      PRO   7   0.027   2.084 -18.389
   55    HD3  PRO   7           3HD      PRO   7  -0.889   1.824 -16.869
   56    H    GLY   8           H        GLY   8   1.594  -3.190 -18.265
   57    HA2  GLY   8           2HA      GLY   8   2.982  -3.897 -20.060
   58    HA3  GLY   8           3HA      GLY   8   3.653  -2.249 -20.185
   59    H    LYS   9           H        LYS   9   3.641  -2.352 -17.001
   60    HA   LYS   9           HA       LYS   9   6.312  -3.643 -16.964
   61    HB2  LYS   9           HB2      LYS   9   6.274  -1.272 -16.315
   62    HB3  LYS   9           HB3      LYS   9   5.146  -1.664 -14.992
   63    HG2  LYS   9           HG2      LYS   9   6.806  -3.258 -14.059
   64    HG3  LYS   9           HG3      LYS   9   7.914  -2.899 -15.399
   65    HD2  LYS   9           2HD      LYS   9   6.933  -0.854 -13.368
   66    HD3  LYS   9           3HD      LYS   9   8.469  -1.739 -13.255
   67    HE2  LYS   9           HE2      LYS   9   9.169  -0.811 -15.447
   68    HE3  LYS   9           HE3      LYS   9   7.640   0.078 -15.557
   69    HZ1  LYS   9           3HZ      LYS   9   9.632   0.434 -13.428
   70    HZ2  LYS   9           1HZ      LYS   9   9.440   1.444 -14.720
   71    HZ3  LYS   9           2HZ      LYS   9   8.244   1.289 -13.603
   72    H    LEU  10           H        LEU  10   6.659  -5.435 -15.819
   73    HA   LEU  10           HA       LEU  10   4.363  -6.456 -14.201
   74    HB2  LEU  10           HB2      LEU  10   6.492  -7.838 -15.840
   75    HB3  LEU  10           HB3      LEU  10   5.406  -8.726 -14.824
   76    HG   LEU  10           HG       LEU  10   4.627  -7.011 -17.232
   77   HD11  LEU  10          1HD1      LEU  10   4.137  -9.178 -18.245
   78   HD12  LEU  10          2HD1      LEU  10   5.762  -9.296 -17.514
   79   HD13  LEU  10          3HD1      LEU  10   4.368 -10.009 -16.688
   80   HD21  LEU  10          3HD2      LEU  10   2.892  -8.607 -15.314
   81   HD22  LEU  10          1HD2      LEU  10   2.812  -6.851 -15.656
   82   HD23  LEU  10          2HD2      LEU  10   2.363  -8.026 -16.905
   83    H    PHE  11           H        PHE  11   4.803  -7.569 -12.312
   84    HA   PHE  11           HA       PHE  11   7.494  -7.156 -11.097
   85    HB2  PHE  11           HB2      PHE  11   5.771  -6.106  -9.784
   86    HB3  PHE  11           HB3      PHE  11   4.700  -7.508  -9.961
   87    HD1  PHE  11           HD1      PHE  11   7.998  -6.465  -8.554
   88    HD2  PHE  11           HD2      PHE  11   4.717  -9.236  -8.357
   89    HE1  PHE  11           HE1      PHE  11   8.932  -7.424  -6.463
   90    HE2  PHE  11           HE2      PHE  11   5.658 -10.197  -6.269
   91    HZ   PHE  11           HZ       PHE  11   7.787  -9.298  -5.343
   92    H    ILE  12           H        ILE  12   8.688  -8.938 -10.705
   93    HA   ILE  12           HA       ILE  12   7.391 -11.576 -11.219
   94    HB   ILE  12           HB       ILE  12  10.285 -10.957 -11.823
   95   HG12  ILE  12          HG21      ILE  12   9.135  -9.291 -13.167
   96   HG13  ILE  12          HG31      ILE  12   9.811 -10.576 -14.157
   97   HG21  ILE  12          1HG2      ILE  12   8.259 -12.958 -12.887
   98   HG22  ILE  12          HG22      ILE  12   9.968 -12.855 -13.369
   99   HG23  ILE  12          HG32      ILE  12   9.531 -13.284 -11.692
  100   HD11  ILE  12          3HD1      ILE  12   6.878 -10.179 -13.460
  101   HD12  ILE  12          1HD1      ILE  12   7.675  -9.975 -15.036
  102   HD13  ILE  12          2HD1      ILE  12   7.511 -11.593 -14.322
  103    H    GLY  13           H        GLY  13   7.049 -11.832  -8.869
  104    HA2  GLY  13           2HA      GLY  13   9.508 -11.732  -7.213
  105    HA3  GLY  13           3HA      GLY  13   7.859 -11.828  -6.625
  106    H    GLY  14           H        GLY  14  10.388 -13.541  -6.175
  107    HA2  GLY  14           2HA      GLY  14  10.152 -15.672  -5.130
  108    HA3  GLY  14           3HA      GLY  14   8.882 -16.098  -6.287
  109    H    LEU  15           H        LEU  15  11.477 -14.480  -7.793
  110    HA   LEU  15           HA       LEU  15  12.142 -16.709  -9.445
  111    HB2  LEU  15           HB2      LEU  15  13.613 -14.107  -8.883
  112    HB3  LEU  15           HB3      LEU  15  13.944 -15.234 -10.234
  113    HG   LEU  15           HG       LEU  15  11.207 -13.992  -9.943
  114   HD11  LEU  15          1HD1      LEU  15  13.678 -12.911 -11.375
  115   HD12  LEU  15          2HD1      LEU  15  12.018 -12.322 -11.620
  116   HD13  LEU  15          3HD1      LEU  15  12.804 -12.127 -10.035
  117   HD21  LEU  15          3HD2      LEU  15  12.887 -15.022 -12.278
  118   HD22  LEU  15          1HD2      LEU  15  11.677 -15.993 -11.418
  119   HD23  LEU  15          2HD2      LEU  15  11.171 -14.554 -12.342
  120    H    ASN  16           H        ASN  16  14.310 -17.623  -9.773
  121    HA   ASN  16           HA       ASN  16  15.410 -18.666  -7.348
  122    HB2  ASN  16           HB2      ASN  16  15.134 -19.820  -9.527
  123    HB3  ASN  16           HB3      ASN  16  16.437 -18.800 -10.185
  124   HD21  ASN  16          2HD2      ASN  16  17.187 -21.063 -10.625
  125   HD22  ASN  16          1HD2      ASN  16  18.151 -21.826  -9.413
  126    H    THR  17           H        THR  17  17.723 -18.474  -6.756
  127    HA   THR  17           HA       THR  17  18.700 -15.746  -6.812
  128    HB   THR  17           HB       THR  17  20.563 -16.658  -5.506
  129    HG1  THR  17           1HG      THR  17  20.791 -18.657  -6.555
  130   HG21  THR  17          1HG2      THR  17  19.287 -17.565  -3.625
  131   HG22  THR  17          HG22      THR  17  18.356 -16.249  -4.393
  132   HG23  THR  17          HG32      THR  17  17.927 -17.953  -4.699
  133    H    GLU  18           H        GLU  18  18.685 -18.132  -9.096
  134    HA   GLU  18           HA       GLU  18  21.437 -17.687 -10.093
  135    HB2  GLU  18           HB2      GLU  18  19.423 -19.770 -10.978
  136    HB3  GLU  18           HB3      GLU  18  21.182 -19.817 -11.168
  137    HG2  GLU  18           HG2      GLU  18  19.652 -19.964  -8.525
  138    HG3  GLU  18           HG3      GLU  18  20.317 -21.340  -9.361
  139    H    THR  19           H        THR  19  18.277 -16.598 -10.553
  140    HA   THR  19           HA       THR  19  18.256 -16.545 -13.465
  141    HB   THR  19           HB       THR  19  16.462 -15.130 -11.459
  142    HG1  THR  19           1HG      THR  19  16.188 -17.622 -12.774
  143   HG21  THR  19          1HG2      THR  19  16.089 -15.851 -14.397
  144   HG22  THR  19          HG22      THR  19  14.828 -15.178 -13.336
  145   HG23  THR  19          HG32      THR  19  16.260 -14.212 -13.718
  146    H    ASN  20           H        ASN  20  18.606 -14.793 -14.790
  147    HA   ASN  20           HA       ASN  20  19.358 -12.218 -13.507
  148    HB2  ASN  20           HB2      ASN  20  20.809 -12.973 -15.976
  149    HB3  ASN  20           HB3      ASN  20  21.343 -11.972 -14.628
  150   HD21  ASN  20          2HD2      ASN  20  21.094 -15.173 -15.990
  151   HD22  ASN  20          1HD2      ASN  20  22.093 -15.990 -14.802
  152    H    GLU  21           H        GLU  21  19.901 -10.830 -15.770
  153    HA   GLU  21           HA       GLU  21  17.229 -10.170 -16.629
  154    HB2  GLU  21           HB2      GLU  21  19.988  -9.255 -17.495
  155    HB3  GLU  21           HB3      GLU  21  18.473  -8.528 -18.087
  156    HG2  GLU  21           HG2      GLU  21  17.822  -7.880 -15.857
  157    HG3  GLU  21           HG3      GLU  21  19.122  -8.825 -15.144
  158    H    LYS  22           H        LYS  22  19.943 -11.988 -18.132
  159    HA   LYS  22           HA       LYS  22  18.838 -11.950 -20.764
  160    HB2  LYS  22           HB2      LYS  22  21.181 -12.439 -20.291
  161    HB3  LYS  22           HB3      LYS  22  20.742 -13.890 -19.378
  162    HG2  LYS  22           HG2      LYS  22  21.549 -14.363 -21.699
  163    HG3  LYS  22           HG3      LYS  22  19.933 -15.003 -21.372
  164    HD2  LYS  22           2HD      LYS  22  18.896 -13.128 -22.551
  165    HD3  LYS  22           3HD      LYS  22  20.478 -12.355 -22.778
  166    HE2  LYS  22           HE2      LYS  22  21.238 -14.312 -24.102
  167    HE3  LYS  22           HE3      LYS  22  19.657 -15.073 -23.881
  168    HZ1  LYS  22           3HZ      LYS  22  19.815 -13.937 -25.988
  169    HZ2  LYS  22           1HZ      LYS  22  18.669 -13.224 -25.049
  170    HZ3  LYS  22           2HZ      LYS  22  20.134 -12.507 -25.248
  171    H    ALA  23           H        ALA  23  18.153 -13.909 -17.917
  172    HA   ALA  23           HA       ALA  23  16.785 -15.972 -19.519
  173    HB1  ALA  23           1HB      ALA  23  18.098 -16.607 -17.520
  174    HB2  ALA  23           HB2      ALA  23  17.074 -15.561 -16.510
  175    HB3  ALA  23           HB3      ALA  23  16.382 -16.997 -17.301
  176    H    LEU  24           H        LEU  24  16.185 -12.975 -17.968
  177    HA   LEU  24           HA       LEU  24  13.334 -13.413 -17.480
  178    HB2  LEU  24           HB2      LEU  24  15.587 -11.664 -16.694
  179    HB3  LEU  24           HB3      LEU  24  14.154 -10.713 -16.983
  180    HG   LEU  24           HG       LEU  24  14.175 -13.262 -15.329
  181   HD11  LEU  24          1HD1      LEU  24  15.777 -11.673 -14.317
  182   HD12  LEU  24          2HD1      LEU  24  14.525 -10.405 -14.320
  183   HD13  LEU  24          3HD1      LEU  24  14.328 -11.860 -13.306
  184   HD21  LEU  24          3HD2      LEU  24  12.338 -10.823 -15.301
  185   HD22  LEU  24          1HD2      LEU  24  11.988 -12.363 -16.117
  186   HD23  LEU  24          2HD2      LEU  24  12.127 -12.309 -14.336
  187    H    GLU  25           H        GLU  25  15.521 -11.864 -19.779
  188    HA   GLU  25           HA       GLU  25  13.329 -10.551 -21.185
  189    HB2  GLU  25           HB2      GLU  25  16.250 -11.106 -21.911
  190    HB3  GLU  25           HB3      GLU  25  15.121 -10.227 -22.968
  191    HG2  GLU  25           HG2      GLU  25  14.671  -8.652 -21.137
  192    HG3  GLU  25           HG3      GLU  25  15.921  -9.431 -20.152
  193    H    ALA  26           H        ALA  26  15.007 -13.581 -21.160
  194    HA   ALA  26           HA       ALA  26  14.265 -14.413 -23.852
  195    HB1  ALA  26           1HB      ALA  26  15.327 -16.549 -23.102
  196    HB2  ALA  26           HB2      ALA  26  16.354 -15.122 -22.813
  197    HB3  ALA  26           HB3      ALA  26  15.449 -15.866 -21.466
  198    H    VAL  27           H        VAL  27  12.873 -14.583 -20.645
  199    HA   VAL  27           HA       VAL  27  11.118 -16.837 -21.403
  200    HB   VAL  27           HB       VAL  27  12.536 -16.724 -19.368
  201   HG11  VAL  27          1HG1      VAL  27  10.371 -14.912 -18.311
  202   HG12  VAL  27          HG21      VAL  27  11.836 -15.472 -17.452
  203   HG13  VAL  27          HG31      VAL  27  11.994 -14.349 -18.830
  204   HG21  VAL  27          HG32      VAL  27   9.530 -17.014 -18.929
  205   HG22  VAL  27          1HG2      VAL  27  10.620 -18.288 -19.557
  206   HG23  VAL  27          HG22      VAL  27  10.811 -17.679 -17.884
  207    H    PHE  28           H        PHE  28  11.002 -13.440 -20.366
  208    HA   PHE  28           HA       PHE  28   8.058 -13.444 -20.679
  209    HB2  PHE  28           HB2      PHE  28   9.973 -11.298 -19.735
  210    HB3  PHE  28           HB3      PHE  28   8.235 -11.071 -19.957
  211    HD1  PHE  28           HD1      PHE  28   6.582 -12.377 -18.628
  212    HD2  PHE  28           HD2      PHE  28  10.792 -12.447 -17.789
  213    HE1  PHE  28           HE1      PHE  28   6.119 -13.322 -16.381
  214    HE2  PHE  28           HE2      PHE  28  10.346 -13.415 -15.562
  215    HZ   PHE  28           HZ       PHE  28   7.999 -13.832 -14.840
  216    H    GLY  29           H        GLY  29  10.812 -12.961 -22.627
  217    HA2  GLY  29           2HA      GLY  29   9.613 -11.007 -24.432
  218    HA3  GLY  29           3HA      GLY  29  11.052 -11.997 -24.748
  219    H    LYS  30           H        LYS  30   8.834 -14.137 -23.660
  220    HA   LYS  30           HA       LYS  30   8.289 -15.200 -26.310
  221    HB2  LYS  30           HB2      LYS  30   7.487 -16.108 -23.491
  222    HB3  LYS  30           HB3      LYS  30   7.400 -17.100 -24.959
  223    HG2  LYS  30           HG2      LYS  30   9.826 -16.947 -25.226
  224    HG3  LYS  30           HG3      LYS  30   9.966 -15.875 -23.835
  225    HD2  LYS  30           2HD      LYS  30  10.593 -18.201 -23.245
  226    HD3  LYS  30           3HD      LYS  30   9.258 -17.581 -22.284
  227    HE2  LYS  30           HE2      LYS  30   8.790 -19.852 -22.905
  228    HE3  LYS  30           HE3      LYS  30   7.637 -18.769 -23.699
  229    HZ1  LYS  30           3HZ      LYS  30  10.035 -19.939 -24.971
  230    HZ2  LYS  30           1HZ      LYS  30   8.492 -20.441 -25.216
  231    HZ3  LYS  30           2HZ      LYS  30   8.948 -18.949 -25.713
  232    H    TYR  31           H        TYR  31   6.803 -13.027 -24.251
  233    HA   TYR  31           HA       TYR  31   4.065 -13.633 -25.297
  234    HB2  TYR  31           HB2      TYR  31   4.980 -12.163 -22.808
  235    HB3  TYR  31           HB3      TYR  31   3.298 -12.456 -23.264
  236    HD1  TYR  31           HD2      TYR  31   2.628 -14.984 -23.511
  237    HD2  TYR  31           HD1      TYR  31   6.186 -13.637 -21.513
  238    HE1  TYR  31           HE2      TYR  31   2.828 -17.190 -22.395
  239    HE2  TYR  31           HE1      TYR  31   6.379 -15.843 -20.355
  240    HH   TYR  31           HH       TYR  31   5.551 -18.002 -20.235
  241    H    GLY  32           H        GLY  32   6.647 -11.267 -25.311
  242    HA2  GLY  32           2HA      GLY  32   5.340  -9.620 -27.249
  243    HA3  GLY  32           3HA      GLY  32   5.234  -8.864 -25.636
  244    H    ARG  33           H        ARG  33   6.571  -7.741 -27.874
  245    HA   ARG  33           HA       ARG  33   9.391  -8.272 -27.491
  246    HB2  ARG  33           HB2      ARG  33   9.838  -6.522 -29.012
  247    HB3  ARG  33           HB3      ARG  33   8.423  -7.390 -29.625
  248    HG2  ARG  33           HG2      ARG  33   6.954  -5.610 -28.670
  249    HG3  ARG  33           HG3      ARG  33   8.420  -4.756 -28.107
  250    HD2  ARG  33           2HD      ARG  33   9.245  -4.626 -30.410
  251    HD3  ARG  33           3HD      ARG  33   7.776  -5.439 -30.996
  252    HE   ARG  33           HE       ARG  33   7.164  -3.086 -29.420
  253   HH11  ARG  33          1HH1      ARG  33   8.158  -4.131 -32.643
  254   HH12  ARG  33          2HH1      ARG  33   7.521  -2.704 -33.426
  255   HH21  ARG  33          1HH2      ARG  33   6.364  -1.235 -30.459
  256   HH22  ARG  33          2HH2      ARG  33   6.506  -1.070 -32.195
  257    H    ILE  34           H        ILE  34  10.587  -7.663 -26.010
  258    HA   ILE  34           HA       ILE  34   9.614  -5.998 -23.805
  259    HB   ILE  34           HB       ILE  34  12.185  -7.527 -24.302
  260   HG12  ILE  34          HG21      ILE  34   9.757  -7.926 -22.492
  261   HG13  ILE  34          HG31      ILE  34  10.141  -8.857 -23.944
  262   HG21  ILE  34          1HG2      ILE  34  12.653  -5.544 -22.884
  263   HG22  ILE  34          HG22      ILE  34  11.344  -6.056 -21.779
  264   HG23  ILE  34          HG32      ILE  34  12.809  -7.052 -21.998
  265   HD11  ILE  34          3HD1      ILE  34  11.755  -8.791 -21.366
  266   HD12  ILE  34          1HD1      ILE  34  10.782 -10.136 -21.978
  267   HD13  ILE  34          2HD1      ILE  34  12.245  -9.638 -22.860
  268    H    VAL  35           H        VAL  35  10.317  -4.032 -23.148
  269    HA   VAL  35           HA       VAL  35  12.057  -2.545 -25.051
  270    HB   VAL  35           HB       VAL  35  10.571  -0.787 -23.328
  271   HG11  VAL  35          1HG1      VAL  35  10.365  -1.365 -26.308
  272   HG12  VAL  35          HG21      VAL  35   9.783   0.091 -25.481
  273   HG13  VAL  35          HG31      VAL  35  11.529  -0.252 -25.530
  274   HG21  VAL  35          HG32      VAL  35   8.815  -2.739 -24.881
  275   HG22  VAL  35          1HG2      VAL  35   8.847  -2.528 -23.111
  276   HG23  VAL  35          HG22      VAL  35   8.281  -1.212 -24.148
  277    H    GLU  36           H        GLU  36  11.546  -3.598 -21.754
  278    HA   GLU  36           HA       GLU  36  14.268  -2.833 -21.077
  279    HB2  GLU  36           HB2      GLU  36  13.076  -0.718 -20.627
  280    HB3  GLU  36           HB3      GLU  36  11.902  -1.579 -19.612
  281    HG2  GLU  36           HG2      GLU  36  13.636  -2.167 -18.010
  282    HG3  GLU  36           HG3      GLU  36  14.886  -1.510 -19.081
  283    H    VAL  37           H        VAL  37  15.026  -4.044 -19.266
  284    HA   VAL  37           HA       VAL  37  12.998  -5.556 -17.748
  285    HB   VAL  37           HB       VAL  37  15.163  -6.769 -19.419
  286   HG11  VAL  37          1HG1      VAL  37  15.334  -8.734 -17.956
  287   HG12  VAL  37          HG21      VAL  37  16.019  -7.302 -17.163
  288   HG13  VAL  37          HG31      VAL  37  14.409  -7.895 -16.692
  289   HG21  VAL  37          HG32      VAL  37  13.470  -8.617 -19.419
  290   HG22  VAL  37          1HG2      VAL  37  12.497  -7.707 -18.258
  291   HG23  VAL  37          HG22      VAL  37  12.755  -7.061 -19.900
  292    H    LEU  38           H        LEU  38  13.476  -5.958 -15.665
  293    HA   LEU  38           HA       LEU  38  15.989  -4.768 -14.521
  294    HB2  LEU  38           HB2      LEU  38  13.115  -4.606 -13.904
  295    HB3  LEU  38           HB3      LEU  38  14.142  -4.761 -12.493
  296    HG   LEU  38           HG       LEU  38  14.575  -2.628 -14.635
  297   HD11  LEU  38          1HD1      LEU  38  13.243  -2.451 -11.899
  298   HD12  LEU  38          2HD1      LEU  38  13.615  -1.070 -12.963
  299   HD13  LEU  38          3HD1      LEU  38  12.425  -2.284 -13.473
  300   HD21  LEU  38          3HD2      LEU  38  15.978  -1.565 -12.912
  301   HD22  LEU  38          1HD2      LEU  38  15.679  -2.933 -11.820
  302   HD23  LEU  38          2HD2      LEU  38  16.601  -3.176 -13.326
  303    H    LEU  39           H        LEU  39  16.894  -5.899 -12.821
  304    HA   LEU  39           HA       LEU  39  15.564  -8.299 -11.882
  305    HB2  LEU  39           HB2      LEU  39  16.799  -9.097 -13.837
  306    HB3  LEU  39           HB3      LEU  39  18.271  -8.286 -13.293
  307    HG   LEU  39           HG       LEU  39  18.064 -10.822 -13.063
  308   HD11  LEU  39          1HD1      LEU  39  19.859  -9.430 -12.070
  309   HD12  LEU  39          2HD1      LEU  39  18.877  -9.261 -10.587
  310   HD13  LEU  39          3HD1      LEU  39  19.463 -10.861 -11.092
  311   HD21  LEU  39          3HD2      LEU  39  16.552 -10.108 -10.531
  312   HD22  LEU  39          1HD2      LEU  39  15.850 -10.880 -11.980
  313   HD23  LEU  39          2HD2      LEU  39  17.114 -11.714 -11.049
  314    H    MET  40           H        MET  40  15.778  -8.172  -9.683
  315    HA   MET  40           HA       MET  40  17.619  -6.056  -8.783
  316    HB2  MET  40           HB2      MET  40  15.540  -7.434  -7.079
  317    HB3  MET  40           HB3      MET  40  16.300  -5.865  -6.840
  318    HG2  MET  40           HG2      MET  40  14.051  -6.680  -8.617
  319    HG3  MET  40           HG3      MET  40  14.228  -5.243  -7.629
  320    HE1  MET  40           HE3      MET  40  16.699  -3.176 -10.039
  321    HE2  MET  40           HE1      MET  40  15.731  -3.004  -8.552
  322    HE3  MET  40           HE2      MET  40  17.063  -4.181  -8.608
  323    H    LYS  41           H        LYS  41  19.324  -6.343  -7.422
  324    HA   LYS  41           HA       LYS  41  19.632  -8.902  -6.035
  325    HB2  LYS  41           HB2      LYS  41  22.174  -8.700  -6.954
  326    HB3  LYS  41           HB3      LYS  41  20.944  -9.775  -7.623
  327    HG2  LYS  41           HG2      LYS  41  20.428  -8.286  -9.397
  328    HG3  LYS  41           HG3      LYS  41  21.425  -6.978  -8.705
  329    HD2  LYS  41           2HD      LYS  41  23.456  -8.284  -9.064
  330    HD3  LYS  41           3HD      LYS  41  22.504  -9.681  -9.607
  331    HE2  LYS  41           HE2      LYS  41  21.611  -8.324 -11.492
  332    HE3  LYS  41           HE3      LYS  41  22.563  -6.939 -10.946
  333    HZ1  LYS  41           3HZ      LYS  41  24.552  -8.208 -11.350
  334    HZ2  LYS  41           1HZ      LYS  41  23.681  -9.523 -11.815
  335    HZ3  LYS  41           2HZ      LYS  41  23.639  -8.147 -12.718
  336    H    ASP  42           H        ASP  42  21.158  -8.906  -4.395
  337    HA   ASP  42           HA       ASP  42  21.427  -6.495  -2.918
  338    HB2  ASP  42           HB2      ASP  42  21.422  -9.026  -2.241
  339    HB3  ASP  42           HB3      ASP  42  23.159  -8.933  -2.554
  340    H    ARG  43           H        ARG  43  23.570  -5.594  -2.156
  341    HA   ARG  43           HA       ARG  43  25.458  -5.415  -4.457
  342    HB2  ARG  43           HB2      ARG  43  25.948  -3.157  -3.714
  343    HB3  ARG  43           HB3      ARG  43  24.228  -3.376  -4.083
  344    HG2  ARG  43           HG2      ARG  43  23.752  -3.622  -1.641
  345    HG3  ARG  43           HG3      ARG  43  25.473  -3.379  -1.297
  346    HD2  ARG  43           2HD      ARG  43  24.285  -1.280  -1.003
  347    HD3  ARG  43           3HD      ARG  43  25.364  -1.166  -2.418
  348    HE   ARG  43           HE       ARG  43  22.777  -2.019  -3.263
  349   HH11  ARG  43          1HH1      ARG  43  24.398   0.864  -2.011
  350   HH12  ARG  43          2HH1      ARG  43  23.312   1.967  -2.823
  351   HH21  ARG  43          1HH2      ARG  43  21.390  -0.559  -4.324
  352   HH22  ARG  43          2HH2      ARG  43  21.606   1.163  -4.114
  353    H    GLU  44           H        GLU  44  25.139  -6.705  -1.396
  354    HA   GLU  44           HA       GLU  44  28.065  -6.550  -0.863
  355    HB2  GLU  44           HB2      GLU  44  25.750  -7.406   0.908
  356    HB3  GLU  44           HB3      GLU  44  27.455  -7.384   1.385
  357    HG2  GLU  44           HG2      GLU  44  25.806  -4.963   0.558
  358    HG3  GLU  44           HG3      GLU  44  26.268  -5.386   2.206
  359    H    THR  45           H        THR  45  25.582  -8.582  -2.116
  360    HA   THR  45           HA       THR  45  27.480 -10.884  -2.040
  361    HB   THR  45           HB       THR  45  25.663 -12.428  -1.732
  362    HG1  THR  45           1HG      THR  45  23.541 -11.629  -1.493
  363   HG21  THR  45          1HG2      THR  45  25.202 -10.118   0.177
  364   HG22  THR  45          HG22      THR  45  24.878 -11.849   0.474
  365   HG23  THR  45          HG32      THR  45  26.562 -11.270   0.304
  366    H    ASN  46           H        ASN  46  25.445  -8.770  -3.874
  367    HA   ASN  46           HA       ASN  46  24.994  -8.658  -6.083
  368    HB2  ASN  46           HB2      ASN  46  27.531  -9.326  -5.912
  369    HB3  ASN  46           HB3      ASN  46  26.986 -10.818  -6.686
  370   HD21  ASN  46          2HD2      ASN  46  25.701 -10.580  -8.734
  371   HD22  ASN  46          1HD2      ASN  46  26.179  -9.292  -9.828
  372    H    LYS  47           H        LYS  47  23.894 -10.952  -4.224
  373    HA   LYS  47           HA       LYS  47  22.949 -12.892  -6.227
  374    HB2  LYS  47           HB2      LYS  47  22.526 -12.537  -3.239
  375    HB3  LYS  47           HB3      LYS  47  21.737 -13.813  -4.175
  376    HG2  LYS  47           HG2      LYS  47  24.719 -13.448  -4.350
  377    HG3  LYS  47           HG3      LYS  47  24.023 -14.303  -2.950
  378    HD2  LYS  47           2HD      LYS  47  22.916 -15.897  -4.483
  379    HD3  LYS  47           3HD      LYS  47  23.635 -15.065  -5.881
  380    HE2  LYS  47           HE2      LYS  47  25.222 -16.258  -3.574
  381    HE3  LYS  47           HE3      LYS  47  24.912 -17.110  -5.097
  382    HZ1  LYS  47           3HZ      LYS  47  26.053 -15.348  -6.251
  383    HZ2  LYS  47           1HZ      LYS  47  26.351 -14.554  -4.839
  384    HZ3  LYS  47           2HZ      LYS  47  27.040 -16.017  -5.118
  385    H    SER  48           H        SER  48  20.895 -13.119  -6.901
  386    HA   SER  48           HA       SER  48  19.277 -10.846  -7.239
  387    HB2  SER  48           HB2      SER  48  18.409 -13.759  -7.263
  388    HB3  SER  48           HB3      SER  48  17.564 -12.394  -8.027
  389    HG   SER  48           HG       SER  48  18.910 -13.494  -9.512
  390    H    ARG  49           H        ARG  49  17.617  -9.938  -6.186
  391    HA   ARG  49           HA       ARG  49  17.263 -10.364  -3.354
  392    HB2  ARG  49           HB2      ARG  49  15.723  -8.820  -5.457
  393    HB3  ARG  49           HB3      ARG  49  15.436  -8.650  -3.717
  394    HG2  ARG  49           HG2      ARG  49  18.182  -8.159  -4.903
  395    HG3  ARG  49           HG3      ARG  49  16.923  -6.927  -5.034
  396    HD2  ARG  49           2HD      ARG  49  17.881  -8.128  -2.412
  397    HD3  ARG  49           3HD      ARG  49  18.417  -6.581  -3.131
  398    HE   ARG  49           HE       ARG  49  15.870  -7.111  -1.790
  399   HH11  ARG  49          1HH1      ARG  49  17.708  -5.020  -3.954
  400   HH12  ARG  49          2HH1      ARG  49  16.651  -3.651  -3.762
  401   HH21  ARG  49          1HH2      ARG  49  14.466  -5.292  -1.535
  402   HH22  ARG  49          2HH2      ARG  49  14.804  -3.812  -2.392
  403    H    GLY  50           H        GLY  50  16.096 -11.980  -6.096
  404    HA2  GLY  50           2HA      GLY  50  14.642 -13.808  -6.137
  405    HA3  GLY  50           3HA      GLY  50  13.980 -13.334  -4.562
  406    H    PHE  51           H        PHE  51  14.047 -10.490  -6.380
  407    HA   PHE  51           HA       PHE  51  11.565 -11.125  -7.848
  408    HB2  PHE  51           HB2      PHE  51  10.366  -9.295  -7.027
  409    HB3  PHE  51           HB3      PHE  51  10.935 -10.200  -5.636
  410    HD1  PHE  51           HD1      PHE  51  12.980  -9.274  -4.347
  411    HD2  PHE  51           HD2      PHE  51  10.829  -7.001  -7.304
  412    HE1  PHE  51           HE1      PHE  51  13.890  -7.157  -3.408
  413    HE2  PHE  51           HE2      PHE  51  11.701  -4.909  -6.330
  414    HZ   PHE  51           HZ       PHE  51  13.254  -4.976  -4.426
  415    H    ALA  52           H        ALA  52  11.029  -9.503  -9.490
  416    HA   ALA  52           HA       ALA  52  13.196  -7.738 -10.380
  417    HB1  ALA  52           1HB      ALA  52  12.358 -10.214 -11.964
  418    HB2  ALA  52           HB2      ALA  52  13.497  -8.973 -12.503
  419    HB3  ALA  52           HB3      ALA  52  13.915 -10.012 -11.122
  420    H    PHE  53           H        PHE  53  12.538  -7.047 -12.803
  421    HA   PHE  53           HA       PHE  53   9.602  -6.827 -13.047
  422    HB2  PHE  53           HB2      PHE  53  11.473  -4.412 -13.033
  423    HB3  PHE  53           HB3      PHE  53   9.770  -4.371 -13.401
  424    HD1  PHE  53           HD1      PHE  53  12.294  -5.042 -10.785
  425    HD2  PHE  53           HD2      PHE  53   8.165  -4.249 -11.635
  426    HE1  PHE  53           HE1      PHE  53  11.866  -4.733  -8.364
  427    HE2  PHE  53           HE2      PHE  53   7.713  -3.955  -9.211
  428    HZ   PHE  53           HZ       PHE  53   9.566  -4.220  -7.565
  429    H    VAL  54           H        VAL  54   8.953  -5.983 -15.193
  430    HA   VAL  54           HA       VAL  54  11.013  -5.903 -17.283
  431    HB   VAL  54           HB       VAL  54  10.612  -8.322 -17.148
  432   HG11  VAL  54          1HG1      VAL  54   7.723  -7.786 -17.389
  433   HG12  VAL  54          HG21      VAL  54   8.587  -9.366 -17.410
  434   HG13  VAL  54          HG31      VAL  54   8.663  -8.350 -15.947
  435   HG21  VAL  54          HG32      VAL  54   9.840  -8.761 -19.410
  436   HG22  VAL  54          1HG2      VAL  54   8.911  -7.250 -19.457
  437   HG23  VAL  54          HG22      VAL  54  10.681  -7.190 -19.479
  438    H    THR  55           H        THR  55  10.369  -4.678 -19.010
  439    HA   THR  55           HA       THR  55   7.577  -3.644 -18.897
  440    HB   THR  55           HB       THR  55  10.000  -2.249 -20.068
  441    HG1  THR  55           1HG      THR  55  10.102  -2.365 -17.800
  442   HG21  THR  55          1HG2      THR  55   7.904  -1.581 -21.125
  443   HG22  THR  55          HG22      THR  55   7.105  -1.427 -19.547
  444   HG23  THR  55          HG32      THR  55   8.406  -0.300 -20.014
  445    H    PHE  56           H        PHE  56   6.312  -4.316 -20.438
  446    HA   PHE  56           HA       PHE  56   7.366  -5.332 -22.994
  447    HB2  PHE  56           HB2      PHE  56   4.636  -5.225 -21.677
  448    HB3  PHE  56           HB3      PHE  56   4.900  -5.815 -23.316
  449    HD1  PHE  56           HD2      PHE  56   6.356  -6.430 -19.846
  450    HD2  PHE  56           HD1      PHE  56   5.080  -8.042 -23.631
  451    HE1  PHE  56           HE2      PHE  56   6.861  -8.707 -19.050
  452    HE2  PHE  56           HE1      PHE  56   5.513 -10.319 -22.804
  453    HZ   PHE  56           HZ       PHE  56   6.358 -10.675 -20.503
  454    H    GLU  57           H        GLU  57   6.563  -4.554 -25.031
  455    HA   GLU  57           HA       GLU  57   6.150  -1.668 -25.110
  456    HB2  GLU  57           HB2      GLU  57   6.974  -3.789 -26.865
  457    HB3  GLU  57           HB3      GLU  57   5.644  -2.938 -27.637
  458    HG2  GLU  57           HG2      GLU  57   8.006  -1.455 -26.436
  459    HG3  GLU  57           HG3      GLU  57   7.984  -2.035 -28.111
  460    H    SER  58           H        SER  58   4.099  -4.559 -25.057
  461    HA   SER  58           HA       SER  58   1.792  -2.731 -25.512
  462    HB2  SER  58           HB2      SER  58   1.868  -4.379 -27.274
  463    HB3  SER  58           HB3      SER  58   2.128  -5.689 -26.100
  464    HG   SER  58           HG       SER  58  -0.066  -5.495 -26.793
  465    HA   PRO  59           HA       PRO  59   0.980  -3.536 -21.293
  466    HB2  PRO  59           HB2      PRO  59  -1.568  -2.628 -21.075
  467    HB3  PRO  59           HB3      PRO  59  -0.220  -1.500 -21.463
  468    HG2  PRO  59           HG2      PRO  59  -2.083  -2.932 -23.379
  469    HG3  PRO  59           HG3      PRO  59  -1.794  -1.164 -23.284
  470    HD2  PRO  59           2HD      PRO  59  -0.401  -2.699 -25.048
  471    HD3  PRO  59           3HD      PRO  59   0.455  -1.428 -24.115
  472    H    ALA  60           H        ALA  60  -0.453  -5.205 -23.921
  473    HA   ALA  60           HA       ALA  60  -1.960  -6.964 -22.056
  474    HB1  ALA  60           1HB      ALA  60  -2.419  -6.463 -25.014
  475    HB2  ALA  60           HB2      ALA  60  -3.355  -7.566 -23.978
  476    HB3  ALA  60           HB3      ALA  60  -3.390  -5.816 -23.662
  477    H    ASP  61           H        ASP  61   0.744  -6.759 -24.235
  478    HA   ASP  61           HA       ASP  61   1.067  -9.628 -24.562
  479    HB2  ASP  61           HB2      ASP  61   3.026  -7.280 -24.590
  480    HB3  ASP  61           HB3      ASP  61   3.495  -8.905 -24.859
  481    H    ALA  62           H        ALA  62   1.677  -7.174 -22.104
  482    HA   ALA  62           HA       ALA  62   3.218  -8.905 -20.357
  483    HB1  ALA  62           1HB      ALA  62   3.463  -6.481 -20.316
  484    HB2  ALA  62           HB2      ALA  62   1.742  -6.281 -19.900
  485    HB3  ALA  62           HB3      ALA  62   2.838  -7.069 -18.745
  486    H    LYS  63           H        LYS  63  -0.240  -8.107 -20.847
  487    HA   LYS  63           HA       LYS  63  -1.157  -9.385 -18.425
  488    HB2  LYS  63           HB2      LYS  63  -2.495  -8.836 -21.107
  489    HB3  LYS  63           HB3      LYS  63  -3.332  -9.538 -19.710
  490    HG2  LYS  63           HG2      LYS  63  -2.915  -7.572 -18.356
  491    HG3  LYS  63           HG3      LYS  63  -1.879  -6.877 -19.620
  492    HD2  LYS  63           2HD      LYS  63  -4.110  -5.825 -19.618
  493    HD3  LYS  63           3HD      LYS  63  -3.813  -6.675 -21.134
  494    HE2  LYS  63           HE2      LYS  63  -5.096  -8.638 -20.280
  495    HE3  LYS  63           HE3      LYS  63  -5.395  -7.772 -18.762
  496    HZ1  LYS  63           3HZ      LYS  63  -7.240  -7.581 -20.265
  497    HZ2  LYS  63           1HZ      LYS  63  -6.575  -6.105 -20.012
  498    HZ3  LYS  63           2HZ      LYS  63  -6.298  -6.896 -21.425
  499    H    ASP  64           H        ASP  64  -0.486 -10.465 -21.769
  500    HA   ASP  64           HA       ASP  64  -1.663 -13.050 -21.438
  501    HB2  ASP  64           HB2      ASP  64  -1.099 -11.788 -23.584
  502    HB3  ASP  64           HB3      ASP  64   0.596 -12.182 -23.289
  503    H    ALA  65           H        ALA  65   1.559 -11.696 -20.821
  504    HA   ALA  65           HA       ALA  65   2.758 -14.269 -20.158
  505    HB1  ALA  65           1HB      ALA  65   3.618 -11.480 -19.302
  506    HB2  ALA  65           HB2      ALA  65   4.609 -12.962 -19.368
  507    HB3  ALA  65           HB3      ALA  65   4.035 -12.201 -20.870
  508    H    ALA  66           H        ALA  66   1.283 -11.544 -18.312
  509    HA   ALA  66           HA       ALA  66   1.852 -12.752 -15.778
  510    HB1  ALA  66           1HB      ALA  66  -0.157 -10.580 -16.545
  511    HB2  ALA  66           HB2      ALA  66   0.475 -10.888 -14.912
  512    HB3  ALA  66           HB3      ALA  66   1.553 -10.295 -16.204
  513    H    ARG  67           H        ARG  67  -0.375 -13.524 -18.175
  514    HA   ARG  67           HA       ARG  67  -2.204 -14.908 -16.281
  515    HB2  ARG  67           HB2      ARG  67  -2.403 -14.172 -19.218
  516    HB3  ARG  67           HB3      ARG  67  -3.573 -15.225 -18.408
  517    HG2  ARG  67           HG2      ARG  67  -4.231 -13.507 -16.869
  518    HG3  ARG  67           HG3      ARG  67  -2.899 -12.451 -17.358
  519    HD2  ARG  67           2HD      ARG  67  -4.977 -11.672 -18.359
  520    HD3  ARG  67           3HD      ARG  67  -3.881 -12.231 -19.618
  521    HE   ARG  67           HE       ARG  67  -5.320 -13.998 -20.120
  522   HH11  ARG  67          1HH1      ARG  67  -6.372 -12.410 -17.133
  523   HH12  ARG  67          2HH1      ARG  67  -7.903 -13.255 -17.095
  524   HH21  ARG  67          1HH2      ARG  67  -7.317 -15.081 -20.032
  525   HH22  ARG  67          2HH2      ARG  67  -8.435 -14.757 -18.728
  526    H    ASP  68           H        ASP  68   0.728 -15.677 -17.627
  527    HA   ASP  68           HA       ASP  68  -0.122 -18.467 -18.262
  528    HB2  ASP  68           HB2      ASP  68   1.461 -16.388 -19.708
  529    HB3  ASP  68           HB3      ASP  68   2.264 -17.904 -19.544
  530    H    MET  69           H        MET  69   2.524 -16.241 -17.499
  531    HA   MET  69           HA       MET  69   4.249 -18.288 -16.390
  532    HB2  MET  69           HB2      MET  69   4.294 -15.426 -17.253
  533    HB3  MET  69           HB3      MET  69   5.379 -15.826 -15.971
  534    HG2  MET  69           HG2      MET  69   5.123 -17.200 -18.679
  535    HG3  MET  69           HG3      MET  69   6.420 -16.083 -18.211
  536    HE1  MET  69           HE3      MET  69   8.370 -18.078 -15.519
  537    HE2  MET  69           HE1      MET  69   8.085 -16.526 -16.360
  538    HE3  MET  69           HE2      MET  69   6.876 -17.146 -15.207
  539    H    ASN  70           H        ASN  70   1.698 -16.351 -15.110
  540    HA   ASN  70           HA       ASN  70   2.902 -15.898 -12.518
  541    HB2  ASN  70           HB2      ASN  70   1.040 -14.525 -13.449
  542    HB3  ASN  70           HB3      ASN  70  -0.023 -15.930 -13.371
  543   HD21  ASN  70          2HD2      ASN  70  -1.353 -14.461 -11.998
  544   HD22  ASN  70          1HD2      ASN  70  -0.986 -14.360 -10.292
  545    H    GLY  71           H        GLY  71   3.178 -17.321 -10.919
  546    HA2  GLY  71           2HA      GLY  71   2.604 -19.033  -9.445
  547    HA3  GLY  71           3HA      GLY  71   1.303 -19.554 -10.537
  548    H    LYS  72           H        LYS  72   3.812 -19.234 -12.649
  549    HA   LYS  72           HA       LYS  72   4.600 -22.041 -12.618
  550    HB2  LYS  72           HB2      LYS  72   5.546 -19.688 -14.257
  551    HB3  LYS  72           HB3      LYS  72   5.694 -21.399 -14.646
  552    HG2  LYS  72           HG2      LYS  72   3.073 -19.867 -14.524
  553    HG3  LYS  72           HG3      LYS  72   3.901 -20.450 -15.982
  554    HD2  LYS  72           2HD      LYS  72   3.652 -22.785 -15.180
  555    HD3  LYS  72           3HD      LYS  72   2.762 -22.193 -13.757
  556    HE2  LYS  72           HE2      LYS  72   1.067 -21.173 -15.235
  557    HE3  LYS  72           HE3      LYS  72   1.946 -21.762 -16.656
  558    HZ1  LYS  72           3HZ      LYS  72   1.585 -23.999 -15.880
  559    HZ2  LYS  72           1HZ      LYS  72   0.756 -23.459 -14.567
  560    HZ3  LYS  72           2HZ      LYS  72   0.148 -23.222 -16.075
  561    H    SER  73           H        SER  73   7.206 -21.413 -13.650
  562    HA   SER  73           HA       SER  73   8.694 -20.555 -11.206
  563    HB2  SER  73           HB2      SER  73   8.137 -22.983 -11.125
  564    HB3  SER  73           HB3      SER  73   8.963 -23.215 -12.678
  565    HG   SER  73           HG       SER  73  10.310 -23.687 -10.883
  566    H    LEU  74           H        LEU  74  10.871 -20.259 -11.440
  567    HA   LEU  74           HA       LEU  74  11.832 -19.888 -14.227
  568    HB2  LEU  74           HB2      LEU  74  11.159 -17.742 -12.497
  569    HB3  LEU  74           HB3      LEU  74  12.846 -17.953 -12.234
  570    HG   LEU  74           HG       LEU  74  12.639 -16.362 -13.954
  571   HD11  LEU  74          1HD1      LEU  74  14.442 -17.989 -14.401
  572   HD12  LEU  74          2HD1      LEU  74  13.314 -18.943 -15.407
  573   HD13  LEU  74          3HD1      LEU  74  13.756 -17.293 -15.881
  574   HD21  LEU  74          3HD2      LEU  74  10.291 -16.993 -14.575
  575   HD22  LEU  74          1HD2      LEU  74  11.322 -16.761 -16.002
  576   HD23  LEU  74          2HD2      LEU  74  10.932 -18.408 -15.448
  577    H    ASP  75           H        ASP  75  13.731 -20.829 -14.505
  578    HA   ASP  75           HA       ASP  75  15.638 -21.935 -14.146
  579    HB2  ASP  75           HB2      ASP  75  16.034 -19.505 -13.007
  580    HB3  ASP  75           HB3      ASP  75  15.916 -20.367 -11.563
  581    H    GLY  76           H        GLY  76  13.290 -22.058 -11.632
  582    HA2  GLY  76           2HA      GLY  76  13.256 -24.674 -11.260
  583    HA3  GLY  76           3HA      GLY  76  14.666 -24.240 -10.260
  584    H    LYS  77           H        LYS  77  12.806 -21.528 -10.021
  585    HA   LYS  77           HA       LYS  77  11.567 -22.512  -7.500
  586    HB2  LYS  77           HB2      LYS  77  12.815 -19.791  -7.980
  587    HB3  LYS  77           HB3      LYS  77  12.196 -20.430  -6.447
  588    HG2  LYS  77           HG2      LYS  77  14.566 -21.497  -8.033
  589    HG3  LYS  77           HG3      LYS  77  14.662 -20.532  -6.557
  590    HD2  LYS  77           2HD      LYS  77  13.693 -22.274  -5.220
  591    HD3  LYS  77           3HD      LYS  77  13.279 -23.252  -6.650
  592    HE2  LYS  77           HE2      LYS  77  15.635 -23.495  -7.226
  593    HE3  LYS  77           HE3      LYS  77  16.108 -22.489  -5.845
  594    HZ1  LYS  77           3HZ      LYS  77  15.129 -24.144  -4.399
  595    HZ2  LYS  77           1HZ      LYS  77  14.711 -25.076  -5.686
  596    HZ3  LYS  77           2HZ      LYS  77  16.298 -24.817  -5.345
  597    H    ALA  78           H        ALA  78   9.511 -21.904  -7.069
  598    HA   ALA  78           HA       ALA  78   7.954 -21.059  -9.317
  599    HB1  ALA  78           1HB      ALA  78   7.152 -21.451  -6.415
  600    HB2  ALA  78           HB2      ALA  78   6.046 -21.307  -7.802
  601    HB3  ALA  78           HB3      ALA  78   7.150 -22.696  -7.688
  602    H    ILE  79           H        ILE  79   6.894 -19.179  -9.757
  603    HA   ILE  79           HA       ILE  79   7.678 -16.828  -8.096
  604    HB   ILE  79           HB       ILE  79   7.937 -15.560 -10.095
  605   HG12  ILE  79          HG21      ILE  79   7.101 -17.997 -11.720
  606   HG13  ILE  79          HG31      ILE  79   6.037 -16.624 -11.355
  607   HG21  ILE  79          1HG2      ILE  79   9.269 -18.257 -10.560
  608   HG22  ILE  79          HG22      ILE  79   9.797 -16.681 -11.178
  609   HG23  ILE  79          HG32      ILE  79   9.843 -17.013  -9.428
  610   HD11  ILE  79          3HD1      ILE  79   6.912 -16.207 -13.507
  611   HD12  ILE  79          1HD1      ILE  79   7.743 -15.098 -12.402
  612   HD13  ILE  79          2HD1      ILE  79   8.586 -16.551 -12.995
  613    H    LYS  80           H        LYS  80   6.472 -14.847  -8.821
  614    HA   LYS  80           HA       LYS  80   3.592 -15.322  -9.374
  615    HB2  LYS  80           HB2      LYS  80   4.111 -14.541  -6.996
  616    HB3  LYS  80           HB3      LYS  80   4.811 -13.082  -7.707
  617    HG2  LYS  80           HG2      LYS  80   2.664 -12.558  -8.822
  618    HG3  LYS  80           HG3      LYS  80   1.934 -14.016  -8.106
  619    HD2  LYS  80           2HD      LYS  80   2.353 -13.092  -5.839
  620    HD3  LYS  80           3HD      LYS  80   3.081 -11.641  -6.584
  621    HE2  LYS  80           HE2      LYS  80   0.971 -11.141  -7.732
  622    HE3  LYS  80           HE3      LYS  80   0.224 -12.596  -7.048
  623    HZ1  LYS  80           3HZ      LYS  80  -0.282 -10.548  -5.829
  624    HZ2  LYS  80           1HZ      LYS  80   0.466 -11.671  -4.881
  625    HZ3  LYS  80           2HZ      LYS  80   1.312 -10.389  -5.438
  626    H    VAL  81           H        VAL  81   2.724 -13.894 -10.950
  627    HA   VAL  81           HA       VAL  81   4.532 -11.754 -11.928
  628    HB   VAL  81           HB       VAL  81   2.982 -13.648 -13.734
  629   HG11  VAL  81          1HG1      VAL  81   4.870 -11.330 -14.329
  630   HG12  VAL  81          HG21      VAL  81   4.128 -12.411 -15.536
  631   HG13  VAL  81          HG31      VAL  81   3.109 -11.321 -14.576
  632   HG21  VAL  81          HG32      VAL  81   5.968 -13.300 -13.229
  633   HG22  VAL  81          1HG2      VAL  81   4.991 -14.734 -12.818
  634   HG23  VAL  81          HG22      VAL  81   5.255 -14.297 -14.521
  635    H    GLU  82           H        GLU  82   3.544  -9.841 -12.148
  636    HA   GLU  82           HA       GLU  82   0.627  -9.604 -12.313
  637    HB2  GLU  82           HB2      GLU  82   1.127 -10.189  -9.911
  638    HB3  GLU  82           HB3      GLU  82   2.163  -8.769  -9.807
  639    HG2  GLU  82           HG2      GLU  82   0.207  -7.308 -10.242
  640    HG3  GLU  82           HG3      GLU  82  -0.821  -8.739 -10.435
  641    H    GLN  83           H        GLN  83   0.026  -7.209 -12.451
  642    HA   GLN  83           HA       GLN  83   2.016  -5.672 -13.840
  643    HB2  GLN  83           HB2      GLN  83  -0.284  -5.219 -14.299
  644    HB3  GLN  83           HB3      GLN  83  -0.677  -5.092 -12.576
  645    HG2  GLN  83           HG2      GLN  83  -0.706  -2.898 -13.589
  646    HG3  GLN  83           HG3      GLN  83   0.590  -3.010 -12.389
  647   HE21  GLN  83          HE22      GLN  83   2.156  -1.685 -13.024
  648   HE22  GLN  83          HE12      GLN  83   2.821  -1.603 -14.641
  649    H    ALA  84           H        ALA  84   3.440  -4.122 -13.084
  650    HA   ALA  84           HA       ALA  84   4.268  -4.511 -10.356
  651    HB1  ALA  84           1HB      ALA  84   5.227  -2.536 -12.458
  652    HB2  ALA  84           HB2      ALA  84   6.077  -2.961 -10.956
  653    HB3  ALA  84           HB3      ALA  84   5.851  -4.195 -12.216
  654    H    THR  85           H        THR  85   4.568  -2.939  -8.737
  655    HA   THR  85           HA       THR  85   2.923  -0.465  -9.001
  656    HB   THR  85           HB       THR  85   2.597  -0.561  -6.570
  657    HG1  THR  85           1HG      THR  85   3.086  -2.508  -5.511
  658   HG21  THR  85          1HG2      THR  85   0.893  -1.520  -8.131
  659   HG22  THR  85          HG22      THR  85   1.681  -3.108  -7.988
  660   HG23  THR  85          HG32      THR  85   0.909  -2.358  -6.567
  661    H    LYS  86           H        LYS  86   3.702   1.132  -7.211
  662    HA   LYS  86           HA       LYS  86   6.351   1.923  -7.938
  663    HB2  LYS  86           HB2      LYS  86   4.522   2.806  -5.668
  664    HB3  LYS  86           HB3      LYS  86   5.925   3.712  -6.244
  665    HG2  LYS  86           HG2      LYS  86   3.508   2.974  -7.967
  666    HG3  LYS  86           HG3      LYS  86   3.713   4.529  -7.155
  667    HD2  LYS  86           2HD      LYS  86   5.721   5.014  -8.440
  668    HD3  LYS  86           3HD      LYS  86   5.649   3.425  -9.238
  669    HE2  LYS  86           HE2      LYS  86   3.525   3.937 -10.252
  670    HE3  LYS  86           HE3      LYS  86   3.370   5.430  -9.307
  671    HZ1  LYS  86           3HZ      LYS  86   5.308   6.273 -10.474
  672    HZ2  LYS  86           1HZ      LYS  86   5.383   4.903 -11.389
  673    HZ3  LYS  86           2HZ      LYS  86   4.097   5.915 -11.522
  674    HA   PRO  87           HA       PRO  87   8.846  -0.238  -5.035
  675    HB2  PRO  87           HB2      PRO  87  10.860   1.545  -4.499
  676    HB3  PRO  87           HB3      PRO  87  10.689   0.719  -6.081
  677    HG2  PRO  87           HG2      PRO  87   9.698   3.482  -5.322
  678    HG3  PRO  87           HG3      PRO  87  10.654   3.006  -6.771
  679    HD2  PRO  87           2HD      PRO  87   7.967   3.281  -6.900
  680    HD3  PRO  87           3HD      PRO  87   8.774   1.930  -7.752
  681    H    SER  88           H        SER  88   9.430  -0.340  -2.759
  682    HA   SER  88           HA       SER  88   7.421   1.062  -1.196
  683    HB2  SER  88           HB2      SER  88   9.503  -0.985  -0.338
  684    HB3  SER  88           HB3      SER  88   8.116  -0.433   0.619
  685    HG   SER  88           HG       SER  88   7.661  -2.365  -0.476
  686    H    PHE  89           H        PHE  89  10.436   2.062  -2.160
  687    HA   PHE  89           HA       PHE  89  10.988   3.438   0.406
  688    HB2  PHE  89           HB2      PHE  89  13.069   4.110  -0.561
  689    HB3  PHE  89           HB3      PHE  89  12.881   2.354  -0.613
  690    HD1  PHE  89           HD2      PHE  89  12.493   5.430  -2.731
  691    HD2  PHE  89           HD1      PHE  89  13.330   1.215  -2.616
  692    HE1  PHE  89           HE2      PHE  89  13.138   5.493  -5.129
  693    HE2  PHE  89           HE1      PHE  89  14.027   1.302  -5.012
  694    HZ   PHE  89           HZ       PHE  89  13.903   3.414  -6.261
  695    H    GLU  90           H        GLU  90   8.890   3.936  -2.006
  696    HA   GLU  90           HA       GLU  90   9.395   6.875  -2.096
  697    HB2  GLU  90           HB2      GLU  90   9.967   5.470  -4.188
  698    HB3  GLU  90           HB3      GLU  90   8.214   5.263  -4.376
  699    HG2  GLU  90           HG2      GLU  90   7.980   7.757  -4.396
  700    HG3  GLU  90           HG3      GLU  90   9.735   7.899  -4.190
  701    H    SER  91           H        SER  91   7.596   8.210  -2.418
  702    HA   SER  91           HA       SER  91   4.959   7.120  -1.647
  703    HB2  SER  91           HB2      SER  91   6.619   9.147  -0.116
  704    HB3  SER  91           HB3      SER  91   4.877   8.878   0.174
  705    HG   SER  91           HG       SER  91   5.393   6.703   0.659
  706    H    GLY  92           H        GLY  92   6.335   8.534  -4.027
  707    HA2  GLY  92           2HA      GLY  92   5.555  10.073  -5.596
  708    HA3  GLY  92           3HA      GLY  92   4.278  10.566  -4.473
  709    H    ARG  93           H        ARG  93   4.626  12.777  -4.722
  710    HA   ARG  93           HA       ARG  93   5.631  14.818  -4.562
  711    HB2  ARG  93           HB2      ARG  93   5.341  13.939  -2.146
  712    HB3  ARG  93           HB3      ARG  93   7.098  13.712  -2.162
  713    HG2  ARG  93           HG2      ARG  93   7.180  16.227  -2.951
  714    HG3  ARG  93           HG3      ARG  93   5.489  16.278  -2.464
  715    HD2  ARG  93           2HD      ARG  93   6.950  17.080  -0.676
  716    HD3  ARG  93           3HD      ARG  93   6.109  15.599  -0.183
  717    HE   ARG  93           HE       ARG  93   8.935  15.590  -1.204
  718   HH11  ARG  93          1HH1      ARG  93   6.568  14.666   1.264
  719   HH12  ARG  93          2HH1      ARG  93   7.712  13.668   2.133
  720   HH21  ARG  93          1HH2      ARG  93  10.384  14.283  -0.051
  721   HH22  ARG  93          2HH2      ARG  93   9.859  13.470   1.400
  722    H    ARG  94           H        ARG  94   8.367  15.049  -3.174
  723    HA   ARG  94           HA       ARG  94  10.206  14.058  -5.253
  724    HB2  ARG  94           HB2      ARG  94   9.253  16.195  -6.094
  725    HB3  ARG  94           HB3      ARG  94   9.759  16.999  -4.600
  726    HG2  ARG  94           HG2      ARG  94  12.132  16.526  -5.133
  727    HG3  ARG  94           HG3      ARG  94  11.633  15.633  -6.589
  728    HD2  ARG  94           2HD      ARG  94  12.354  17.868  -7.212
  729    HD3  ARG  94           3HD      ARG  94  10.609  17.704  -7.493
  730    HE   ARG  94           HE       ARG  94  11.071  18.770  -4.876
  731   HH11  ARG  94          1HH1      ARG  94  11.262  19.670  -8.286
  732   HH12  ARG  94          2HH1      ARG  94  10.993  21.370  -7.976
  733   HH21  ARG  94          1HH2      ARG  94  10.747  20.990  -4.493
  734   HH22  ARG  94          2HH2      ARG  94  10.713  22.118  -5.829
  735    H    GLY  95           H        GLY  95  12.397  14.096  -4.527
  736    HA2  GLY  95           2HA      GLY  95  14.124  14.091  -3.011
  737    HA3  GLY  95           3HA      GLY  95  13.238  15.296  -2.057
  738    H5'    A  96           H5'        A  96   5.023 -10.928   1.438
  739   H5''    A  96          H5''        A  96   4.150  -9.388   1.492
  740    H4'    A  96           H4'        A  96   4.610 -11.315   3.833
  741    H3'    A  96           H3'        A  96   2.512 -11.052   1.775
  742    H2'    A  96           H2'        A  96   0.706 -10.393   3.107
  743   HO2'    A  96          HO2'        A  96   1.140 -12.053   4.724
  744    H1'    A  96           H1'        A  96   1.880  -8.725   4.858
  745    H8     A  96           H8         A  96   4.085  -7.457   2.478
  746    H61    A  96           H61        A  96  -0.573  -5.289  -1.009
  747    H62    A  96           H62        A  96   1.155  -5.195  -0.710
  748    H2     A  96           H2         A  96  -2.245  -8.236   1.843
  749   HO5'    A  96          H5T         A  96   6.447  -9.144   1.703
  750    H5'    U  97           H5'        U  97   0.744 -12.844   1.199
  751   H5''    U  97          H5''        U  97   0.976 -14.510   0.643
  752    H4'    U  97           H4'        U  97   1.602 -13.711  -1.590
  753    H3'    U  97           H3'        U  97   1.977 -11.204  -0.463
  754    H2'    U  97           H2'        U  97  -0.072 -10.134  -0.544
  755   HO2'    U  97          HO2'        U  97   0.420  -9.595  -2.696
  756    H1'    U  97           H1'        U  97  -1.814 -11.897  -1.866
  757    H3     U  97           H3         U  97  -4.525 -12.786   1.618
  758    H5     U  97           H5         U  97  -1.197 -10.931   3.369
  759    H6     U  97           H6         U  97  -0.055 -11.063   1.218
  760    H5'    C  98           H5'        C  98   4.167 -11.346  -0.618
  761   H5''    C  98          H5''        C  98   4.752  -9.689  -0.822
  762    H4'    C  98           H4'        C  98   6.619 -10.875  -0.092
  763    H3'    C  98           H3'        C  98   6.810  -9.696  -2.566
  764    H2'    C  98           H2'        C  98   6.228 -11.581  -3.849
  765   HO2'    C  98          HO2'        C  98   8.459 -10.962  -4.367
  766    H1'    C  98           H1'        C  98   7.854 -13.483  -2.207
  767    H41    C  98           H41        C  98   3.947 -17.210  -5.584
  768    H42    C  98           H42        C  98   2.534 -16.393  -4.936
  769    H5     C  98           H5         C  98   2.689 -14.480  -3.423
  770    H6     C  98           H6         C  98   4.250 -12.995  -2.272
  771    H5'    A  99           H5'        A  99   9.524  -6.397  -0.945
  772   H5''    A  99          H5''        A  99   7.896  -6.572  -1.638
  773    H4'    A  99           H4'        A  99  10.443  -6.243  -3.291
  774    H3'    A  99           H3'        A  99   9.244  -4.218  -1.746
  775    H2'    A  99           H2'        A  99   7.203  -4.257  -3.051
  776   HO2'    A  99          HO2'        A  99   8.046  -2.139  -3.255
  777    H1'    A  99           H1'        A  99   9.061  -4.718  -5.399
  778    H8     A  99           H8         A  99   7.475  -3.640  -7.064
  779    H61    A  99           H61        A  99   1.970  -6.523  -7.270
  780    H62    A  99           H62        A  99   3.002  -5.361  -8.081
  781    H2     A  99           H2         A  99   4.152  -7.912  -3.660
  782    H5'    A 100           H5'        A 100  12.903  -1.152  -4.113
  783   H5''    A 100          H5''        A 100  11.736  -2.244  -4.897
  784    H4'    A 100           H4'        A 100  14.447  -3.261  -5.244
  785    H3'    A 100           H3'        A 100  14.703  -0.607  -5.151
  786    H2'    A 100           H2'        A 100  12.618  -0.217  -6.255
  787   HO2'    A 100          HO2'        A 100  13.200   0.698  -8.313
  788    H1'    A 100           H1'        A 100  13.468  -2.001  -8.519
  789    H8     A 100           H8         A 100  10.336  -1.896  -6.195
  790    H61    A 100           H61        A 100   7.393   0.140 -11.283
  791    H62    A 100           H62        A 100   7.172  -0.378  -9.615
  792    H2     A 100           H2         A 100  11.661  -0.401 -12.282
  793    H5'    A 101           H5'        A 101  16.166   0.906  -7.174
  794   H5''    A 101          H5''        A 101  17.800   0.517  -7.724
  795    H4'    A 101           H4'        A 101  17.455   2.925  -7.360
  796    H3'    A 101           H3'        A 101  19.688   1.480  -6.666
  797   HO3'    A 101          H3T         A 101  20.598   3.609  -6.223
  798    H2'    A 101           H2'        A 101  19.112   1.073  -4.433
  799   HO2'    A 101          HO2'        A 101  20.218   2.690  -3.126
  800    H1'    A 101           H1'        A 101  18.089   3.883  -4.068
  801    H8     A 101           H8         A 101  17.645   0.106  -3.378
  802    H61    A 101           H61        A 101  14.947   1.971   1.904
  803    H62    A 101           H62        A 101  15.511   0.576   0.998
  804    H2     A 101           H2         A 101  15.768   5.556  -0.586
  Start of MODEL    4
    1    H1   MET   1           H1       MET   1  -5.818   2.221  -0.762
    2    H2   MET   1           H2       MET   1  -5.413   0.627  -0.870
    3    H3   MET   1           H3       MET   1  -5.966   1.430  -2.193
    4    HA   MET   1           HA       MET   1  -4.024   2.826  -2.247
    5    HB2  MET   1           HB2      MET   1  -3.643   2.803   0.212
    6    HB3  MET   1           HB3      MET   1  -3.126   1.112   0.108
    7    HG2  MET   1           HG2      MET   1  -1.207   2.657   0.138
    8    HG3  MET   1           HG3      MET   1  -1.274   1.735  -1.366
    9    HE1  MET   1           HE1      MET   1   0.301   3.187  -2.693
   10    HE2  MET   1           HE2      MET   1   0.281   4.964  -2.718
   11    HE3  MET   1           HE3      MET   1   0.623   4.102  -1.196
   12    H    VAL   2           H        VAL   2  -4.291   1.800  -4.228
   13    HA   VAL   2           HA       VAL   2  -2.038  -0.029  -4.637
   14    HB   VAL   2           HB       VAL   2  -3.921  -1.535  -4.653
   15   HG11  VAL   2          1HG1      VAL   2  -5.767   0.077  -5.049
   16   HG12  VAL   2          HG21      VAL   2  -5.222   0.273  -6.736
   17   HG13  VAL   2          HG31      VAL   2  -5.826  -1.298  -6.163
   18   HG21  VAL   2          HG32      VAL   2  -3.705  -2.381  -6.945
   19   HG22  VAL   2          1HG2      VAL   2  -3.119  -0.788  -7.488
   20   HG23  VAL   2          HG22      VAL   2  -2.137  -1.760  -6.367
   21    H    GLU   3           H        GLU   3  -0.754   0.793  -6.148
   22    HA   GLU   3           HA       GLU   3  -1.884   2.760  -8.076
   23    HB2  GLU   3           HB2      GLU   3   0.153   4.133  -7.736
   24    HB3  GLU   3           HB3      GLU   3  -0.891   4.046  -6.312
   25    HG2  GLU   3           HG2      GLU   3   0.610   2.230  -5.399
   26    HG3  GLU   3           HG3      GLU   3   1.728   2.571  -6.730
   27    H    ALA   4           H        ALA   4  -1.476   2.333 -10.084
   28    HA   ALA   4           HA       ALA   4   0.759   0.487 -10.769
   29    HB1  ALA   4           1HB      ALA   4  -0.626  -0.070 -12.752
   30    HB2  ALA   4           HB2      ALA   4  -1.463  -0.446 -11.224
   31    HB3  ALA   4           HB3      ALA   4  -1.907   1.005 -12.150
   32    H    ASP   5           H        ASP   5   2.419   1.717 -11.360
   33    HA   ASP   5           HA       ASP   5   2.111   4.446 -12.160
   34    HB2  ASP   5           HB2      ASP   5   4.044   3.565 -10.950
   35    HB3  ASP   5           HB3      ASP   5   4.504   2.581 -12.346
   36    H    ARG   6           H        ARG   6   2.617   1.465 -14.114
   37    HA   ARG   6           HA       ARG   6   1.731   2.925 -16.463
   38    HB2  ARG   6           HB2      ARG   6   4.228   3.488 -16.155
   39    HB3  ARG   6           HB3      ARG   6   4.554   1.785 -16.485
   40    HG2  ARG   6           HG2      ARG   6   4.849   3.071 -18.513
   41    HG3  ARG   6           HG3      ARG   6   3.436   2.019 -18.710
   42    HD2  ARG   6           2HD      ARG   6   3.028   4.286 -19.587
   43    HD3  ARG   6           3HD      ARG   6   1.938   3.917 -18.247
   44    HE   ARG   6           HE       ARG   6   3.949   5.161 -16.934
   45   HH11  ARG   6          1HH1      ARG   6   2.196   6.045 -19.873
   46   HH12  ARG   6          2HH1      ARG   6   2.407   7.764 -19.619
   47   HH21  ARG   6          1HH2      ARG   6   4.213   7.400 -16.632
   48   HH22  ARG   6          2HH2      ARG   6   3.552   8.527 -17.794
   49    HA   PRO   7           HA       PRO   7   0.490  -1.332 -17.403
   50    HB2  PRO   7           HB2      PRO   7   0.392  -0.064 -20.134
   51    HB3  PRO   7           HB3      PRO   7  -0.821  -1.157 -19.374
   52    HG2  PRO   7           HG2      PRO   7  -1.270   1.476 -19.525
   53    HG3  PRO   7           HG3      PRO   7  -1.573   0.637 -17.955
   54    HD2  PRO   7           2HD      PRO   7   0.863   2.251 -18.788
   55    HD3  PRO   7           3HD      PRO   7  -0.060   2.322 -17.249
   56    H    GLY   8           H        GLY   8   1.563  -3.142 -18.357
   57    HA2  GLY   8           2HA      GLY   8   2.945  -4.163 -19.971
   58    HA3  GLY   8           3HA      GLY   8   3.705  -2.589 -20.319
   59    H    LYS   9           H        LYS   9   3.838  -2.140 -17.250
   60    HA   LYS   9           HA       LYS   9   6.390  -3.546 -16.920
   61    HB2  LYS   9           HB2      LYS   9   6.211  -1.164 -16.275
   62    HB3  LYS   9           HB3      LYS   9   5.006  -1.610 -15.035
   63    HG2  LYS   9           HG2      LYS   9   6.693  -3.214 -14.065
   64    HG3  LYS   9           HG3      LYS   9   7.879  -2.639 -15.246
   65    HD2  LYS   9           2HD      LYS   9   6.499  -0.875 -13.181
   66    HD3  LYS   9           3HD      LYS   9   8.097  -1.629 -12.977
   67    HE2  LYS   9           HE2      LYS   9   8.911  -0.446 -14.989
   68    HE3  LYS   9           HE3      LYS   9   7.336   0.335 -15.186
   69    HZ1  LYS   9           3HZ      LYS   9   7.656   1.394 -13.064
   70    HZ2  LYS   9           1HZ      LYS   9   9.085   0.613 -12.836
   71    HZ3  LYS   9           2HZ      LYS   9   8.931   1.732 -14.039
   72    H    LEU  10           H        LEU  10   6.651  -5.354 -15.783
   73    HA   LEU  10           HA       LEU  10   4.327  -6.387 -14.208
   74    HB2  LEU  10           HB2      LEU  10   6.459  -7.781 -15.849
   75    HB3  LEU  10           HB3      LEU  10   5.364  -8.653 -14.835
   76    HG   LEU  10           HG       LEU  10   4.572  -6.935 -17.233
   77   HD11  LEU  10          1HD1      LEU  10   4.342  -9.944 -16.726
   78   HD12  LEU  10          2HD1      LEU  10   4.160  -9.093 -18.278
   79   HD13  LEU  10          3HD1      LEU  10   5.757  -9.225 -17.496
   80   HD21  LEU  10          3HD2      LEU  10   2.326  -8.022 -16.906
   81   HD22  LEU  10          1HD2      LEU  10   2.874  -8.572 -15.311
   82   HD23  LEU  10          2HD2      LEU  10   2.756  -6.824 -15.664
   83    H    PHE  11           H        PHE  11   4.780  -7.582 -12.355
   84    HA   PHE  11           HA       PHE  11   7.463  -7.159 -11.133
   85    HB2  PHE  11           HB2      PHE  11   5.681  -6.150  -9.822
   86    HB3  PHE  11           HB3      PHE  11   4.687  -7.600  -9.978
   87    HD1  PHE  11           HD2      PHE  11   8.005  -6.464  -8.661
   88    HD2  PHE  11           HD1      PHE  11   4.757  -9.260  -8.323
   89    HE1  PHE  11           HE2      PHE  11   8.989  -7.356  -6.566
   90    HE2  PHE  11           HE1      PHE  11   5.773 -10.177  -6.247
   91    HZ   PHE  11           HZ       PHE  11   7.897  -9.208  -5.378
   92    H    ILE  12           H        ILE  12   8.681  -8.919 -10.741
   93    HA   ILE  12           HA       ILE  12   7.439 -11.585 -11.247
   94    HB   ILE  12           HB       ILE  12  10.314 -10.919 -11.878
   95   HG12  ILE  12          HG21      ILE  12   9.143  -9.292 -13.247
   96   HG13  ILE  12          HG31      ILE  12   9.813 -10.594 -14.217
   97   HG21  ILE  12          1HG2      ILE  12   8.311 -12.965 -12.897
   98   HG22  ILE  12          HG22      ILE  12  10.011 -12.834 -13.403
   99   HG23  ILE  12          HG32      ILE  12   9.600 -13.256 -11.717
  100   HD11  ILE  12          3HD1      ILE  12   7.660 -10.023 -15.082
  101   HD12  ILE  12          1HD1      ILE  12   7.517 -11.626 -14.337
  102   HD13  ILE  12          2HD1      ILE  12   6.885 -10.193 -13.492
  103    H    GLY  13           H        GLY  13   7.115 -11.752  -8.880
  104    HA2  GLY  13           2HA      GLY  13   9.594 -11.670  -7.247
  105    HA3  GLY  13           3HA      GLY  13   7.952 -11.741  -6.646
  106    H    GLY  14           H        GLY  14  10.468 -13.479  -6.213
  107    HA2  GLY  14           2HA      GLY  14  10.201 -15.591  -5.136
  108    HA3  GLY  14           3HA      GLY  14   8.924 -16.024  -6.289
  109    H    LEU  15           H        LEU  15  11.503 -14.441  -7.853
  110    HA   LEU  15           HA       LEU  15  12.173 -16.717  -9.438
  111    HB2  LEU  15           HB2      LEU  15  13.637 -14.086  -8.981
  112    HB3  LEU  15           HB3      LEU  15  13.949 -15.254 -10.294
  113    HG   LEU  15           HG       LEU  15  11.218 -14.003 -10.004
  114   HD11  LEU  15          1HD1      LEU  15  12.834 -12.143 -10.158
  115   HD12  LEU  15          2HD1      LEU  15  13.680 -12.966 -11.488
  116   HD13  LEU  15          3HD1      LEU  15  12.016 -12.365 -11.721
  117   HD21  LEU  15          3HD2      LEU  15  12.860 -15.047 -12.357
  118   HD22  LEU  15          1HD2      LEU  15  11.713 -16.044 -11.436
  119   HD23  LEU  15          2HD2      LEU  15  11.130 -14.639 -12.373
  120    H    ASN  16           H        ASN  16  14.380 -17.576  -9.749
  121    HA   ASN  16           HA       ASN  16  15.503 -18.552  -7.317
  122    HB2  ASN  16           HB2      ASN  16  15.297 -19.691  -9.517
  123    HB3  ASN  16           HB3      ASN  16  16.573 -18.615 -10.138
  124   HD21  ASN  16          2HD2      ASN  16  17.281 -20.909 -10.592
  125   HD22  ASN  16          1HD2      ASN  16  18.328 -21.641  -9.421
  126    H    THR  17           H        THR  17  17.800 -18.228  -6.669
  127    HA   THR  17           HA       THR  17  18.597 -15.436  -6.753
  128    HB   THR  17           HB       THR  17  20.481 -16.193  -5.390
  129    HG1  THR  17           1HG      THR  17  20.664 -18.410  -4.935
  130   HG21  THR  17          1HG2      THR  17  18.236 -15.877  -4.339
  131   HG22  THR  17          HG22      THR  17  17.909 -17.616  -4.585
  132   HG23  THR  17          HG32      THR  17  19.223 -17.101  -3.498
  133    H    GLU  18           H        GLU  18  18.818 -17.884  -8.965
  134    HA   GLU  18           HA       GLU  18  21.572 -17.256  -9.870
  135    HB2  GLU  18           HB2      GLU  18  19.858 -19.548 -10.808
  136    HB3  GLU  18           HB3      GLU  18  21.626 -19.435 -10.773
  137    HG2  GLU  18           HG2      GLU  18  19.775 -19.652  -8.344
  138    HG3  GLU  18           HG3      GLU  18  20.626 -20.986  -9.074
  139    H    THR  19           H        THR  19  18.363 -16.467 -10.509
  140    HA   THR  19           HA       THR  19  18.457 -16.500 -13.423
  141    HB   THR  19           HB       THR  19  16.531 -15.123 -11.504
  142    HG1  THR  19           1HG      THR  19  16.433 -17.661 -12.753
  143   HG21  THR  19          1HG2      THR  19  16.272 -15.897 -14.440
  144   HG22  THR  19          HG22      THR  19  14.948 -15.292 -13.417
  145   HG23  THR  19          HG32      THR  19  16.330 -14.243 -13.777
  146    H    ASN  20           H        ASN  20  18.748 -14.746 -14.791
  147    HA   ASN  20           HA       ASN  20  19.366 -12.130 -13.517
  148    HB2  ASN  20           HB2      ASN  20  20.894 -12.826 -15.955
  149    HB3  ASN  20           HB3      ASN  20  21.358 -11.823 -14.579
  150   HD21  ASN  20          2HD2      ASN  20  21.197 -15.032 -15.955
  151   HD22  ASN  20          1HD2      ASN  20  22.208 -15.829 -14.765
  152    H    GLU  21           H        GLU  21  19.907 -10.722 -15.761
  153    HA   GLU  21           HA       GLU  21  17.231 -10.109 -16.624
  154    HB2  GLU  21           HB2      GLU  21  19.976  -9.150 -17.488
  155    HB3  GLU  21           HB3      GLU  21  18.451  -8.449 -18.085
  156    HG2  GLU  21           HG2      GLU  21  17.782  -7.808 -15.861
  157    HG3  GLU  21           HG3      GLU  21  19.101  -8.721 -15.137
  158    H    LYS  22           H        LYS  22  19.951 -11.908 -18.100
  159    HA   LYS  22           HA       LYS  22  18.864 -11.891 -20.746
  160    HB2  LYS  22           HB2      LYS  22  21.210 -12.347 -20.268
  161    HB3  LYS  22           HB3      LYS  22  20.783 -13.799 -19.344
  162    HG2  LYS  22           HG2      LYS  22  21.606 -14.290 -21.648
  163    HG3  LYS  22           HG3      LYS  22  19.986 -14.929 -21.325
  164    HD2  LYS  22           2HD      LYS  22  18.955 -13.052 -22.514
  165    HD3  LYS  22           3HD      LYS  22  20.548 -12.311 -22.781
  166    HE2  LYS  22           HE2      LYS  22  19.662 -15.039 -23.818
  167    HE3  LYS  22           HE3      LYS  22  19.688 -13.544 -24.770
  168    HZ1  LYS  22           3HZ      LYS  22  21.652 -14.845 -25.140
  169    HZ2  LYS  22           1HZ      LYS  22  22.060 -13.431 -24.401
  170    HZ3  LYS  22           2HZ      LYS  22  22.033 -14.834 -23.542
  171    H    ALA  23           H        ALA  23  18.206 -13.873 -17.896
  172    HA   ALA  23           HA       ALA  23  16.859 -15.953 -19.494
  173    HB1  ALA  23           1HB      ALA  23  16.436 -16.961 -17.277
  174    HB2  ALA  23           HB2      ALA  23  18.157 -16.556 -17.480
  175    HB3  ALA  23           HB3      ALA  23  17.118 -15.517 -16.487
  176    H    LEU  24           H        LEU  24  16.218 -12.949 -17.966
  177    HA   LEU  24           HA       LEU  24  13.368 -13.415 -17.490
  178    HB2  LEU  24           HB2      LEU  24  15.609 -11.655 -16.694
  179    HB3  LEU  24           HB3      LEU  24  14.171 -10.711 -16.958
  180    HG   LEU  24           HG       LEU  24  14.221 -13.277 -15.327
  181   HD11  LEU  24          1HD1      LEU  24  14.590 -10.422 -14.322
  182   HD12  LEU  24          2HD1      LEU  24  14.390 -11.869 -13.301
  183   HD13  LEU  24          3HD1      LEU  24  15.828 -11.708 -14.328
  184   HD21  LEU  24          3HD2      LEU  24  12.365 -10.845 -15.255
  185   HD22  LEU  24          1HD2      LEU  24  12.020 -12.369 -16.103
  186   HD23  LEU  24          2HD2      LEU  24  12.168 -12.347 -14.322
  187    H    GLU  25           H        GLU  25  15.551 -11.797 -19.745
  188    HA   GLU  25           HA       GLU  25  13.350 -10.512 -21.149
  189    HB2  GLU  25           HB2      GLU  25  16.282 -11.015 -21.882
  190    HB3  GLU  25           HB3      GLU  25  15.141 -10.149 -22.937
  191    HG2  GLU  25           HG2      GLU  25  14.659  -8.595 -21.104
  192    HG3  GLU  25           HG3      GLU  25  15.903  -9.368 -20.100
  193    H    ALA  26           H        ALA  26  15.063 -13.513 -21.158
  194    HA   ALA  26           HA       ALA  26  14.338 -14.328 -23.862
  195    HB1  ALA  26           1HB      ALA  26  15.530 -15.785 -21.485
  196    HB2  ALA  26           HB2      ALA  26  15.416 -16.458 -23.135
  197    HB3  ALA  26           HB3      ALA  26  16.432 -15.025 -22.824
  198    H    VAL  27           H        VAL  27  12.942 -14.555 -20.652
  199    HA   VAL  27           HA       VAL  27  11.223 -16.817 -21.451
  200    HB   VAL  27           HB       VAL  27  12.611 -16.715 -19.402
  201   HG11  VAL  27          1HG1      VAL  27  11.875 -15.500 -17.475
  202   HG12  VAL  27          HG21      VAL  27  12.045 -14.352 -18.823
  203   HG13  VAL  27          HG31      VAL  27  10.419 -14.932 -18.345
  204   HG21  VAL  27          HG32      VAL  27  10.708 -18.287 -19.659
  205   HG22  VAL  27          1HG2      VAL  27  10.873 -17.719 -17.968
  206   HG23  VAL  27          HG22      VAL  27   9.601 -17.033 -19.017
  207    H    PHE  28           H        PHE  28  11.043 -13.435 -20.346
  208    HA   PHE  28           HA       PHE  28   8.105 -13.479 -20.693
  209    HB2  PHE  28           HB2      PHE  28   9.982 -11.307 -19.725
  210    HB3  PHE  28           HB3      PHE  28   8.238 -11.110 -19.955
  211    HD1  PHE  28           HD2      PHE  28   6.609 -12.424 -18.610
  212    HD2  PHE  28           HD1      PHE  28  10.822 -12.467 -17.795
  213    HE1  PHE  28           HE2      PHE  28   6.163 -13.381 -16.367
  214    HE2  PHE  28           HE1      PHE  28  10.388 -13.460 -15.562
  215    HZ   PHE  28           HZ       PHE  28   8.048 -13.890 -14.839
  216    H    GLY  29           H        GLY  29  10.861 -12.926 -22.624
  217    HA2  GLY  29           2HA      GLY  29   9.633 -10.983 -24.412
  218    HA3  GLY  29           3HA      GLY  29  11.092 -11.944 -24.730
  219    H    LYS  30           H        LYS  30   8.894 -14.129 -23.671
  220    HA   LYS  30           HA       LYS  30   8.363 -15.171 -26.328
  221    HB2  LYS  30           HB2      LYS  30   7.584 -16.119 -23.524
  222    HB3  LYS  30           HB3      LYS  30   7.506 -17.093 -25.006
  223    HG2  LYS  30           HG2      LYS  30   9.937 -16.891 -25.280
  224    HG3  LYS  30           HG3      LYS  30  10.055 -15.846 -23.870
  225    HD2  LYS  30           2HD      LYS  30  10.732 -18.163 -23.337
  226    HD3  LYS  30           3HD      LYS  30   9.388 -17.585 -22.351
  227    HE2  LYS  30           HE2      LYS  30   8.961 -19.862 -23.008
  228    HE3  LYS  30           HE3      LYS  30   7.786 -18.787 -23.787
  229    HZ1  LYS  30           3HZ      LYS  30   9.112 -18.922 -25.800
  230    HZ2  LYS  30           1HZ      LYS  30  10.211 -19.897 -25.054
  231    HZ3  LYS  30           2HZ      LYS  30   8.677 -20.425 -25.312
  232    H    TYR  31           H        TYR  31   6.841 -13.055 -24.216
  233    HA   TYR  31           HA       TYR  31   4.118 -13.684 -25.271
  234    HB2  TYR  31           HB2      TYR  31   5.020 -12.206 -22.789
  235    HB3  TYR  31           HB3      TYR  31   3.339 -12.492 -23.251
  236    HD1  TYR  31           HD2      TYR  31   2.635 -15.001 -23.474
  237    HD2  TYR  31           HD1      TYR  31   6.227 -13.700 -21.507
  238    HE1  TYR  31           HE2      TYR  31   2.814 -17.211 -22.358
  239    HE2  TYR  31           HE1      TYR  31   6.400 -15.906 -20.350
  240    HH   TYR  31           HH       TYR  31   5.549 -18.059 -20.229
  241    H    GLY  32           H        GLY  32   6.670 -11.259 -25.272
  242    HA2  GLY  32           2HA      GLY  32   5.336  -9.651 -27.207
  243    HA3  GLY  32           3HA      GLY  32   5.190  -8.898 -25.596
  244    H    ARG  33           H        ARG  33   6.471  -7.610 -27.682
  245    HA   ARG  33           HA       ARG  33   9.303  -8.048 -27.526
  246    HB2  ARG  33           HB2      ARG  33   7.766  -6.914 -29.353
  247    HB3  ARG  33           HB3      ARG  33   8.024  -5.442 -28.383
  248    HG2  ARG  33           HG2      ARG  33  10.486  -5.801 -28.562
  249    HG3  ARG  33           HG3      ARG  33  10.155  -7.304 -29.467
  250    HD2  ARG  33           2HD      ARG  33   8.974  -5.959 -31.205
  251    HD3  ARG  33           3HD      ARG  33   9.385  -4.482 -30.330
  252    HE   ARG  33           HE       ARG  33  11.192  -6.217 -31.902
  253   HH11  ARG  33          1HH1      ARG  33  10.911  -3.420 -29.732
  254   HH12  ARG  33          2HH1      ARG  33  12.493  -2.815 -30.137
  255   HH21  ARG  33          1HH2      ARG  33  13.228  -5.393 -32.414
  256   HH22  ARG  33          2HH2      ARG  33  13.801  -3.922 -31.656
  257    H    ILE  34           H        ILE  34  10.472  -7.627 -25.864
  258    HA   ILE  34           HA       ILE  34   9.579  -5.940 -23.665
  259    HB   ILE  34           HB       ILE  34  12.176  -7.401 -24.243
  260   HG12  ILE  34          HG21      ILE  34   9.740  -7.947 -22.495
  261   HG13  ILE  34          HG31      ILE  34  10.239  -8.848 -23.926
  262   HG21  ILE  34          1HG2      ILE  34  12.789  -6.976 -21.924
  263   HG22  ILE  34          HG22      ILE  34  12.563  -5.443 -22.761
  264   HG23  ILE  34          HG32      ILE  34  11.285  -6.046 -21.668
  265   HD11  ILE  34          3HD1      ILE  34  11.730  -8.721 -21.276
  266   HD12  ILE  34          1HD1      ILE  34  10.867 -10.108 -21.957
  267   HD13  ILE  34          2HD1      ILE  34  12.342  -9.514 -22.750
  268    H    VAL  35           H        VAL  35  10.210  -3.935 -23.070
  269    HA   VAL  35           HA       VAL  35  11.982  -2.463 -24.966
  270    HB   VAL  35           HB       VAL  35  10.588  -0.659 -23.236
  271   HG11  VAL  35          1HG1      VAL  35  10.296  -1.289 -26.192
  272   HG12  VAL  35          HG21      VAL  35   9.729   0.189 -25.374
  273   HG13  VAL  35          HG31      VAL  35  11.474  -0.173 -25.456
  274   HG21  VAL  35          HG32      VAL  35   8.696  -2.577 -24.659
  275   HG22  VAL  35          1HG2      VAL  35   8.826  -2.327 -22.903
  276   HG23  VAL  35          HG22      VAL  35   8.259  -1.009 -23.944
  277    H    GLU  36           H        GLU  36  11.484  -3.517 -21.666
  278    HA   GLU  36           HA       GLU  36  14.205  -2.742 -20.978
  279    HB2  GLU  36           HB2      GLU  36  13.005  -0.624 -20.561
  280    HB3  GLU  36           HB3      GLU  36  11.825  -1.463 -19.548
  281    HG2  GLU  36           HG2      GLU  36  13.545  -2.041 -17.923
  282    HG3  GLU  36           HG3      GLU  36  14.806  -1.394 -18.988
  283    H    VAL  37           H        VAL  37  14.953  -3.899 -19.141
  284    HA   VAL  37           HA       VAL  37  12.944  -5.465 -17.642
  285    HB   VAL  37           HB       VAL  37  15.164  -6.621 -19.290
  286   HG11  VAL  37          1HG1      VAL  37  15.322  -8.599 -17.847
  287   HG12  VAL  37          HG21      VAL  37  15.947  -7.172 -17.009
  288   HG13  VAL  37          HG31      VAL  37  14.325  -7.806 -16.612
  289   HG21  VAL  37          HG32      VAL  37  12.763  -6.936 -19.837
  290   HG22  VAL  37          1HG2      VAL  37  13.495  -8.491 -19.361
  291   HG23  VAL  37          HG22      VAL  37  12.479  -7.613 -18.214
  292    H    LEU  38           H        LEU  38  13.403  -5.856 -15.573
  293    HA   LEU  38           HA       LEU  38  15.870  -4.599 -14.378
  294    HB2  LEU  38           HB2      LEU  38  13.002  -4.534 -13.796
  295    HB3  LEU  38           HB3      LEU  38  13.990  -4.766 -12.374
  296    HG   LEU  38           HG       LEU  38  14.419  -2.468 -14.344
  297   HD11  LEU  38          1HD1      LEU  38  13.096  -2.531 -11.596
  298   HD12  LEU  38          2HD1      LEU  38  13.436  -1.072 -12.548
  299   HD13  LEU  38          3HD1      LEU  38  12.267  -2.265 -13.154
  300   HD21  LEU  38          3HD2      LEU  38  15.797  -1.529 -12.530
  301   HD22  LEU  38          1HD2      LEU  38  15.529  -2.998 -11.565
  302   HD23  LEU  38          2HD2      LEU  38  16.457  -3.081 -13.085
  303    H    LEU  39           H        LEU  39  16.818  -5.728 -12.690
  304    HA   LEU  39           HA       LEU  39  15.568  -8.175 -11.805
  305    HB2  LEU  39           HB2      LEU  39  16.793  -8.910 -13.797
  306    HB3  LEU  39           HB3      LEU  39  18.253  -8.084 -13.270
  307    HG   LEU  39           HG       LEU  39  18.108 -10.616 -13.091
  308   HD11  LEU  39          1HD1      LEU  39  19.884  -9.235 -12.081
  309   HD12  LEU  39          2HD1      LEU  39  18.918  -9.104 -10.585
  310   HD13  LEU  39          3HD1      LEU  39  19.512 -10.687 -11.130
  311   HD21  LEU  39          3HD2      LEU  39  16.591  -9.990 -10.532
  312   HD22  LEU  39          1HD2      LEU  39  15.901 -10.757 -11.993
  313   HD23  LEU  39          2HD2      LEU  39  17.186 -11.576 -11.083
  314    H    MET  40           H        MET  40  15.847  -8.108  -9.598
  315    HA   MET  40           HA       MET  40  17.708  -6.020  -8.654
  316    HB2  MET  40           HB2      MET  40  15.696  -7.538  -6.975
  317    HB3  MET  40           HB3      MET  40  16.469  -5.997  -6.631
  318    HG2  MET  40           HG2      MET  40  14.114  -6.658  -8.307
  319    HG3  MET  40           HG3      MET  40  14.403  -5.254  -7.296
  320    HE1  MET  40           HE3      MET  40  16.691  -3.147  -9.851
  321    HE2  MET  40           HE1      MET  40  15.825  -2.986  -8.306
  322    HE3  MET  40           HE2      MET  40  17.147  -4.168  -8.455
  323    H    LYS  41           H        LYS  41  19.442  -6.378  -7.296
  324    HA   LYS  41           HA       LYS  41  19.758  -9.058  -6.170
  325    HB2  LYS  41           HB2      LYS  41  22.311  -8.735  -7.068
  326    HB3  LYS  41           HB3      LYS  41  21.074  -9.776  -7.788
  327    HG2  LYS  41           HG2      LYS  41  20.513  -8.176  -9.442
  328    HG3  LYS  41           HG3      LYS  41  21.504  -6.905  -8.674
  329    HD2  LYS  41           2HD      LYS  41  23.539  -8.227  -9.107
  330    HD3  LYS  41           3HD      LYS  41  22.568  -9.523  -9.833
  331    HE2  LYS  41           HE2      LYS  41  21.771  -7.956 -11.573
  332    HE3  LYS  41           HE3      LYS  41  22.721  -6.647 -10.834
  333    HZ1  LYS  41           3HZ      LYS  41  24.703  -7.906 -11.291
  334    HZ2  LYS  41           1HZ      LYS  41  23.836  -9.128 -11.966
  335    HZ3  LYS  41           2HZ      LYS  41  23.866  -7.646 -12.681
  336    H    ASP  42           H        ASP  42  21.351  -9.260  -4.573
  337    HA   ASP  42           HA       ASP  42  21.460  -7.089  -2.747
  338    HB2  ASP  42           HB2      ASP  42  21.443  -9.638  -2.367
  339    HB3  ASP  42           HB3      ASP  42  23.176  -9.571  -2.725
  340    H    ARG  43           H        ARG  43  23.457  -6.219  -1.753
  341    HA   ARG  43           HA       ARG  43  25.402  -5.509  -3.884
  342    HB2  ARG  43           HB2      ARG  43  25.802  -3.484  -2.611
  343    HB3  ARG  43           HB3      ARG  43  24.067  -3.677  -2.932
  344    HG2  ARG  43           HG2      ARG  43  23.759  -4.587  -0.631
  345    HG3  ARG  43           HG3      ARG  43  25.496  -4.356  -0.325
  346    HD2  ARG  43           2HD      ARG  43  25.243  -1.929  -0.736
  347    HD3  ARG  43           3HD      ARG  43  23.513  -2.161  -1.039
  348    HE   ARG  43           HE       ARG  43  23.124  -2.384   1.237
  349   HH11  ARG  43          1HH1      ARG  43  26.614  -2.475   0.632
  350   HH12  ARG  43          2HH1      ARG  43  27.025  -2.359   2.326
  351   HH21  ARG  43          1HH2      ARG  43  23.701  -2.217   3.441
  352   HH22  ARG  43          2HH2      ARG  43  25.387  -2.206   3.903
  353    H    GLU  44           H        GLU  44  25.176  -7.566  -1.266
  354    HA   GLU  44           HA       GLU  44  28.117  -7.389  -0.752
  355    HB2  GLU  44           HB2      GLU  44  25.913  -8.521   1.006
  356    HB3  GLU  44           HB3      GLU  44  27.642  -8.523   1.380
  357    HG2  GLU  44           HG2      GLU  44  27.642  -6.026   1.266
  358    HG3  GLU  44           HG3      GLU  44  25.893  -6.057   1.000
  359    H    THR  45           H        THR  45  25.592  -9.302  -2.144
  360    HA   THR  45           HA       THR  45  27.536 -11.559  -2.419
  361    HB   THR  45           HB       THR  45  25.722 -13.139  -2.348
  362    HG1  THR  45           1HG      THR  45  23.595 -12.359  -1.961
  363   HG21  THR  45          1HG2      THR  45  25.263 -11.135  -0.114
  364   HG22  THR  45          HG22      THR  45  24.950 -12.890  -0.072
  365   HG23  THR  45          HG32      THR  45  26.634 -12.285  -0.181
  366    H    ASN  46           H        ASN  46  25.495  -9.225  -3.936
  367    HA   ASN  46           HA       ASN  46  25.041  -8.810  -6.098
  368    HB2  ASN  46           HB2      ASN  46  27.578  -9.489  -6.045
  369    HB3  ASN  46           HB3      ASN  46  27.035 -10.884  -6.984
  370   HD21  ASN  46          2HD2      ASN  46  28.661  -9.698  -8.474
  371   HD22  ASN  46          1HD2      ASN  46  27.955  -8.562  -9.612
  372    H    LYS  47           H        LYS  47  24.066 -11.447  -4.585
  373    HA   LYS  47           HA       LYS  47  23.014 -13.027  -6.820
  374    HB2  LYS  47           HB2      LYS  47  22.693 -13.107  -3.799
  375    HB3  LYS  47           HB3      LYS  47  21.770 -14.156  -4.872
  376    HG2  LYS  47           HG2      LYS  47  24.792 -13.973  -4.985
  377    HG3  LYS  47           HG3      LYS  47  23.944 -15.125  -3.911
  378    HD2  LYS  47           2HD      LYS  47  22.803 -16.078  -5.928
  379    HD3  LYS  47           3HD      LYS  47  23.781 -14.999  -6.957
  380    HE2  LYS  47           HE2      LYS  47  25.844 -15.971  -5.942
  381    HE3  LYS  47           HE3      LYS  47  24.833 -17.093  -5.019
  382    HZ1  LYS  47           3HZ      LYS  47  25.619 -18.125  -7.022
  383    HZ2  LYS  47           1HZ      LYS  47  23.990 -17.930  -7.146
  384    HZ3  LYS  47           2HZ      LYS  47  24.996 -16.926  -7.959
  385    H    SER  48           H        SER  48  20.880 -13.230  -7.357
  386    HA   SER  48           HA       SER  48  19.388 -10.846  -7.466
  387    HB2  SER  48           HB2      SER  48  18.380 -13.696  -7.763
  388    HB3  SER  48           HB3      SER  48  17.585 -12.221  -8.370
  389    HG   SER  48           HG       SER  48  18.910 -13.253  -9.963
  390    H    ARG  49           H        ARG  49  17.729  -9.985  -6.299
  391    HA   ARG  49           HA       ARG  49  17.541 -10.687  -3.499
  392    HB2  ARG  49           HB2      ARG  49  15.902  -8.793  -5.223
  393    HB3  ARG  49           HB3      ARG  49  15.924  -8.798  -3.449
  394    HG2  ARG  49           HG2      ARG  49  18.613  -8.590  -4.617
  395    HG3  ARG  49           HG3      ARG  49  17.543  -7.299  -5.184
  396    HD2  ARG  49           2HD      ARG  49  18.025  -7.986  -2.265
  397    HD3  ARG  49           3HD      ARG  49  18.874  -6.721  -3.186
  398    HE   ARG  49           HE       ARG  49  16.098  -6.627  -2.228
  399   HH11  ARG  49          1HH1      ARG  49  18.609  -5.222  -4.304
  400   HH12  ARG  49          2HH1      ARG  49  17.802  -3.670  -4.391
  401   HH21  ARG  49          1HH2      ARG  49  15.116  -4.542  -2.359
  402   HH22  ARG  49          2HH2      ARG  49  15.892  -3.293  -3.315
  403    H    GLY  50           H        GLY  50  16.239 -12.091  -6.197
  404    HA2  GLY  50           2HA      GLY  50  14.760 -13.900  -6.229
  405    HA3  GLY  50           3HA      GLY  50  14.124 -13.429  -4.644
  406    H    PHE  51           H        PHE  51  14.200 -10.605  -6.531
  407    HA   PHE  51           HA       PHE  51  11.676 -11.236  -7.930
  408    HB2  PHE  51           HB2      PHE  51  10.462  -9.445  -7.031
  409    HB3  PHE  51           HB3      PHE  51  11.080 -10.377  -5.670
  410    HD1  PHE  51           HD1      PHE  51  13.118  -9.469  -4.392
  411    HD2  PHE  51           HD2      PHE  51  10.924  -7.156  -7.280
  412    HE1  PHE  51           HE1      PHE  51  14.040  -7.379  -3.426
  413    HE2  PHE  51           HE2      PHE  51  11.785  -5.069  -6.258
  414    HZ   PHE  51           HZ       PHE  51  13.364  -5.170  -4.375
  415    H    ALA  52           H        ALA  52  11.089  -9.607  -9.535
  416    HA   ALA  52           HA       ALA  52  13.207  -7.760 -10.400
  417    HB1  ALA  52           1HB      ALA  52  12.385 -10.217 -12.007
  418    HB2  ALA  52           HB2      ALA  52  13.477  -8.942 -12.566
  419    HB3  ALA  52           HB3      ALA  52  13.957  -9.986 -11.206
  420    H    PHE  53           H        PHE  53  12.494  -7.011 -12.792
  421    HA   PHE  53           HA       PHE  53   9.554  -6.866 -13.014
  422    HB2  PHE  53           HB2      PHE  53  11.349  -4.391 -12.963
  423    HB3  PHE  53           HB3      PHE  53   9.647  -4.403 -13.333
  424    HD1  PHE  53           HD1      PHE  53  12.175  -5.099 -10.705
  425    HD2  PHE  53           HD2      PHE  53   8.054  -4.263 -11.572
  426    HE1  PHE  53           HE1      PHE  53  11.736  -4.817  -8.293
  427    HE2  PHE  53           HE2      PHE  53   7.599  -3.973  -9.147
  428    HZ   PHE  53           HZ       PHE  53   9.442  -4.278  -7.502
  429    H    VAL  54           H        VAL  54   8.885  -5.978 -15.154
  430    HA   VAL  54           HA       VAL  54  10.950  -5.839 -17.235
  431    HB   VAL  54           HB       VAL  54  10.593  -8.273 -17.121
  432   HG11  VAL  54          1HG1      VAL  54   7.696  -7.789 -17.394
  433   HG12  VAL  54          HG21      VAL  54   8.597  -9.352 -17.410
  434   HG13  VAL  54          HG31      VAL  54   8.627  -8.344 -15.944
  435   HG21  VAL  54          HG32      VAL  54   8.898  -7.201 -19.433
  436   HG22  VAL  54          1HG2      VAL  54  10.668  -7.115 -19.438
  437   HG23  VAL  54          HG22      VAL  54   9.852  -8.699 -19.399
  438    H    THR  55           H        THR  55  10.309  -4.581 -18.936
  439    HA   THR  55           HA       THR  55   7.483  -3.630 -18.878
  440    HB   THR  55           HB       THR  55   9.911  -2.172 -19.981
  441    HG1  THR  55           1HG      THR  55   8.448  -1.801 -17.576
  442   HG21  THR  55          1HG2      THR  55   7.012  -1.370 -19.461
  443   HG22  THR  55          HG22      THR  55   8.313  -0.251 -19.939
  444   HG23  THR  55          HG32      THR  55   7.788  -1.539 -21.046
  445    H    PHE  56           H        PHE  56   6.254  -4.309 -20.441
  446    HA   PHE  56           HA       PHE  56   7.372  -5.388 -22.945
  447    HB2  PHE  56           HB2      PHE  56   4.627  -5.259 -21.671
  448    HB3  PHE  56           HB3      PHE  56   4.894  -5.855 -23.306
  449    HD1  PHE  56           HD1      PHE  56   6.353  -6.463 -19.844
  450    HD2  PHE  56           HD2      PHE  56   5.081  -8.070 -23.630
  451    HE1  PHE  56           HE1      PHE  56   6.857  -8.742 -19.047
  452    HE2  PHE  56           HE2      PHE  56   5.524 -10.351 -22.810
  453    HZ   PHE  56           HZ       PHE  56   6.364 -10.705 -20.494
  454    H    GLU  57           H        GLU  57   6.659  -4.674 -25.060
  455    HA   GLU  57           HA       GLU  57   6.246  -1.835 -25.319
  456    HB2  GLU  57           HB2      GLU  57   6.408  -4.240 -27.161
  457    HB3  GLU  57           HB3      GLU  57   5.815  -2.684 -27.741
  458    HG2  GLU  57           HG2      GLU  57   7.916  -1.615 -26.804
  459    HG3  GLU  57           HG3      GLU  57   8.540  -3.254 -26.528
  460    H    SER  58           H        SER  58   4.102  -4.652 -25.045
  461    HA   SER  58           HA       SER  58   1.820  -2.772 -25.496
  462    HB2  SER  58           HB2      SER  58   1.816  -4.415 -27.260
  463    HB3  SER  58           HB3      SER  58   2.075  -5.730 -26.091
  464    HG   SER  58           HG       SER  58  -0.130  -5.474 -26.743
  465    HA   PRO  59           HA       PRO  59   1.050  -3.551 -21.271
  466    HB2  PRO  59           HB2      PRO  59  -1.471  -2.606 -21.009
  467    HB3  PRO  59           HB3      PRO  59  -0.125  -1.495 -21.460
  468    HG2  PRO  59           HG2      PRO  59  -2.039  -2.936 -23.314
  469    HG3  PRO  59           HG3      PRO  59  -1.742  -1.171 -23.234
  470    HD2  PRO  59           2HD      PRO  59  -0.397  -2.720 -25.012
  471    HD3  PRO  59           3HD      PRO  59   0.496  -1.454 -24.109
  472    H    ALA  60           H        ALA  60  -0.434  -5.210 -23.877
  473    HA   ALA  60           HA       ALA  60  -1.964  -6.937 -22.003
  474    HB1  ALA  60           1HB      ALA  60  -3.365  -5.769 -23.627
  475    HB2  ALA  60           HB2      ALA  60  -2.399  -6.438 -24.973
  476    HB3  ALA  60           HB3      ALA  60  -3.361  -7.520 -23.928
  477    H    ASP  61           H        ASP  61   0.744  -6.787 -24.213
  478    HA   ASP  61           HA       ASP  61   1.021  -9.660 -24.508
  479    HB2  ASP  61           HB2      ASP  61   3.013  -7.335 -24.576
  480    HB3  ASP  61           HB3      ASP  61   3.459  -8.972 -24.830
  481    H    ALA  62           H        ALA  62   1.676  -7.207 -22.078
  482    HA   ALA  62           HA       ALA  62   3.211  -8.935 -20.326
  483    HB1  ALA  62           1HB      ALA  62   1.742  -6.301 -19.886
  484    HB2  ALA  62           HB2      ALA  62   2.825  -7.086 -18.715
  485    HB3  ALA  62           HB3      ALA  62   3.465  -6.515 -20.286
  486    H    LYS  63           H        LYS  63  -0.243  -8.102 -20.795
  487    HA   LYS  63           HA       LYS  63  -1.168  -9.356 -18.359
  488    HB2  LYS  63           HB2      LYS  63  -2.515  -8.807 -21.038
  489    HB3  LYS  63           HB3      LYS  63  -3.353  -9.495 -19.639
  490    HG2  LYS  63           HG2      LYS  63  -2.902  -7.520 -18.290
  491    HG3  LYS  63           HG3      LYS  63  -1.883  -6.838 -19.568
  492    HD2  LYS  63           2HD      LYS  63  -4.118  -5.788 -19.545
  493    HD3  LYS  63           3HD      LYS  63  -3.820  -6.636 -21.063
  494    HE2  LYS  63           HE2      LYS  63  -5.083  -8.610 -20.202
  495    HE3  LYS  63           HE3      LYS  63  -5.388  -7.749 -18.690
  496    HZ1  LYS  63           3HZ      LYS  63  -6.573  -6.081 -19.944
  497    HZ2  LYS  63           1HZ      LYS  63  -6.300  -6.888 -21.353
  498    HZ3  LYS  63           2HZ      LYS  63  -7.242  -7.560 -20.187
  499    H    ASP  64           H        ASP  64  -0.533 -10.453 -21.712
  500    HA   ASP  64           HA       ASP  64  -1.708 -13.033 -21.358
  501    HB2  ASP  64           HB2      ASP  64  -1.144 -11.804 -23.512
  502    HB3  ASP  64           HB3      ASP  64   0.552 -12.196 -23.215
  503    H    ALA  65           H        ALA  65   1.572 -11.730 -20.834
  504    HA   ALA  65           HA       ALA  65   2.733 -14.292 -20.155
  505    HB1  ALA  65           1HB      ALA  65   4.619 -13.011 -19.385
  506    HB2  ALA  65           HB2      ALA  65   4.018 -12.228 -20.864
  507    HB3  ALA  65           HB3      ALA  65   3.642 -11.521 -19.283
  508    H    ALA  66           H        ALA  66   1.301 -11.572 -18.283
  509    HA   ALA  66           HA       ALA  66   1.874 -12.783 -15.748
  510    HB1  ALA  66           1HB      ALA  66  -0.129 -10.599 -16.523
  511    HB2  ALA  66           HB2      ALA  66   0.483 -10.925 -14.884
  512    HB3  ALA  66           HB3      ALA  66   1.580 -10.323 -16.149
  513    H    ARG  67           H        ARG  67  -0.374 -13.537 -18.135
  514    HA   ARG  67           HA       ARG  67  -2.178 -14.933 -16.227
  515    HB2  ARG  67           HB2      ARG  67  -2.406 -14.177 -19.155
  516    HB3  ARG  67           HB3      ARG  67  -3.568 -15.244 -18.348
  517    HG2  ARG  67           HG2      ARG  67  -4.215 -13.545 -16.781
  518    HG3  ARG  67           HG3      ARG  67  -2.894 -12.479 -17.265
  519    HD2  ARG  67           2HD      ARG  67  -4.974 -11.694 -18.220
  520    HD3  ARG  67           3HD      ARG  67  -3.914 -12.244 -19.523
  521    HE   ARG  67           HE       ARG  67  -5.742 -14.308 -18.554
  522   HH11  ARG  67          1HH1      ARG  67  -5.372 -11.592 -20.790
  523   HH12  ARG  67          2HH1      ARG  67  -6.628 -12.161 -21.867
  524   HH21  ARG  67          1HH2      ARG  67  -7.369 -15.027 -19.987
  525   HH22  ARG  67          2HH2      ARG  67  -7.741 -14.095 -21.419
  526    H    ASP  68           H        ASP  68   0.745 -15.710 -17.557
  527    HA   ASP  68           HA       ASP  68  -0.119 -18.502 -18.164
  528    HB2  ASP  68           HB2      ASP  68   1.425 -16.458 -19.686
  529    HB3  ASP  68           HB3      ASP  68   2.273 -17.947 -19.468
  530    H    MET  69           H        MET  69   2.546 -16.282 -17.465
  531    HA   MET  69           HA       MET  69   4.265 -18.313 -16.337
  532    HB2  MET  69           HB2      MET  69   4.308 -15.447 -17.215
  533    HB3  MET  69           HB3      MET  69   5.407 -15.840 -15.950
  534    HG2  MET  69           HG2      MET  69   5.109 -17.219 -18.652
  535    HG3  MET  69           HG3      MET  69   6.411 -16.114 -18.197
  536    HE1  MET  69           HE3      MET  69   6.909 -17.209 -15.184
  537    HE2  MET  69           HE1      MET  69   8.401 -18.114 -15.546
  538    HE3  MET  69           HE2      MET  69   8.083 -16.551 -16.355
  539    H    ASN  70           H        ASN  70   1.720 -16.378 -15.063
  540    HA   ASN  70           HA       ASN  70   2.924 -15.888 -12.472
  541    HB2  ASN  70           HB2      ASN  70   1.065 -14.529 -13.411
  542    HB3  ASN  70           HB3      ASN  70   0.004 -15.941 -13.333
  543   HD21  ASN  70          2HD2      ASN  70  -1.326 -14.453 -11.976
  544   HD22  ASN  70          1HD2      ASN  70  -0.953 -14.334 -10.265
  545    H    GLY  71           H        GLY  71   3.231 -17.295 -10.877
  546    HA2  GLY  71           2HA      GLY  71   2.676 -19.002  -9.377
  547    HA3  GLY  71           3HA      GLY  71   1.361 -19.520 -10.446
  548    H    LYS  72           H        LYS  72   3.816 -19.233 -12.605
  549    HA   LYS  72           HA       LYS  72   4.606 -22.032 -12.567
  550    HB2  LYS  72           HB2      LYS  72   5.520 -19.677 -14.225
  551    HB3  LYS  72           HB3      LYS  72   5.696 -21.383 -14.610
  552    HG2  LYS  72           HG2      LYS  72   3.049 -19.880 -14.475
  553    HG3  LYS  72           HG3      LYS  72   3.875 -20.472 -15.931
  554    HD2  LYS  72           2HD      LYS  72   3.662 -22.806 -15.101
  555    HD3  LYS  72           3HD      LYS  72   2.772 -22.207 -13.683
  556    HE2  LYS  72           HE2      LYS  72   1.052 -21.239 -15.170
  557    HE3  LYS  72           HE3      LYS  72   1.937 -21.832 -16.584
  558    HZ1  LYS  72           3HZ      LYS  72   1.613 -24.070 -15.750
  559    HZ2  LYS  72           1HZ      LYS  72   0.775 -23.505 -14.454
  560    HZ3  LYS  72           2HZ      LYS  72   0.166 -23.324 -15.972
  561    H    SER  73           H        SER  73   7.200 -21.424 -13.638
  562    HA   SER  73           HA       SER  73   8.723 -20.585 -11.214
  563    HB2  SER  73           HB2      SER  73   8.128 -22.994 -11.148
  564    HB3  SER  73           HB3      SER  73   8.962 -23.238 -12.693
  565    HG   SER  73           HG       SER  73  10.275 -23.728 -10.869
  566    H    LEU  74           H        LEU  74  10.884 -20.298 -11.456
  567    HA   LEU  74           HA       LEU  74  11.912 -19.965 -14.219
  568    HB2  LEU  74           HB2      LEU  74  11.160 -17.771 -12.550
  569    HB3  LEU  74           HB3      LEU  74  12.850 -17.956 -12.271
  570    HG   LEU  74           HG       LEU  74  12.580 -16.397 -14.042
  571   HD11  LEU  74          1HD1      LEU  74  13.432 -18.998 -15.368
  572   HD12  LEU  74          2HD1      LEU  74  13.777 -17.356 -15.925
  573   HD13  LEU  74          3HD1      LEU  74  14.479 -17.918 -14.395
  574   HD21  LEU  74          3HD2      LEU  74  11.343 -16.912 -16.090
  575   HD22  LEU  74          1HD2      LEU  74  11.048 -18.580 -15.533
  576   HD23  LEU  74          2HD2      LEU  74  10.286 -17.209 -14.692
  577    H    ASP  75           H        ASP  75  13.878 -20.871 -14.388
  578    HA   ASP  75           HA       ASP  75  15.695 -22.036 -13.787
  579    HB2  ASP  75           HB2      ASP  75  16.063 -19.442 -12.997
  580    HB3  ASP  75           HB3      ASP  75  15.993 -20.121 -11.457
  581    H    GLY  76           H        GLY  76  13.113 -22.715 -12.432
  582    HA2  GLY  76           2HA      GLY  76  12.851 -24.791 -11.410
  583    HA3  GLY  76           3HA      GLY  76  14.378 -24.588 -10.538
  584    H    LYS  77           H        LYS  77  12.856 -21.635 -10.221
  585    HA   LYS  77           HA       LYS  77  11.713 -22.443  -7.590
  586    HB2  LYS  77           HB2      LYS  77  13.002 -19.793  -8.289
  587    HB3  LYS  77           HB3      LYS  77  12.468 -20.344  -6.689
  588    HG2  LYS  77           HG2      LYS  77  14.687 -21.556  -8.381
  589    HG3  LYS  77           HG3      LYS  77  14.916 -20.570  -6.931
  590    HD2  LYS  77           2HD      LYS  77  13.980 -22.251  -5.507
  591    HD3  LYS  77           3HD      LYS  77  13.407 -23.223  -6.875
  592    HE2  LYS  77           HE2      LYS  77  15.676 -23.621  -7.638
  593    HE3  LYS  77           HE3      LYS  77  16.331 -22.598  -6.344
  594    HZ1  LYS  77           3HZ      LYS  77  16.433 -24.926  -5.779
  595    HZ2  LYS  77           1HZ      LYS  77  15.413 -24.149  -4.754
  596    HZ3  LYS  77           2HZ      LYS  77  14.807 -25.092  -5.961
  597    H    ALA  78           H        ALA  78   9.682 -21.883  -7.120
  598    HA   ALA  78           HA       ALA  78   8.026 -21.060  -9.318
  599    HB1  ALA  78           1HB      ALA  78   7.321 -21.446  -6.390
  600    HB2  ALA  78           HB2      ALA  78   6.175 -21.327  -7.748
  601    HB3  ALA  78           HB3      ALA  78   7.302 -22.703  -7.653
  602    H    ILE  79           H        ILE  79   6.947 -19.188  -9.731
  603    HA   ILE  79           HA       ILE  79   7.744 -16.825  -8.097
  604    HB   ILE  79           HB       ILE  79   8.005 -15.565 -10.084
  605   HG12  ILE  79          HG21      ILE  79   7.090 -17.981 -11.698
  606   HG13  ILE  79          HG31      ILE  79   6.081 -16.573 -11.341
  607   HG21  ILE  79          1HG2      ILE  79   9.835 -16.703 -11.188
  608   HG22  ILE  79          HG22      ILE  79   9.891 -17.070  -9.446
  609   HG23  ILE  79          HG32      ILE  79   9.284 -18.283 -10.600
  610   HD11  ILE  79          3HD1      ILE  79   6.965 -16.190 -13.504
  611   HD12  ILE  79          1HD1      ILE  79   7.841 -15.113 -12.413
  612   HD13  ILE  79          2HD1      ILE  79   8.618 -16.611 -12.999
  613    H    LYS  80           H        LYS  80   6.564 -14.864  -8.798
  614    HA   LYS  80           HA       LYS  80   3.645 -15.252  -9.221
  615    HB2  LYS  80           HB2      LYS  80   4.282 -14.431  -6.902
  616    HB3  LYS  80           HB3      LYS  80   5.119 -13.078  -7.667
  617    HG2  LYS  80           HG2      LYS  80   2.923 -12.457  -8.793
  618    HG3  LYS  80           HG3      LYS  80   2.130 -13.668  -7.766
  619    HD2  LYS  80           2HD      LYS  80   2.922 -12.456  -5.746
  620    HD3  LYS  80           3HD      LYS  80   3.770 -11.289  -6.794
  621    HE2  LYS  80           HE2      LYS  80   1.606 -10.676  -7.844
  622    HE3  LYS  80           HE3      LYS  80   0.766 -11.786  -6.754
  623    HZ1  LYS  80           3HZ      LYS  80   1.512 -10.458  -4.909
  624    HZ2  LYS  80           1HZ      LYS  80   2.374  -9.464  -5.896
  625    HZ3  LYS  80           2HZ      LYS  80   0.744  -9.489  -6.002
  626    H    VAL  81           H        VAL  81   2.804 -13.936 -10.894
  627    HA   VAL  81           HA       VAL  81   4.578 -11.779 -11.900
  628    HB   VAL  81           HB       VAL  81   3.031 -13.695 -13.683
  629   HG11  VAL  81          1HG1      VAL  81   3.151 -11.370 -14.546
  630   HG12  VAL  81          HG21      VAL  81   4.917 -11.377 -14.305
  631   HG13  VAL  81          HG31      VAL  81   4.174 -12.462 -15.500
  632   HG21  VAL  81          HG32      VAL  81   6.017 -13.341 -13.196
  633   HG22  VAL  81          1HG2      VAL  81   5.051 -14.769 -12.770
  634   HG23  VAL  81          HG22      VAL  81   5.296 -14.345 -14.476
  635    H    GLU  82           H        GLU  82   3.564  -9.869 -12.158
  636    HA   GLU  82           HA       GLU  82   0.647  -9.689 -12.310
  637    HB2  GLU  82           HB2      GLU  82   1.175 -10.243  -9.894
  638    HB3  GLU  82           HB3      GLU  82   2.121  -8.752  -9.804
  639    HG2  GLU  82           HG2      GLU  82   0.125  -7.413 -10.216
  640    HG3  GLU  82           HG3      GLU  82  -0.816  -8.876 -10.583
  641    H    GLN  83           H        GLN  83  -0.009  -7.307 -12.417
  642    HA   GLN  83           HA       GLN  83   1.991  -5.769 -13.823
  643    HB2  GLN  83           HB2      GLN  83  -0.503  -5.700 -14.169
  644    HB3  GLN  83           HB3      GLN  83  -0.656  -4.821 -12.642
  645    HG2  GLN  83           HG2      GLN  83   1.089  -3.934 -14.982
  646    HG3  GLN  83           HG3      GLN  83  -0.601  -3.453 -14.801
  647   HE21  GLN  83          HE22      GLN  83   1.914  -1.809 -14.782
  648   HE22  GLN  83          HE12      GLN  83   1.881  -0.962 -13.250
  649    H    ALA  84           H        ALA  84   3.388  -4.214 -13.033
  650    HA   ALA  84           HA       ALA  84   3.994  -4.569 -10.220
  651    HB1  ALA  84           1HB      ALA  84   5.996  -3.241 -10.752
  652    HB2  ALA  84           HB2      ALA  84   5.744  -4.534 -11.947
  653    HB3  ALA  84           HB3      ALA  84   5.309  -2.850 -12.344
  654    H    THR  85           H        THR  85   4.151  -3.044  -8.587
  655    HA   THR  85           HA       THR  85   2.724  -0.473  -9.115
  656    HB   THR  85           HB       THR  85   2.194  -0.383  -6.782
  657    HG1  THR  85           1HG      THR  85   3.392  -2.952  -6.624
  658   HG21  THR  85          1HG2      THR  85   0.540  -2.216  -6.678
  659   HG22  THR  85          HG22      THR  85   0.623  -1.564  -8.335
  660   HG23  THR  85          HG32      THR  85   1.421  -3.102  -7.942
  661    H    LYS  86           H        LYS  86   3.408   1.302  -7.616
  662    HA   LYS  86           HA       LYS  86   6.108   1.943  -8.112
  663    HB2  LYS  86           HB2      LYS  86   4.108   3.078  -6.115
  664    HB3  LYS  86           HB3      LYS  86   5.643   3.845  -6.557
  665    HG2  LYS  86           HG2      LYS  86   4.852   3.769  -8.980
  666    HG3  LYS  86           HG3      LYS  86   3.274   3.219  -8.372
  667    HD2  LYS  86           2HD      LYS  86   3.327   5.333  -6.870
  668    HD3  LYS  86           3HD      LYS  86   4.656   5.880  -7.912
  669    HE2  LYS  86           HE2      LYS  86   3.156   5.484  -9.903
  670    HE3  LYS  86           HE3      LYS  86   1.840   5.108  -8.774
  671    HZ1  LYS  86           3HZ      LYS  86   2.084   7.326  -7.866
  672    HZ2  LYS  86           1HZ      LYS  86   3.296   7.665  -8.917
  673    HZ3  LYS  86           2HZ      LYS  86   1.774   7.401  -9.481
  674    HA   PRO  87           HA       PRO  87   8.331  -0.033  -4.891
  675    HB2  PRO  87           HB2      PRO  87  10.492   1.596  -4.555
  676    HB3  PRO  87           HB3      PRO  87  10.227   0.664  -6.049
  677    HG2  PRO  87           HG2      PRO  87   9.457   3.554  -5.541
  678    HG3  PRO  87           HG3      PRO  87  10.394   2.884  -6.921
  679    HD2  PRO  87           2HD      PRO  87   7.724   3.330  -7.122
  680    HD3  PRO  87           3HD      PRO  87   8.453   1.862  -7.843
  681    H    SER  88           H        SER  88   8.964   0.166  -2.642
  682    HA   SER  88           HA       SER  88   7.003   1.633  -1.142
  683    HB2  SER  88           HB2      SER  88   7.859  -0.667  -0.636
  684    HB3  SER  88           HB3      SER  88   9.422   0.036  -0.197
  685    HG   SER  88           HG       SER  88   8.045  -0.270   1.615
  686    H    PHE  89           H        PHE  89  10.083   2.539  -2.335
  687    HA   PHE  89           HA       PHE  89  10.343   4.619  -0.221
  688    HB2  PHE  89           HB2      PHE  89  12.631   4.805  -0.764
  689    HB3  PHE  89           HB3      PHE  89  12.278   3.089  -0.575
  690    HD1  PHE  89           HD2      PHE  89  13.066   5.796  -2.946
  691    HD2  PHE  89           HD1      PHE  89  12.461   1.570  -2.487
  692    HE1  PHE  89           HE2      PHE  89  13.994   5.430  -5.211
  693    HE2  PHE  89           HE1      PHE  89  13.441   1.189  -4.736
  694    HZ   PHE  89           HZ       PHE  89  14.190   3.104  -6.108
  695    H    GLU  90           H        GLU  90   8.766   4.286  -2.983
  696    HA   GLU  90           HA       GLU  90   8.101   5.537  -4.724
  697    HB2  GLU  90           HB2      GLU  90   7.340   7.733  -4.196
  698    HB3  GLU  90           HB3      GLU  90   7.080   6.688  -2.794
  699    HG2  GLU  90           HG2      GLU  90   8.965   7.660  -1.629
  700    HG3  GLU  90           HG3      GLU  90   9.496   8.518  -3.086
  701    H    SER  91           H        SER  91   8.520   8.075  -5.678
  702    HA   SER  91           HA       SER  91  11.399   8.258  -6.281
  703    HB2  SER  91           HB2      SER  91  10.485   6.569  -7.844
  704    HB3  SER  91           HB3      SER  91   9.257   7.729  -8.387
  705    HG   SER  91           HG       SER  91  11.175   7.666  -9.718
  706    H    GLY  92           H        GLY  92  12.003  10.281  -7.136
  707    HA2  GLY  92           2HA      GLY  92  10.171  12.454  -6.518
  708    HA3  GLY  92           3HA      GLY  92  11.842  12.585  -7.096
  709    H    ARG  93           H        ARG  93  10.464  10.482  -9.207
  710    HA   ARG  93           HA       ARG  93   9.914  12.655 -11.170
  711    HB2  ARG  93           HB2      ARG  93  11.780  11.064 -11.579
  712    HB3  ARG  93           HB3      ARG  93  10.624   9.723 -11.548
  713    HG2  ARG  93           HG2      ARG  93   9.401  10.838 -13.473
  714    HG3  ARG  93           HG3      ARG  93  10.734  12.011 -13.561
  715    HD2  ARG  93           2HD      ARG  93  10.971   8.982 -13.797
  716    HD3  ARG  93           3HD      ARG  93  10.989  10.104 -15.164
  717    HE   ARG  93           HE       ARG  93  13.168   9.550 -13.297
  718   HH11  ARG  93          1HH1      ARG  93  11.880  11.855 -15.655
  719   HH12  ARG  93          2HH1      ARG  93  13.438  12.594 -15.947
  720   HH21  ARG  93          1HH2      ARG  93  15.179  10.534 -13.702
  721   HH22  ARG  93          2HH2      ARG  93  15.298  11.845 -14.854
  722    H    ARG  94           H        ARG  94   8.453   9.842  -9.588
  723    HA   ARG  94           HA       ARG  94   5.941  10.338 -11.086
  724    HB2  ARG  94           HB2      ARG  94   7.377   7.661 -10.905
  725    HB3  ARG  94           HB3      ARG  94   5.708   7.880 -11.466
  726    HG2  ARG  94           HG2      ARG  94   6.557   9.389 -13.273
  727    HG3  ARG  94           HG3      ARG  94   8.221   9.012 -12.761
  728    HD2  ARG  94           2HD      ARG  94   7.757   6.593 -13.105
  729    HD3  ARG  94           3HD      ARG  94   6.122   7.000 -13.666
  730    HE   ARG  94           HE       ARG  94   8.074   8.442 -15.193
  731   HH11  ARG  94          1HH1      ARG  94   6.688   5.209 -14.773
  732   HH12  ARG  94          2HH1      ARG  94   7.061   4.711 -16.404
  733   HH21  ARG  94          1HH2      ARG  94   8.537   7.765 -17.325
  734   HH22  ARG  94          2HH2      ARG  94   8.079   6.165 -17.857
  735    H    GLY  95           H        GLY  95   7.184  10.370  -8.131
  736    HA2  GLY  95           2HA      GLY  95   5.649   8.499  -6.620
  737    HA3  GLY  95           3HA      GLY  95   6.379   9.995  -6.014
  738    H5'    A  96           H5'        A  96   5.429 -11.020   3.110
  739   H5''    A  96          H5''        A  96   6.072 -10.143   4.496
  740    H4'    A  96           H4'        A  96   5.551 -13.165   4.328
  741    H3'    A  96           H3'        A  96   3.923 -10.844   5.092
  742    H2'    A  96           H2'        A  96   3.725 -11.147   7.393
  743   HO2'    A  96          HO2'        A  96   3.127 -13.413   7.163
  744    H1'    A  96           H1'        A  96   6.150 -12.110   8.060
  745    H8     A  96           H8         A  96   7.934 -10.172   5.881
  746    H61    A  96           H61        A  96   5.900  -4.857   8.355
  747    H62    A  96           H62        A  96   7.133  -5.581   7.339
  748    H2     A  96           H2         A  96   3.180  -8.109   9.657
  749   HO5'    A  96          H5T         A  96   7.677 -10.704   2.922
  750    H5'    U  97           H5'        U  97   1.521 -10.681   5.145
  751   H5''    U  97          H5''        U  97   0.289 -11.018   3.920
  752    H4'    U  97           H4'        U  97   1.086  -9.036   2.623
  753    H3'    U  97           H3'        U  97   3.251  -9.040   4.428
  754    H2'    U  97           H2'        U  97   2.687  -7.535   6.100
  755   HO2'    U  97          HO2'        U  97   2.986  -5.795   4.649
  756    H1'    U  97           H1'        U  97   0.028  -6.890   5.685
  757    H3     U  97           H3         U  97  -1.782  -9.420   8.944
  758    H5     U  97           H5         U  97   2.114 -10.908   8.550
  759    H6     U  97           H6         U  97   2.378  -9.535   6.545
  760    H5'    C  98           H5'        C  98   5.814  -7.246   0.465
  761   H5''    C  98          H5''        C  98   4.434  -8.353   0.376
  762    H4'    C  98           H4'        C  98   7.268  -9.248   1.019
  763    H3'    C  98           H3'        C  98   6.733  -8.101  -1.390
  764    H2'    C  98           H2'        C  98   4.668  -9.239  -1.718
  765   HO2'    C  98          HO2'        C  98   6.687 -10.778  -3.005
  766    H1'    C  98           H1'        C  98   5.914 -11.895  -1.055
  767    H41    C  98           H41        C  98  -0.349 -13.086  -1.319
  768    H42    C  98           H42        C  98  -0.675 -11.879  -0.090
  769    H5     C  98           H5         C  98   1.079 -10.474   0.880
  770    H6     C  98           H6         C  98   3.473  -9.985   0.834
  771    H5'    A  99           H5'        A  99   9.585  -6.245  -1.186
  772   H5''    A  99          H5''        A  99   8.011  -6.679  -1.896
  773    H4'    A  99           H4'        A  99  10.448  -6.044  -3.591
  774    H3'    A  99           H3'        A  99   9.237  -4.158  -1.925
  775    H2'    A  99           H2'        A  99   7.084  -4.357  -3.045
  776   HO2'    A  99          HO2'        A  99   8.460  -2.172  -3.650
  777    H1'    A  99           H1'        A  99   8.763  -4.536  -5.553
  778    H8     A  99           H8         A  99   6.961  -3.567  -7.043
  779    H61    A  99           H61        A  99   1.833  -7.069  -7.120
  780    H62    A  99           H62        A  99   2.681  -5.753  -7.903
  781    H2     A  99           H2         A  99   4.361  -8.360  -3.695
  782    H5'    A 100           H5'        A 100  12.990  -3.551  -3.627
  783   H5''    A 100          H5''        A 100  13.882  -2.060  -3.309
  784    H4'    A 100           H4'        A 100  14.657  -3.366  -5.359
  785    H3'    A 100           H3'        A 100  14.621  -0.684  -4.887
  786    H2'    A 100           H2'        A 100  12.477  -0.348  -5.872
  787   HO2'    A 100          HO2'        A 100  12.878   0.641  -7.938
  788    H1'    A 100           H1'        A 100  13.349  -2.097  -8.171
  789    H8     A 100           H8         A 100  10.253  -2.041  -5.837
  790    H61    A 100           H61        A 100   7.135  -0.290 -10.939
  791    H62    A 100           H62        A 100   6.969  -0.765  -9.259
  792    H2     A 100           H2         A 100  11.451  -0.486 -11.932
  793    H5'    A 101           H5'        A 101  16.046   1.055  -6.979
  794   H5''    A 101          H5''        A 101  17.654   0.652  -7.605
  795    H4'    A 101           H4'        A 101  17.396   3.038  -7.225
  796    H3'    A 101           H3'        A 101  19.610   1.585  -6.556
  797   HO3'    A 101          H3T         A 101  20.547   3.694  -6.078
  798    H2'    A 101           H2'        A 101  19.052   1.113  -4.334
  799   HO2'    A 101          HO2'        A 101  21.023   2.277  -4.227
  800    H1'    A 101           H1'        A 101  18.036   3.888  -3.810
  801    H8     A 101           H8         A 101  17.636   0.087  -3.314
  802    H61    A 101           H61        A 101  14.384   1.648   1.748
  803    H62    A 101           H62        A 101  15.063   0.300   0.849
  804    H2     A 101           H2         A 101  15.317   5.352  -0.485
  Start of MODEL    5
    1    H1   MET   1           H1       MET   1  -4.412   3.297  -1.019
    2    H2   MET   1           H2       MET   1  -3.518   4.450  -0.256
    3    H3   MET   1           H3       MET   1  -2.856   2.978  -0.583
    4    HA   MET   1           HA       MET   1  -3.708   4.939  -2.602
    5    HB2  MET   1           HB2      MET   1  -1.683   5.617  -1.332
    6    HB3  MET   1           HB3      MET   1  -0.894   4.102  -1.819
    7    HG2  MET   1           HG2      MET   1  -0.243   5.936  -3.296
    8    HG3  MET   1           HG3      MET   1  -1.163   4.721  -4.188
    9    HE1  MET   1           HE1      MET   1  -0.505   7.584  -5.285
   10    HE2  MET   1           HE2      MET   1  -1.486   6.416  -6.201
   11    HE3  MET   1           HE3      MET   1  -2.062   8.083  -5.989
   12    H    VAL   2           H        VAL   2  -4.527   3.900  -4.291
   13    HA   VAL   2           HA       VAL   2  -3.332   1.306  -5.057
   14    HB   VAL   2           HB       VAL   2  -5.725   1.275  -4.832
   15   HG11  VAL   2          1HG1      VAL   2  -6.223   3.689  -5.212
   16   HG12  VAL   2          HG21      VAL   2  -5.883   3.462  -6.946
   17   HG13  VAL   2          HG31      VAL   2  -7.238   2.612  -6.192
   18   HG21  VAL   2          HG32      VAL   2  -4.905   1.320  -7.762
   19   HG22  VAL   2          1HG2      VAL   2  -4.668  -0.041  -6.631
   20   HG23  VAL   2          HG22      VAL   2  -6.310   0.475  -7.072
   21    H    GLU   3           H        GLU   3  -1.619   1.498  -6.278
   22    HA   GLU   3           HA       GLU   3  -1.632   3.497  -8.476
   23    HB2  GLU   3           HB2      GLU   3   0.725   4.036  -7.921
   24    HB3  GLU   3           HB3      GLU   3  -0.427   4.513  -6.660
   25    HG2  GLU   3           HG2      GLU   3   0.134   2.365  -5.440
   26    HG3  GLU   3           HG3      GLU   3   1.418   2.093  -6.629
   27    H    ALA   4           H        ALA   4  -0.666   2.908 -10.337
   28    HA   ALA   4           HA       ALA   4   0.789   0.342 -10.507
   29    HB1  ALA   4           1HB      ALA   4  -0.705  -0.337 -12.414
   30    HB2  ALA   4           HB2      ALA   4  -1.564  -0.283 -10.853
   31    HB3  ALA   4           HB3      ALA   4  -1.767   1.030 -12.034
   32    H    ASP   5           H        ASP   5   2.647   1.246 -11.188
   33    HA   ASP   5           HA       ASP   5   2.652   3.507 -13.027
   34    HB2  ASP   5           HB2      ASP   5   4.237   3.440 -11.218
   35    HB3  ASP   5           HB3      ASP   5   4.835   1.856 -11.718
   36    H    ARG   6           H        ARG   6   2.792   3.481 -15.095
   37    HA   ARG   6           HA       ARG   6   2.859   2.871 -17.246
   38    HB2  ARG   6           HB2      ARG   6   5.199   3.262 -16.626
   39    HB3  ARG   6           HB3      ARG   6   5.419   1.522 -16.345
   40    HG2  ARG   6           HG2      ARG   6   4.841   1.060 -18.702
   41    HG3  ARG   6           HG3      ARG   6   4.538   2.793 -18.985
   42    HD2  ARG   6           2HD      ARG   6   6.889   3.291 -18.411
   43    HD3  ARG   6           3HD      ARG   6   7.195   1.558 -18.157
   44    HE   ARG   6           HE       ARG   6   6.128   1.782 -20.736
   45   HH11  ARG   6          1HH1      ARG   6   8.973   3.000 -19.016
   46   HH12  ARG   6          2HH1      ARG   6   9.943   3.103 -20.467
   47   HH21  ARG   6          1HH2      ARG   6   7.421   1.926 -22.603
   48   HH22  ARG   6          2HH2      ARG   6   9.071   2.491 -22.483
   49    HA   PRO   7           HA       PRO   7   0.862  -1.202 -17.549
   50    HB2  PRO   7           HB2      PRO   7   0.630   0.052 -20.287
   51    HB3  PRO   7           HB3      PRO   7  -0.599  -0.930 -19.413
   52    HG2  PRO   7           HG2      PRO   7  -0.822   1.725 -19.535
   53    HG3  PRO   7           HG3      PRO   7  -1.055   0.905 -17.944
   54    HD2  PRO   7           2HD      PRO   7   1.413   2.343 -18.974
   55    HD3  PRO   7           3HD      PRO   7   0.660   2.425 -17.342
   56    H    GLY   8           H        GLY   8   1.717  -3.135 -18.477
   57    HA2  GLY   8           2HA      GLY   8   3.014  -4.356 -20.017
   58    HA3  GLY   8           3HA      GLY   8   3.849  -2.862 -20.505
   59    H    LYS   9           H        LYS   9   4.019  -2.162 -17.460
   60    HA   LYS   9           HA       LYS   9   6.524  -3.601 -17.012
   61    HB2  LYS   9           HB2      LYS   9   6.342  -1.207 -16.416
   62    HB3  LYS   9           HB3      LYS   9   5.111  -1.629 -15.195
   63    HG2  LYS   9           HG2      LYS   9   6.740  -3.189 -14.120
   64    HG3  LYS   9           HG3      LYS   9   7.967  -2.696 -15.303
   65    HD2  LYS   9           2HD      LYS   9   6.565  -0.801 -13.378
   66    HD3  LYS   9           3HD      LYS   9   8.131  -1.589 -13.065
   67    HE2  LYS   9           HE2      LYS   9   9.078  -0.521 -15.078
   68    HE3  LYS   9           HE3      LYS   9   7.524   0.242 -15.429
   69    HZ1  LYS   9           3HZ      LYS   9   7.701   1.485 -13.429
   70    HZ2  LYS   9           1HZ      LYS   9   9.080   0.705 -12.970
   71    HZ3  LYS   9           2HZ      LYS   9   9.085   1.699 -14.279
   72    H    LEU  10           H        LEU  10   6.772  -5.363 -15.831
   73    HA   LEU  10           HA       LEU  10   4.444  -6.372 -14.241
   74    HB2  LEU  10           HB2      LEU  10   6.562  -7.789 -15.872
   75    HB3  LEU  10           HB3      LEU  10   5.477  -8.653 -14.844
   76    HG   LEU  10           HG       LEU  10   4.659  -6.964 -17.250
   77   HD11  LEU  10          1HD1      LEU  10   4.433  -9.963 -16.697
   78   HD12  LEU  10          2HD1      LEU  10   4.197  -9.137 -18.253
   79   HD13  LEU  10          3HD1      LEU  10   5.825  -9.252 -17.525
   80   HD21  LEU  10          3HD2      LEU  10   2.993  -8.583 -15.289
   81   HD22  LEU  10          1HD2      LEU  10   2.868  -6.833 -15.644
   82   HD23  LEU  10          2HD2      LEU  10   2.416  -8.030 -16.877
   83    H    PHE  11           H        PHE  11   4.962  -7.658 -12.426
   84    HA   PHE  11           HA       PHE  11   7.637  -7.166 -11.204
   85    HB2  PHE  11           HB2      PHE  11   5.889  -6.128  -9.893
   86    HB3  PHE  11           HB3      PHE  11   4.860  -7.557 -10.033
   87    HD1  PHE  11           HD1      PHE  11   8.151  -6.418  -8.677
   88    HD2  PHE  11           HD2      PHE  11   4.935  -9.256  -8.403
   89    HE1  PHE  11           HE1      PHE  11   9.140  -7.335  -6.598
   90    HE2  PHE  11           HE2      PHE  11   5.947 -10.196  -6.334
   91    HZ   PHE  11           HZ       PHE  11   8.067  -9.228  -5.449
   92    H    ILE  12           H        ILE  12   8.851  -8.937 -10.797
   93    HA   ILE  12           HA       ILE  12   7.589 -11.600 -11.278
   94    HB   ILE  12           HB       ILE  12  10.458 -10.945 -11.945
   95   HG12  ILE  12          HG21      ILE  12   9.268  -9.332 -13.301
   96   HG13  ILE  12          HG31      ILE  12   9.920 -10.645 -14.282
   97   HG21  ILE  12          1HG2      ILE  12   9.751 -13.289 -11.760
   98   HG22  ILE  12          HG22      ILE  12   8.464 -13.004 -12.950
   99   HG23  ILE  12          HG32      ILE  12  10.171 -12.873 -13.443
  100   HD11  ILE  12          3HD1      ILE  12   7.766 -10.098 -15.128
  101   HD12  ILE  12          1HD1      ILE  12   7.611 -11.673 -14.330
  102   HD13  ILE  12          2HD1      ILE  12   7.010 -10.201 -13.528
  103    H    GLY  13           H        GLY  13   7.290 -11.776  -8.920
  104    HA2  GLY  13           2HA      GLY  13   9.772 -11.705  -7.293
  105    HA3  GLY  13           3HA      GLY  13   8.131 -11.809  -6.687
  106    H    GLY  14           H        GLY  14  10.665 -13.527  -6.272
  107    HA2  GLY  14           2HA      GLY  14  10.357 -15.613  -5.146
  108    HA3  GLY  14           3HA      GLY  14   9.090 -16.053  -6.300
  109    H    LEU  15           H        LEU  15  11.801 -14.547  -7.752
  110    HA   LEU  15           HA       LEU  15  12.357 -16.795  -9.405
  111    HB2  LEU  15           HB2      LEU  15  14.032 -14.315  -8.840
  112    HB3  LEU  15           HB3      LEU  15  14.217 -15.441 -10.216
  113    HG   LEU  15           HG       LEU  15  11.587 -14.027  -9.806
  114   HD11  LEU  15          1HD1      LEU  15  14.052 -13.011 -11.296
  115   HD12  LEU  15          2HD1      LEU  15  12.421 -12.305 -11.376
  116   HD13  LEU  15          3HD1      LEU  15  13.322 -12.272  -9.847
  117   HD21  LEU  15          3HD2      LEU  15  11.483 -14.447 -12.241
  118   HD22  LEU  15          1HD2      LEU  15  13.143 -15.073 -12.218
  119   HD23  LEU  15          2HD2      LEU  15  11.859 -15.967 -11.381
  120    H    ASN  16           H        ASN  16  14.644 -17.603  -9.790
  121    HA   ASN  16           HA       ASN  16  15.183 -19.285  -7.555
  122    HB2  ASN  16           HB2      ASN  16  15.045 -20.011  -9.835
  123    HB3  ASN  16           HB3      ASN  16  16.408 -18.955 -10.296
  124   HD21  ASN  16          2HD2      ASN  16  17.693 -20.526 -11.087
  125   HD22  ASN  16          1HD2      ASN  16  18.307 -21.873 -10.167
  126    H    THR  17           H        THR  17  16.306 -16.228  -8.112
  127    HA   THR  17           HA       THR  17  17.969 -14.990  -7.509
  128    HB   THR  17           HB       THR  17  19.313 -15.350  -5.646
  129    HG1  THR  17           1HG      THR  17  19.028 -18.121  -6.125
  130   HG21  THR  17          1HG2      THR  17  16.880 -15.506  -5.121
  131   HG22  THR  17          HG22      THR  17  17.020 -17.292  -5.220
  132   HG23  THR  17          HG32      THR  17  17.914 -16.399  -3.973
  133    H    GLU  18           H        GLU  18  18.518 -17.871  -9.160
  134    HA   GLU  18           HA       GLU  18  21.311 -17.182  -9.868
  135    HB2  GLU  18           HB2      GLU  18  19.751 -19.561 -10.857
  136    HB3  GLU  18           HB3      GLU  18  21.506 -19.398 -10.654
  137    HG2  GLU  18           HG2      GLU  18  19.389 -19.605  -8.464
  138    HG3  GLU  18           HG3      GLU  18  20.444 -20.887  -8.947
  139    H    THR  19           H        THR  19  18.159 -16.551 -10.789
  140    HA   THR  19           HA       THR  19  18.416 -16.516 -13.678
  141    HB   THR  19           HB       THR  19  16.444 -15.074 -11.861
  142    HG1  THR  19           1HG      THR  19  15.190 -16.958 -12.160
  143   HG21  THR  19          1HG2      THR  19  16.355 -14.391 -14.239
  144   HG22  THR  19          HG22      THR  19  16.217 -16.100 -14.721
  145   HG23  THR  19          HG32      THR  19  14.918 -15.323 -13.776
  146    H    ASN  20           H        ASN  20  18.720 -14.717 -15.005
  147    HA   ASN  20           HA       ASN  20  19.383 -12.126 -13.692
  148    HB2  ASN  20           HB2      ASN  20  20.977 -12.699 -16.073
  149    HB3  ASN  20           HB3      ASN  20  21.454 -11.964 -14.543
  150   HD21  ASN  20          2HD2      ASN  20  21.251 -14.879 -16.448
  151   HD22  ASN  20          1HD2      ASN  20  22.139 -15.911 -15.338
  152    H    GLU  21           H        GLU  21  19.995 -10.734 -15.913
  153    HA   GLU  21           HA       GLU  21  17.351 -10.029 -16.748
  154    HB2  GLU  21           HB2      GLU  21  20.010  -9.118 -17.923
  155    HB3  GLU  21           HB3      GLU  21  18.444  -8.287 -17.998
  156    HG2  GLU  21           HG2      GLU  21  19.336  -7.154 -16.196
  157    HG3  GLU  21           HG3      GLU  21  18.591  -8.508 -15.352
  158    H    LYS  22           H        LYS  22  20.009 -11.854 -18.259
  159    HA   LYS  22           HA       LYS  22  18.979 -11.784 -20.915
  160    HB2  LYS  22           HB2      LYS  22  21.316 -12.471 -19.816
  161    HB3  LYS  22           HB3      LYS  22  20.613 -14.085 -19.820
  162    HG2  LYS  22           HG2      LYS  22  21.086 -12.254 -22.215
  163    HG3  LYS  22           HG3      LYS  22  22.007 -13.701 -21.789
  164    HD2  LYS  22           2HD      LYS  22  19.881 -15.052 -22.106
  165    HD3  LYS  22           3HD      LYS  22  19.138 -13.581 -22.783
  166    HE2  LYS  22           HE2      LYS  22  21.664 -14.924 -23.819
  167    HE3  LYS  22           HE3      LYS  22  20.052 -15.087 -24.533
  168    HZ1  LYS  22           3HZ      LYS  22  21.556 -12.569 -24.282
  169    HZ2  LYS  22           1HZ      LYS  22  21.339 -13.428 -25.663
  170    HZ3  LYS  22           2HZ      LYS  22  20.052 -12.721 -24.929
  171    H    ALA  23           H        ALA  23  18.149 -13.738 -18.072
  172    HA   ALA  23           HA       ALA  23  16.921 -15.833 -19.765
  173    HB1  ALA  23           1HB      ALA  23  18.267 -16.501 -17.807
  174    HB2  ALA  23           HB2      ALA  23  17.203 -15.543 -16.747
  175    HB3  ALA  23           HB3      ALA  23  16.566 -16.966 -17.600
  176    H    LEU  24           H        LEU  24  16.210 -12.919 -18.093
  177    HA   LEU  24           HA       LEU  24  13.384 -13.495 -17.652
  178    HB2  LEU  24           HB2      LEU  24  15.499 -11.474 -16.962
  179    HB3  LEU  24           HB3      LEU  24  13.881 -10.823 -17.084
  180    HG   LEU  24           HG       LEU  24  14.603 -13.293 -15.448
  181   HD11  LEU  24          1HD1      LEU  24  14.261 -10.411 -14.510
  182   HD12  LEU  24          2HD1      LEU  24  14.486 -11.836 -13.465
  183   HD13  LEU  24          3HD1      LEU  24  15.796 -11.326 -14.554
  184   HD21  LEU  24          3HD2      LEU  24  12.260 -13.124 -16.075
  185   HD22  LEU  24          1HD2      LEU  24  12.418 -12.766 -14.338
  186   HD23  LEU  24          2HD2      LEU  24  12.180 -11.440 -15.509
  187    H    GLU  25           H        GLU  25  15.530 -11.826 -19.926
  188    HA   GLU  25           HA       GLU  25  13.292 -10.625 -21.329
  189    HB2  GLU  25           HB2      GLU  25  16.230 -11.089 -22.066
  190    HB3  GLU  25           HB3      GLU  25  15.077 -10.256 -23.136
  191    HG2  GLU  25           HG2      GLU  25  14.551  -8.700 -21.305
  192    HG3  GLU  25           HG3      GLU  25  15.832  -9.427 -20.316
  193    H    ALA  26           H        ALA  26  15.031 -13.600 -21.288
  194    HA   ALA  26           HA       ALA  26  14.274 -14.514 -23.950
  195    HB1  ALA  26           1HB      ALA  26  15.505 -15.878 -21.534
  196    HB2  ALA  26           HB2      ALA  26  15.407 -16.595 -23.165
  197    HB3  ALA  26           HB3      ALA  26  16.397 -15.136 -22.885
  198    H    VAL  27           H        VAL  27  12.894 -14.601 -20.746
  199    HA   VAL  27           HA       VAL  27  11.161 -16.896 -21.459
  200    HB   VAL  27           HB       VAL  27  12.607 -16.759 -19.428
  201   HG11  VAL  27          1HG1      VAL  27  10.431 -14.980 -18.345
  202   HG12  VAL  27          HG21      VAL  27  11.917 -15.530 -17.514
  203   HG13  VAL  27          HG31      VAL  27  12.042 -14.402 -18.886
  204   HG21  VAL  27          HG32      VAL  27  10.722 -18.353 -19.640
  205   HG22  VAL  27          1HG2      VAL  27  10.889 -17.761 -17.961
  206   HG23  VAL  27          HG22      VAL  27   9.604 -17.106 -19.016
  207    H    PHE  28           H        PHE  28  11.049 -13.494 -20.434
  208    HA   PHE  28           HA       PHE  28   8.102 -13.515 -20.715
  209    HB2  PHE  28           HB2      PHE  28  10.027 -11.371 -19.785
  210    HB3  PHE  28           HB3      PHE  28   8.288 -11.133 -20.017
  211    HD1  PHE  28           HD2      PHE  28   6.641 -12.480 -18.702
  212    HD2  PHE  28           HD1      PHE  28  10.843 -12.462 -17.808
  213    HE1  PHE  28           HE2      PHE  28   6.165 -13.420 -16.457
  214    HE2  PHE  28           HE1      PHE  28  10.377 -13.445 -15.586
  215    HZ   PHE  28           HZ       PHE  28   8.041 -13.888 -14.888
  216    H    GLY  29           H        GLY  29  10.835 -13.014 -22.692
  217    HA2  GLY  29           2HA      GLY  29   9.600 -11.076 -24.490
  218    HA3  GLY  29           3HA      GLY  29  11.041 -12.055 -24.824
  219    H    LYS  30           H        LYS  30   8.858 -14.204 -23.695
  220    HA   LYS  30           HA       LYS  30   8.259 -15.289 -26.328
  221    HB2  LYS  30           HB2      LYS  30   7.523 -16.195 -23.494
  222    HB3  LYS  30           HB3      LYS  30   7.424 -17.187 -24.967
  223    HG2  LYS  30           HG2      LYS  30   9.844 -16.998 -25.273
  224    HG3  LYS  30           HG3      LYS  30   9.994 -15.941 -23.877
  225    HD2  LYS  30           2HD      LYS  30  10.669 -18.252 -23.328
  226    HD3  LYS  30           3HD      LYS  30   9.345 -17.660 -22.330
  227    HE2  LYS  30           HE2      LYS  30   8.908 -19.946 -22.964
  228    HE3  LYS  30           HE3      LYS  30   7.711 -18.878 -23.708
  229    HZ1  LYS  30           3HZ      LYS  30   8.552 -20.511 -25.264
  230    HZ2  LYS  30           1HZ      LYS  30   8.983 -19.009 -25.756
  231    HZ3  LYS  30           2HZ      LYS  30  10.095 -19.994 -25.043
  232    H    TYR  31           H        TYR  31   6.787 -13.145 -24.190
  233    HA   TYR  31           HA       TYR  31   4.048 -13.772 -25.201
  234    HB2  TYR  31           HB2      TYR  31   4.991 -12.268 -22.750
  235    HB3  TYR  31           HB3      TYR  31   3.303 -12.550 -23.185
  236    HD1  TYR  31           HD2      TYR  31   2.592 -15.063 -23.382
  237    HD2  TYR  31           HD1      TYR  31   6.207 -13.745 -21.469
  238    HE1  TYR  31           HE2      TYR  31   2.786 -17.262 -22.255
  239    HE2  TYR  31           HE1      TYR  31   6.390 -15.942 -20.292
  240    HH   TYR  31           HH       TYR  31   5.552 -18.091 -20.157
  241    H    GLY  32           H        GLY  32   6.607 -11.377 -25.299
  242    HA2  GLY  32           2HA      GLY  32   5.284  -9.786 -27.250
  243    HA3  GLY  32           3HA      GLY  32   5.117  -9.008 -25.658
  244    H    ARG  33           H        ARG  33   6.432  -7.740 -27.729
  245    HA   ARG  33           HA       ARG  33   9.251  -8.203 -27.527
  246    HB2  ARG  33           HB2      ARG  33   7.772  -7.089 -29.407
  247    HB3  ARG  33           HB3      ARG  33   7.991  -5.607 -28.443
  248    HG2  ARG  33           HG2      ARG  33  10.466  -5.948 -28.561
  249    HG3  ARG  33           HG3      ARG  33  10.169  -7.469 -29.443
  250    HD2  ARG  33           2HD      ARG  33   9.031  -6.179 -31.242
  251    HD3  ARG  33           3HD      ARG  33   9.384  -4.675 -30.381
  252    HE   ARG  33           HE       ARG  33  11.280  -6.415 -31.851
  253   HH11  ARG  33          1HH1      ARG  33  10.843  -3.537 -29.812
  254   HH12  ARG  33          2HH1      ARG  33  12.433  -2.919 -30.172
  255   HH21  ARG  33          1HH2      ARG  33  13.329  -5.552 -32.302
  256   HH22  ARG  33          2HH2      ARG  33  13.822  -4.035 -31.589
  257    H    ILE  34           H        ILE  34  10.403  -7.788 -25.866
  258    HA   ILE  34           HA       ILE  34   9.524  -6.045 -23.709
  259    HB   ILE  34           HB       ILE  34  12.075  -7.602 -24.242
  260   HG12  ILE  34          HG21      ILE  34   9.627  -7.981 -22.465
  261   HG13  ILE  34          HG31      ILE  34  10.085  -8.958 -23.867
  262   HG21  ILE  34          1HG2      ILE  34  11.270  -6.140 -21.694
  263   HG22  ILE  34          HG22      ILE  34  12.733  -7.129 -21.956
  264   HG23  ILE  34          HG32      ILE  34  12.551  -5.604 -22.816
  265   HD11  ILE  34          3HD1      ILE  34  10.636 -10.150 -21.808
  266   HD12  ILE  34          1HD1      ILE  34  12.123  -9.706 -22.686
  267   HD13  ILE  34          2HD1      ILE  34  11.618  -8.802 -21.234
  268    H    VAL  35           H        VAL  35  10.148  -4.017 -23.194
  269    HA   VAL  35           HA       VAL  35  11.905  -2.614 -25.146
  270    HB   VAL  35           HB       VAL  35  10.568  -0.801 -23.352
  271   HG11  VAL  35          1HG1      VAL  35  10.247  -1.362 -26.324
  272   HG12  VAL  35          HG21      VAL  35   9.735   0.115 -25.468
  273   HG13  VAL  35          HG31      VAL  35  11.463  -0.292 -25.579
  274   HG21  VAL  35          HG32      VAL  35   8.666  -2.689 -24.803
  275   HG22  VAL  35          1HG2      VAL  35   8.789  -2.442 -23.043
  276   HG23  VAL  35          HG22      VAL  35   8.227  -1.128 -24.090
  277    H    GLU  36           H        GLU  36  11.498  -3.606 -21.811
  278    HA   GLU  36           HA       GLU  36  14.238  -2.835 -21.191
  279    HB2  GLU  36           HB2      GLU  36  13.058  -0.708 -20.790
  280    HB3  GLU  36           HB3      GLU  36  11.882  -1.531 -19.748
  281    HG2  GLU  36           HG2      GLU  36  13.600  -2.081 -18.129
  282    HG3  GLU  36           HG3      GLU  36  14.866  -1.486 -19.218
  283    H    VAL  37           H        VAL  37  15.016  -3.978 -19.346
  284    HA   VAL  37           HA       VAL  37  13.014  -5.511 -17.811
  285    HB   VAL  37           HB       VAL  37  15.182  -6.684 -19.489
  286   HG11  VAL  37          1HG1      VAL  37  14.515  -7.807 -16.734
  287   HG12  VAL  37          HG21      VAL  37  15.453  -8.626 -17.989
  288   HG13  VAL  37          HG31      VAL  37  16.103  -7.161 -17.240
  289   HG21  VAL  37          HG32      VAL  37  12.583  -7.703 -18.250
  290   HG22  VAL  37          1HG2      VAL  37  12.768  -7.037 -19.890
  291   HG23  VAL  37          HG22      VAL  37  13.553  -8.574 -19.444
  292    H    LEU  38           H        LEU  38  13.473  -5.844 -15.739
  293    HA   LEU  38           HA       LEU  38  15.943  -4.561 -14.578
  294    HB2  LEU  38           HB2      LEU  38  13.064  -4.501 -13.972
  295    HB3  LEU  38           HB3      LEU  38  14.079  -4.663 -12.560
  296    HG   LEU  38           HG       LEU  38  14.369  -2.426 -14.619
  297   HD11  LEU  38          1HD1      LEU  38  13.489  -1.001 -12.792
  298   HD12  LEU  38          2HD1      LEU  38  12.306  -2.250 -13.262
  299   HD13  LEU  38          3HD1      LEU  38  13.262  -2.437 -11.774
  300   HD21  LEU  38          3HD2      LEU  38  15.831  -1.396 -12.920
  301   HD22  LEU  38          1HD2      LEU  38  15.705  -2.862 -11.925
  302   HD23  LEU  38          2HD2      LEU  38  16.515  -2.925 -13.509
  303    H    LEU  39           H        LEU  39  16.899  -5.653 -12.880
  304    HA   LEU  39           HA       LEU  39  15.651  -8.091 -11.940
  305    HB2  LEU  39           HB2      LEU  39  16.900  -8.823 -13.924
  306    HB3  LEU  39           HB3      LEU  39  18.356  -8.007 -13.361
  307    HG   LEU  39           HG       LEU  39  18.195 -10.541 -13.184
  308   HD11  LEU  39          1HD1      LEU  39  18.968  -9.004 -10.687
  309   HD12  LEU  39          2HD1      LEU  39  19.572 -10.600 -11.203
  310   HD13  LEU  39          3HD1      LEU  39  19.947  -9.156 -12.171
  311   HD21  LEU  39          3HD2      LEU  39  16.628  -9.887 -10.666
  312   HD22  LEU  39          1HD2      LEU  39  15.973 -10.677 -12.134
  313   HD23  LEU  39          2HD2      LEU  39  17.230 -11.483 -11.177
  314    H    MET  40           H        MET  40  15.859  -7.925  -9.761
  315    HA   MET  40           HA       MET  40  17.649  -5.766  -8.849
  316    HB2  MET  40           HB2      MET  40  15.587  -7.235  -7.180
  317    HB3  MET  40           HB3      MET  40  16.296  -5.653  -6.891
  318    HG2  MET  40           HG2      MET  40  14.085  -6.482  -8.706
  319    HG3  MET  40           HG3      MET  40  14.233  -5.049  -7.695
  320    HE1  MET  40           HE3      MET  40  15.691  -2.757  -8.614
  321    HE2  MET  40           HE1      MET  40  17.043  -3.912  -8.660
  322    HE3  MET  40           HE2      MET  40  16.667  -2.908 -10.092
  323    H    LYS  41           H        LYS  41  19.346  -6.041  -7.391
  324    HA   LYS  41           HA       LYS  41  19.633  -8.683  -6.160
  325    HB2  LYS  41           HB2      LYS  41  22.232  -8.274  -7.013
  326    HB3  LYS  41           HB3      LYS  41  21.082  -9.459  -7.644
  327    HG2  LYS  41           HG2      LYS  41  20.402  -7.989  -9.410
  328    HG3  LYS  41           HG3      LYS  41  21.427  -6.665  -8.773
  329    HD2  LYS  41           2HD      LYS  41  23.434  -8.101  -9.118
  330    HD3  LYS  41           3HD      LYS  41  22.394  -9.392  -9.756
  331    HE2  LYS  41           HE2      LYS  41  21.619  -7.831 -11.549
  332    HE3  LYS  41           HE3      LYS  41  22.731  -6.598 -10.919
  333    HZ1  LYS  41           3HZ      LYS  41  23.515  -9.231 -11.974
  334    HZ2  LYS  41           1HZ      LYS  41  23.672  -7.796 -12.763
  335    HZ3  LYS  41           2HZ      LYS  41  24.550  -8.084 -11.406
  336    H    ASP  42           H        ASP  42  21.031  -8.853  -4.467
  337    HA   ASP  42           HA       ASP  42  21.214  -6.624  -2.721
  338    HB2  ASP  42           HB2      ASP  42  21.136  -9.230  -2.350
  339    HB3  ASP  42           HB3      ASP  42  22.891  -9.110  -2.491
  340    H    ARG  43           H        ARG  43  23.270  -5.924  -1.649
  341    HA   ARG  43           HA       ARG  43  25.341  -5.392  -3.721
  342    HB2  ARG  43           HB2      ARG  43  25.786  -3.312  -2.542
  343    HB3  ARG  43           HB3      ARG  43  24.078  -3.422  -2.995
  344    HG2  ARG  43           HG2      ARG  43  23.524  -4.170  -0.679
  345    HG3  ARG  43           HG3      ARG  43  25.240  -4.014  -0.238
  346    HD2  ARG  43           2HD      ARG  43  25.186  -1.622  -0.802
  347    HD3  ARG  43           3HD      ARG  43  23.472  -1.756  -1.262
  348    HE   ARG  43           HE       ARG  43  23.795  -2.740   1.387
  349   HH11  ARG  43          1HH1      ARG  43  23.908   0.314  -0.396
  350   HH12  ARG  43          2HH1      ARG  43  23.448   1.272   0.991
  351   HH21  ARG  43          1HH2      ARG  43  23.204  -1.453   3.186
  352   HH22  ARG  43          2HH2      ARG  43  23.049   0.276   3.007
  353    H    GLU  44           H        GLU  44  24.783  -7.210  -0.971
  354    HA   GLU  44           HA       GLU  44  27.678  -7.230  -0.237
  355    HB2  GLU  44           HB2      GLU  44  25.235  -8.117   1.332
  356    HB3  GLU  44           HB3      GLU  44  26.917  -8.257   1.877
  357    HG2  GLU  44           HG2      GLU  44  27.157  -5.783   1.695
  358    HG3  GLU  44           HG3      GLU  44  25.451  -5.665   1.232
  359    H    THR  45           H        THR  45  25.177  -9.019  -1.812
  360    HA   THR  45           HA       THR  45  27.010 -11.379  -1.876
  361    HB   THR  45           HB       THR  45  25.085 -12.851  -2.030
  362    HG1  THR  45           1HG      THR  45  22.996 -11.932  -1.762
  363   HG21  THR  45          1HG2      THR  45  24.620 -10.910   0.246
  364   HG22  THR  45          HG22      THR  45  24.164 -12.639   0.182
  365   HG23  THR  45          HG32      THR  45  25.888 -12.171   0.235
  366    H    ASN  46           H        ASN  46  25.219  -8.970  -3.605
  367    HA   ASN  46           HA       ASN  46  24.855  -8.637  -5.826
  368    HB2  ASN  46           HB2      ASN  46  27.211 -10.526  -5.963
  369    HB3  ASN  46           HB3      ASN  46  26.551  -9.680  -7.386
  370   HD21  ASN  46          2HD2      ASN  46  26.430  -7.247  -7.224
  371   HD22  ASN  46          1HD2      ASN  46  27.706  -6.433  -6.339
  372    H    LYS  47           H        LYS  47  23.825 -11.266  -4.307
  373    HA   LYS  47           HA       LYS  47  22.851 -12.818  -6.600
  374    HB2  LYS  47           HB2      LYS  47  22.300 -12.821  -3.599
  375    HB3  LYS  47           HB3      LYS  47  21.359 -13.803  -4.718
  376    HG2  LYS  47           HG2      LYS  47  24.373 -13.909  -4.598
  377    HG3  LYS  47           HG3      LYS  47  23.328 -14.956  -3.594
  378    HD2  LYS  47           2HD      LYS  47  22.242 -15.731  -5.784
  379    HD3  LYS  47           3HD      LYS  47  23.561 -14.883  -6.630
  380    HE2  LYS  47           HE2      LYS  47  25.184 -16.189  -5.190
  381    HE3  LYS  47           HE3      LYS  47  23.799 -17.112  -4.578
  382    HZ1  LYS  47           3HZ      LYS  47  24.662 -16.962  -7.395
  383    HZ2  LYS  47           1HZ      LYS  47  24.868 -18.249  -6.395
  384    HZ3  LYS  47           2HZ      LYS  47  23.360 -17.797  -6.857
  385    H    SER  48           H        SER  48  20.638 -12.960  -7.153
  386    HA   SER  48           HA       SER  48  19.324 -10.443  -7.334
  387    HB2  SER  48           HB2      SER  48  18.847 -12.345  -8.851
  388    HB3  SER  48           HB3      SER  48  18.076 -13.195  -7.480
  389    HG   SER  48           HG       SER  48  17.276 -10.690  -8.538
  390    H    ARG  49           H        ARG  49  17.564  -9.569  -6.242
  391    HA   ARG  49           HA       ARG  49  17.322 -10.100  -3.415
  392    HB2  ARG  49           HB2      ARG  49  15.591  -8.569  -5.384
  393    HB3  ARG  49           HB3      ARG  49  15.473  -8.428  -3.611
  394    HG2  ARG  49           HG2      ARG  49  18.058  -7.844  -5.083
  395    HG3  ARG  49           HG3      ARG  49  16.771  -6.634  -5.016
  396    HD2  ARG  49           2HD      ARG  49  17.983  -7.922  -2.552
  397    HD3  ARG  49           3HD      ARG  49  18.531  -6.384  -3.278
  398    HE   ARG  49           HE       ARG  49  16.089  -6.834  -1.728
  399   HH11  ARG  49          1HH1      ARG  49  17.816  -4.779  -4.003
  400   HH12  ARG  49          2HH1      ARG  49  16.869  -3.356  -3.674
  401   HH21  ARG  49          1HH2      ARG  49  14.839  -4.962  -1.264
  402   HH22  ARG  49          2HH2      ARG  49  15.196  -3.452  -2.067
  403    H    GLY  50           H        GLY  50  16.280 -11.766  -6.103
  404    HA2  GLY  50           2HA      GLY  50  14.919 -13.658  -6.215
  405    HA3  GLY  50           3HA      GLY  50  14.191 -13.226  -4.648
  406    H    PHE  51           H        PHE  51  14.228 -10.392  -6.483
  407    HA   PHE  51           HA       PHE  51  11.779 -11.094  -7.972
  408    HB2  PHE  51           HB2      PHE  51  10.516  -9.303  -7.130
  409    HB3  PHE  51           HB3      PHE  51  11.120 -10.196  -5.741
  410    HD1  PHE  51           HD1      PHE  51  13.030  -9.212  -4.373
  411    HD2  PHE  51           HD2      PHE  51  11.032  -7.008  -7.480
  412    HE1  PHE  51           HE1      PHE  51  13.915  -7.082  -3.444
  413    HE2  PHE  51           HE2      PHE  51  11.844  -4.886  -6.485
  414    HZ   PHE  51           HZ       PHE  51  13.343  -4.925  -4.535
  415    H    ALA  52           H        ALA  52  11.194  -9.516  -9.602
  416    HA   ALA  52           HA       ALA  52  13.309  -7.682 -10.513
  417    HB1  ALA  52           1HB      ALA  52  12.481 -10.183 -12.058
  418    HB2  ALA  52           HB2      ALA  52  13.566  -8.914 -12.654
  419    HB3  ALA  52           HB3      ALA  52  14.055  -9.925 -11.274
  420    H    PHE  53           H        PHE  53  12.584  -6.973 -12.914
  421    HA   PHE  53           HA       PHE  53   9.645  -6.851 -13.123
  422    HB2  PHE  53           HB2      PHE  53  11.409  -4.359 -13.139
  423    HB3  PHE  53           HB3      PHE  53   9.699  -4.399 -13.468
  424    HD1  PHE  53           HD2      PHE  53  12.292  -5.027 -10.883
  425    HD2  PHE  53           HD1      PHE  53   8.148  -4.218 -11.674
  426    HE1  PHE  53           HE2      PHE  53  11.905  -4.696  -8.466
  427    HE2  PHE  53           HE1      PHE  53   7.744  -3.895  -9.249
  428    HZ   PHE  53           HZ       PHE  53   9.615  -4.153  -7.635
  429    H    VAL  54           H        VAL  54   8.967  -6.012 -15.268
  430    HA   VAL  54           HA       VAL  54  11.015  -5.898 -17.372
  431    HB   VAL  54           HB       VAL  54  10.660  -8.326 -17.204
  432   HG11  VAL  54          1HG1      VAL  54   7.760  -7.864 -17.451
  433   HG12  VAL  54          HG21      VAL  54   8.667  -9.418 -17.444
  434   HG13  VAL  54          HG31      VAL  54   8.710  -8.371 -15.998
  435   HG21  VAL  54          HG32      VAL  54   9.880  -8.809 -19.457
  436   HG22  VAL  54          1HG2      VAL  54   8.948  -7.297 -19.526
  437   HG23  VAL  54          HG22      VAL  54  10.718  -7.239 -19.546
  438    H    THR  55           H        THR  55  10.347  -4.639 -19.066
  439    HA   THR  55           HA       THR  55   7.523  -3.695 -18.956
  440    HB   THR  55           HB       THR  55   9.942  -2.237 -20.081
  441    HG1  THR  55           1HG      THR  55   9.984  -2.364 -17.818
  442   HG21  THR  55          1HG2      THR  55   8.357  -0.329 -20.106
  443   HG22  THR  55          HG22      THR  55   7.810  -1.647 -21.168
  444   HG23  THR  55          HG32      THR  55   7.045  -1.413 -19.581
  445    H    PHE  56           H        PHE  56   6.271  -4.374 -20.512
  446    HA   PHE  56           HA       PHE  56   7.374  -5.455 -23.023
  447    HB2  PHE  56           HB2      PHE  56   4.633  -5.345 -21.740
  448    HB3  PHE  56           HB3      PHE  56   4.900  -5.954 -23.368
  449    HD1  PHE  56           HD2      PHE  56   6.380  -6.528 -19.901
  450    HD2  PHE  56           HD1      PHE  56   5.082  -8.164 -23.668
  451    HE1  PHE  56           HE2      PHE  56   6.903  -8.801 -19.096
  452    HE2  PHE  56           HE1      PHE  56   5.547 -10.438 -22.838
  453    HZ   PHE  56           HZ       PHE  56   6.394 -10.775 -20.531
  454    H    GLU  57           H        GLU  57   6.633  -4.767 -25.128
  455    HA   GLU  57           HA       GLU  57   6.239  -1.937 -25.423
  456    HB2  GLU  57           HB2      GLU  57   6.330  -4.371 -27.226
  457    HB3  GLU  57           HB3      GLU  57   5.738  -2.819 -27.826
  458    HG2  GLU  57           HG2      GLU  57   7.869  -1.754 -26.942
  459    HG3  GLU  57           HG3      GLU  57   8.484  -3.393 -26.655
  460    H    SER  58           H        SER  58   4.048  -4.728 -25.082
  461    HA   SER  58           HA       SER  58   1.799  -2.795 -25.477
  462    HB2  SER  58           HB2      SER  58   1.715  -4.432 -27.249
  463    HB3  SER  58           HB3      SER  58   1.981  -5.760 -26.097
  464    HG   SER  58           HG       SER  58  -0.249  -5.440 -26.691
  465    HA   PRO  59           HA       PRO  59   1.089  -3.592 -21.245
  466    HB2  PRO  59           HB2      PRO  59  -1.386  -2.543 -20.928
  467    HB3  PRO  59           HB3      PRO  59  -0.003  -1.481 -21.396
  468    HG2  PRO  59           HG2      PRO  59  -2.002  -2.848 -23.222
  469    HG3  PRO  59           HG3      PRO  59  -1.648  -1.096 -23.137
  470    HD2  PRO  59           2HD      PRO  59  -0.371  -2.670 -24.954
  471    HD3  PRO  59           3HD      PRO  59   0.565  -1.442 -24.051
  472    H    ALA  60           H        ALA  60  -0.384  -5.225 -23.818
  473    HA   ALA  60           HA       ALA  60  -1.945  -6.933 -21.942
  474    HB1  ALA  60           1HB      ALA  60  -3.366  -5.733 -23.519
  475    HB2  ALA  60           HB2      ALA  60  -2.432  -6.391 -24.890
  476    HB3  ALA  60           HB3      ALA  60  -3.383  -7.480 -23.841
  477    H    ASP  61           H        ASP  61   0.743  -6.798 -24.172
  478    HA   ASP  61           HA       ASP  61   0.954  -9.674 -24.497
  479    HB2  ASP  61           HB2      ASP  61   3.003  -7.405 -24.567
  480    HB3  ASP  61           HB3      ASP  61   3.396  -9.050 -24.857
  481    H    ALA  62           H        ALA  62   1.708  -7.245 -22.063
  482    HA   ALA  62           HA       ALA  62   3.245  -8.993 -20.346
  483    HB1  ALA  62           1HB      ALA  62   3.521  -6.568 -20.315
  484    HB2  ALA  62           HB2      ALA  62   1.808  -6.347 -19.872
  485    HB3  ALA  62           HB3      ALA  62   2.917  -7.132 -18.728
  486    H    LYS  63           H        LYS  63  -0.206  -8.139 -20.752
  487    HA   LYS  63           HA       LYS  63  -1.096  -9.356 -18.294
  488    HB2  LYS  63           HB2      LYS  63  -2.473  -8.807 -20.945
  489    HB3  LYS  63           HB3      LYS  63  -3.299  -9.462 -19.518
  490    HG2  LYS  63           HG2      LYS  63  -2.766  -7.483 -18.210
  491    HG3  LYS  63           HG3      LYS  63  -1.767  -6.842 -19.526
  492    HD2  LYS  63           2HD      LYS  63  -3.955  -5.723 -19.477
  493    HD3  LYS  63           3HD      LYS  63  -3.758  -6.624 -20.974
  494    HE2  LYS  63           HE2      LYS  63  -5.049  -8.529 -20.007
  495    HE3  LYS  63           HE3      LYS  63  -5.270  -7.612 -18.515
  496    HZ1  LYS  63           3HZ      LYS  63  -6.249  -6.794 -21.177
  497    HZ2  LYS  63           1HZ      LYS  63  -7.165  -7.411 -19.959
  498    HZ3  LYS  63           2HZ      LYS  63  -6.448  -5.945 -19.782
  499    H    ASP  64           H        ASP  64  -0.526 -10.500 -21.637
  500    HA   ASP  64           HA       ASP  64  -1.739 -13.061 -21.226
  501    HB2  ASP  64           HB2      ASP  64  -1.215 -11.868 -23.414
  502    HB3  ASP  64           HB3      ASP  64   0.483 -12.273 -23.155
  503    H    ALA  65           H        ALA  65   1.528 -11.762 -20.733
  504    HA   ALA  65           HA       ALA  65   2.685 -14.336 -20.052
  505    HB1  ALA  65           1HB      ALA  65   4.592 -13.053 -19.332
  506    HB2  ALA  65           HB2      ALA  65   3.979 -12.296 -20.818
  507    HB3  ALA  65           HB3      ALA  65   3.631 -11.553 -19.245
  508    H    ALA  66           H        ALA  66   1.329 -11.561 -18.200
  509    HA   ALA  66           HA       ALA  66   1.911 -12.744 -15.659
  510    HB1  ALA  66           1HB      ALA  66   0.585 -10.845 -14.797
  511    HB2  ALA  66           HB2      ALA  66   1.654 -10.290 -16.113
  512    HB3  ALA  66           HB3      ALA  66  -0.067 -10.546 -16.425
  513    H    ARG  67           H        ARG  67  -0.387 -13.510 -17.998
  514    HA   ARG  67           HA       ARG  67  -2.192 -14.822 -16.030
  515    HB2  ARG  67           HB2      ARG  67  -2.449 -14.136 -18.972
  516    HB3  ARG  67           HB3      ARG  67  -3.616 -15.155 -18.109
  517    HG2  ARG  67           HG2      ARG  67  -4.199 -13.396 -16.588
  518    HG3  ARG  67           HG3      ARG  67  -2.861 -12.374 -17.130
  519    HD2  ARG  67           2HD      ARG  67  -4.953 -11.582 -18.069
  520    HD3  ARG  67           3HD      ARG  67  -3.907 -12.163 -19.362
  521    HE   ARG  67           HE       ARG  67  -5.771 -14.171 -18.320
  522   HH11  ARG  67          1HH1      ARG  67  -5.311 -11.584 -20.687
  523   HH12  ARG  67          2HH1      ARG  67  -6.557 -12.187 -21.755
  524   HH21  ARG  67          1HH2      ARG  67  -7.377 -14.937 -19.735
  525   HH22  ARG  67          2HH2      ARG  67  -7.729 -14.079 -21.218
  526    H    ASP  68           H        ASP  68   0.700 -15.666 -17.451
  527    HA   ASP  68           HA       ASP  68  -0.215 -18.449 -18.031
  528    HB2  ASP  68           HB2      ASP  68   1.377 -16.409 -19.525
  529    HB3  ASP  68           HB3      ASP  68   2.145 -17.949 -19.372
  530    H    MET  69           H        MET  69   2.506 -16.283 -17.379
  531    HA   MET  69           HA       MET  69   4.205 -18.336 -16.251
  532    HB2  MET  69           HB2      MET  69   4.271 -15.474 -17.146
  533    HB3  MET  69           HB3      MET  69   5.382 -15.884 -15.886
  534    HG2  MET  69           HG2      MET  69   5.037 -17.267 -18.575
  535    HG3  MET  69           HG3      MET  69   6.358 -16.163 -18.147
  536    HE1  MET  69           HE3      MET  69   8.332 -18.189 -15.491
  537    HE2  MET  69           HE1      MET  69   8.020 -16.614 -16.285
  538    HE3  MET  69           HE2      MET  69   6.840 -17.276 -15.127
  539    H    ASN  70           H        ASN  70   1.707 -16.335 -14.964
  540    HA   ASN  70           HA       ASN  70   2.961 -15.864 -12.400
  541    HB2  ASN  70           HB2      ASN  70   1.130 -14.464 -13.320
  542    HB3  ASN  70           HB3      ASN  70   0.032 -15.839 -13.217
  543   HD21  ASN  70          2HD2      ASN  70  -1.250 -14.332 -11.843
  544   HD22  ASN  70          1HD2      ASN  70  -0.849 -14.219 -10.140
  545    H    GLY  71           H        GLY  71   3.221 -17.267 -10.776
  546    HA2  GLY  71           2HA      GLY  71   2.636 -18.958  -9.278
  547    HA3  GLY  71           3HA      GLY  71   1.315 -19.456 -10.350
  548    H    LYS  72           H        LYS  72   3.741 -19.228 -12.533
  549    HA   LYS  72           HA       LYS  72   4.514 -22.031 -12.464
  550    HB2  LYS  72           HB2      LYS  72   5.424 -19.717 -14.179
  551    HB3  LYS  72           HB3      LYS  72   5.562 -21.436 -14.530
  552    HG2  LYS  72           HG2      LYS  72   2.933 -19.908 -14.361
  553    HG3  LYS  72           HG3      LYS  72   3.726 -20.504 -15.837
  554    HD2  LYS  72           2HD      LYS  72   3.497 -22.832 -15.010
  555    HD3  LYS  72           3HD      LYS  72   2.660 -22.217 -13.560
  556    HE2  LYS  72           HE2      LYS  72   0.920 -21.210 -15.002
  557    HE3  LYS  72           HE3      LYS  72   1.745 -21.840 -16.438
  558    HZ1  LYS  72           3HZ      LYS  72   1.381 -24.057 -15.589
  559    HZ2  LYS  72           1HZ      LYS  72   0.607 -23.465 -14.258
  560    HZ3  LYS  72           2HZ      LYS  72  -0.052 -23.274 -15.746
  561    H    SER  73           H        SER  73   7.095 -21.428 -13.596
  562    HA   SER  73           HA       SER  73   8.657 -20.576 -11.192
  563    HB2  SER  73           HB2      SER  73   8.117 -22.995 -11.122
  564    HB3  SER  73           HB3      SER  73   8.874 -23.214 -12.709
  565    HG   SER  73           HG       SER  73  10.294 -23.701 -10.980
  566    H    LEU  74           H        LEU  74  10.807 -20.253 -11.479
  567    HA   LEU  74           HA       LEU  74  11.719 -19.833 -14.281
  568    HB2  LEU  74           HB2      LEU  74  11.141 -17.716 -12.458
  569    HB3  LEU  74           HB3      LEU  74  12.828 -17.986 -12.278
  570    HG   LEU  74           HG       LEU  74  12.523 -16.314 -13.950
  571   HD11  LEU  74          1HD1      LEU  74  14.365 -17.877 -14.405
  572   HD12  LEU  74          2HD1      LEU  74  13.275 -18.863 -15.422
  573   HD13  LEU  74          3HD1      LEU  74  13.670 -17.198 -15.886
  574   HD21  LEU  74          3HD2      LEU  74  10.858 -18.366 -15.482
  575   HD22  LEU  74          1HD2      LEU  74  10.197 -16.990 -14.572
  576   HD23  LEU  74          2HD2      LEU  74  11.219 -16.706 -16.001
  577    H    ASP  75           H        ASP  75  13.527 -20.919 -14.595
  578    HA   ASP  75           HA       ASP  75  15.422 -22.044 -14.265
  579    HB2  ASP  75           HB2      ASP  75  15.840 -19.501 -13.341
  580    HB3  ASP  75           HB3      ASP  75  15.962 -20.300 -11.854
  581    H    GLY  76           H        GLY  76  13.049 -22.322 -11.984
  582    HA2  GLY  76           2HA      GLY  76  13.212 -24.791 -11.338
  583    HA3  GLY  76           3HA      GLY  76  14.622 -24.264 -10.396
  584    H    LYS  77           H        LYS  77  12.796 -21.590 -10.091
  585    HA   LYS  77           HA       LYS  77  11.489 -22.643  -7.632
  586    HB2  LYS  77           HB2      LYS  77  12.845 -19.953  -7.941
  587    HB3  LYS  77           HB3      LYS  77  12.112 -20.613  -6.468
  588    HG2  LYS  77           HG2      LYS  77  14.513 -21.729  -7.953
  589    HG3  LYS  77           HG3      LYS  77  14.576 -20.836  -6.432
  590    HD2  LYS  77           2HD      LYS  77  13.477 -22.594  -5.221
  591    HD3  LYS  77           3HD      LYS  77  13.090 -23.479  -6.713
  592    HE2  LYS  77           HE2      LYS  77  15.467 -23.782  -7.199
  593    HE3  LYS  77           HE3      LYS  77  15.906 -22.874  -5.738
  594    HZ1  LYS  77           3HZ      LYS  77  15.981 -25.242  -5.375
  595    HZ2  LYS  77           1HZ      LYS  77  14.816 -24.565  -4.434
  596    HZ3  LYS  77           2HZ      LYS  77  14.397 -25.403  -5.786
  597    H    ALA  78           H        ALA  78   9.482 -21.961  -7.140
  598    HA   ALA  78           HA       ALA  78   7.905 -21.035  -9.331
  599    HB1  ALA  78           1HB      ALA  78   7.179 -21.353  -6.396
  600    HB2  ALA  78           HB2      ALA  78   6.036 -21.173  -7.749
  601    HB3  ALA  78           HB3      ALA  78   7.071 -22.614  -7.654
  602    H    ILE  79           H        ILE  79   6.897 -19.107  -9.736
  603    HA   ILE  79           HA       ILE  79   7.800 -16.789  -8.089
  604    HB   ILE  79           HB       ILE  79   8.049 -15.511 -10.106
  605   HG12  ILE  79          HG21      ILE  79   7.252 -17.965 -11.714
  606   HG13  ILE  79          HG31      ILE  79   6.154 -16.612 -11.354
  607   HG21  ILE  79          1HG2      ILE  79   9.951 -16.970  -9.399
  608   HG22  ILE  79          HG22      ILE  79   9.391 -18.200 -10.558
  609   HG23  ILE  79          HG32      ILE  79   9.924 -16.608 -11.145
  610   HD11  ILE  79          3HD1      ILE  79   7.034 -16.185 -13.509
  611   HD12  ILE  79          1HD1      ILE  79   7.815 -15.051 -12.401
  612   HD13  ILE  79          2HD1      ILE  79   8.709 -16.484 -12.974
  613    H    LYS  80           H        LYS  80   6.633 -14.769  -8.747
  614    HA   LYS  80           HA       LYS  80   3.726 -15.173  -9.214
  615    HB2  LYS  80           HB2      LYS  80   4.411 -14.335  -6.896
  616    HB3  LYS  80           HB3      LYS  80   5.099 -12.915  -7.692
  617    HG2  LYS  80           HG2      LYS  80   2.818 -12.473  -8.725
  618    HG3  LYS  80           HG3      LYS  80   2.183 -13.794  -7.725
  619    HD2  LYS  80           2HD      LYS  80   3.087 -12.552  -5.694
  620    HD3  LYS  80           3HD      LYS  80   3.488 -11.202  -6.779
  621    HE2  LYS  80           HE2      LYS  80   1.100 -11.067  -7.466
  622    HE3  LYS  80           HE3      LYS  80   0.720 -12.408  -6.377
  623    HZ1  LYS  80           3HZ      LYS  80   0.230 -10.400  -5.281
  624    HZ2  LYS  80           1HZ      LYS  80   1.562 -11.019  -4.559
  625    HZ3  LYS  80           2HZ      LYS  80   1.727  -9.758  -5.590
  626    H    VAL  81           H        VAL  81   2.866 -13.833 -10.860
  627    HA   VAL  81           HA       VAL  81   4.665 -11.719 -11.935
  628    HB   VAL  81           HB       VAL  81   3.094 -13.652 -13.678
  629   HG11  VAL  81          1HG1      VAL  81   4.999 -11.365 -14.331
  630   HG12  VAL  81          HG21      VAL  81   4.241 -12.465 -15.507
  631   HG13  VAL  81          HG31      VAL  81   3.236 -11.344 -14.566
  632   HG21  VAL  81          HG32      VAL  81   6.086 -13.327 -13.182
  633   HG22  VAL  81          1HG2      VAL  81   5.094 -14.739 -12.749
  634   HG23  VAL  81          HG22      VAL  81   5.367 -14.332 -14.457
  635    H    GLU  82           H        GLU  82   3.680  -9.800 -12.106
  636    HA   GLU  82           HA       GLU  82   0.773  -9.594 -12.404
  637    HB2  GLU  82           HB2      GLU  82   1.135 -10.194  -9.981
  638    HB3  GLU  82           HB3      GLU  82   2.158  -8.768  -9.812
  639    HG2  GLU  82           HG2      GLU  82  -0.140  -8.397  -8.966
  640    HG3  GLU  82           HG3      GLU  82   0.262  -7.296 -10.285
  641    H    GLN  83           H        GLN  83   0.131  -7.227 -12.507
  642    HA   GLN  83           HA       GLN  83   2.122  -5.659 -13.841
  643    HB2  GLN  83           HB2      GLN  83  -0.401  -5.574 -14.088
  644    HB3  GLN  83           HB3      GLN  83  -0.468  -4.670 -12.571
  645    HG2  GLN  83           HG2      GLN  83   1.109  -3.854 -15.055
  646    HG3  GLN  83           HG3      GLN  83  -0.512  -3.264 -14.659
  647   HE21  GLN  83          HE22      GLN  83   2.227  -1.915 -14.914
  648   HE22  GLN  83          HE12      GLN  83   2.393  -1.027 -13.421
  649    H    ALA  84           H        ALA  84   3.512  -4.059 -13.022
  650    HA   ALA  84           HA       ALA  84   4.153  -4.517 -10.225
  651    HB1  ALA  84           1HB      ALA  84   5.461  -2.763 -12.327
  652    HB2  ALA  84           HB2      ALA  84   6.158  -3.193 -10.751
  653    HB3  ALA  84           HB3      ALA  84   5.881  -4.461 -11.975
  654    H    THR  85           H        THR  85   4.028  -3.180  -8.499
  655    HA   THR  85           HA       THR  85   2.709  -0.546  -8.908
  656    HB   THR  85           HB       THR  85   2.524  -0.479  -6.494
  657    HG1  THR  85           1HG      THR  85   3.121  -2.324  -5.295
  658   HG21  THR  85          1HG2      THR  85   0.761  -1.640  -7.871
  659   HG22  THR  85          HG22      THR  85   1.595  -3.180  -7.596
  660   HG23  THR  85          HG32      THR  85   0.878  -2.299  -6.223
  661    H    LYS  86           H        LYS  86   3.576   1.248  -7.525
  662    HA   LYS  86           HA       LYS  86   6.273   1.804  -8.251
  663    HB2  LYS  86           HB2      LYS  86   4.370   3.103  -6.256
  664    HB3  LYS  86           HB3      LYS  86   5.901   3.812  -6.787
  665    HG2  LYS  86           HG2      LYS  86   5.069   3.663  -9.167
  666    HG3  LYS  86           HG3      LYS  86   3.500   3.114  -8.536
  667    HD2  LYS  86           2HD      LYS  86   3.383   5.240  -7.188
  668    HD3  LYS  86           3HD      LYS  86   4.852   5.791  -8.033
  669    HE2  LYS  86           HE2      LYS  86   3.663   5.469 -10.213
  670    HE3  LYS  86           HE3      LYS  86   2.202   4.998  -9.318
  671    HZ1  LYS  86           3HZ      LYS  86   3.544   7.609  -9.124
  672    HZ2  LYS  86           1HZ      LYS  86   2.147   7.307  -9.940
  673    HZ3  LYS  86           2HZ      LYS  86   2.192   7.162  -8.303
  674    HA   PRO  87           HA       PRO  87   8.581   0.029  -4.965
  675    HB2  PRO  87           HB2      PRO  87  10.651   1.774  -4.590
  676    HB3  PRO  87           HB3      PRO  87  10.471   0.806  -6.078
  677    HG2  PRO  87           HG2      PRO  87   9.536   3.656  -5.641
  678    HG3  PRO  87           HG3      PRO  87  10.554   3.016  -6.984
  679    HD2  PRO  87           2HD      PRO  87   7.886   3.312  -7.292
  680    HD3  PRO  87           3HD      PRO  87   8.711   1.855  -7.933
  681    H    SER  88           H        SER  88   9.224   0.315  -2.704
  682    HA   SER  88           HA       SER  88   7.394   2.232  -1.365
  683    HB2  SER  88           HB2      SER  88   6.535  -0.106  -1.517
  684    HB3  SER  88           HB3      SER  88   7.941  -0.660  -0.593
  685    HG   SER  88           HG       SER  88   7.251   0.776   1.082
  686    H    PHE  89           H        PHE  89  10.625   1.666  -1.765
  687    HA   PHE  89           HA       PHE  89  11.428   1.841   1.026
  688    HB2  PHE  89           HB2      PHE  89  13.653   2.290   0.153
  689    HB3  PHE  89           HB3      PHE  89  12.939   0.829  -0.529
  690    HD1  PHE  89           HD2      PHE  89  13.428   4.475  -1.268
  691    HD2  PHE  89           HD1      PHE  89  13.020   0.499  -2.835
  692    HE1  PHE  89           HE2      PHE  89  13.977   5.316  -3.548
  693    HE2  PHE  89           HE1      PHE  89  13.602   1.347  -5.111
  694    HZ   PHE  89           HZ       PHE  89  14.054   3.732  -5.462
  695    H    GLU  90           H        GLU  90   9.826   3.990  -0.929
  696    HA   GLU  90           HA       GLU  90  10.664   6.257   0.767
  697    HB2  GLU  90           HB2      GLU  90  11.965   6.201  -1.464
  698    HB3  GLU  90           HB3      GLU  90  10.405   6.542  -2.242
  699    HG2  GLU  90           HG2      GLU  90  10.188   8.570  -0.787
  700    HG3  GLU  90           HG3      GLU  90  11.774   8.189  -0.077
  701    H    SER  91           H        SER  91   9.108   7.744   1.123
  702    HA   SER  91           HA       SER  91   6.359   6.780   0.561
  703    HB2  SER  91           HB2      SER  91   7.700   8.451   2.686
  704    HB3  SER  91           HB3      SER  91   5.914   8.380   2.531
  705    HG   SER  91           HG       SER  91   6.755   6.808   3.983
  706    H    GLY  92           H        GLY  92   8.478   8.991  -0.769
  707    HA2  GLY  92           2HA      GLY  92   6.790  11.318  -0.936
  708    HA3  GLY  92           3HA      GLY  92   8.199  10.966  -1.946
  709    H    ARG  93           H        ARG  93   5.186  11.797  -2.306
  710    HA   ARG  93           HA       ARG  93   4.815  10.259  -4.810
  711    HB2  ARG  93           HB2      ARG  93   2.780  10.511  -2.553
  712    HB3  ARG  93           HB3      ARG  93   2.318  10.134  -4.216
  713    HG2  ARG  93           HG2      ARG  93   4.200   8.462  -2.504
  714    HG3  ARG  93           HG3      ARG  93   2.503   8.102  -2.858
  715    HD2  ARG  93           2HD      ARG  93   3.070   8.112  -5.314
  716    HD3  ARG  93           3HD      ARG  93   4.781   8.264  -4.886
  717    HE   ARG  93           HE       ARG  93   3.086   5.891  -4.664
  718   HH11  ARG  93          1HH1      ARG  93   6.099   7.420  -3.584
  719   HH12  ARG  93          2HH1      ARG  93   6.828   5.900  -3.126
  720   HH21  ARG  93          1HH2      ARG  93   4.076   3.949  -4.062
  721   HH22  ARG  93          2HH2      ARG  93   5.715   3.940  -3.448
  722    H    ARG  94           H        ARG  94   2.854  11.247  -6.011
  723    HA   ARG  94           HA       ARG  94   3.040  14.217  -5.831
  724    HB2  ARG  94           HB2      ARG  94   4.556  13.243  -7.554
  725    HB3  ARG  94           HB3      ARG  94   3.159  12.474  -8.318
  726    HG2  ARG  94           HG2      ARG  94   2.164  14.689  -8.775
  727    HG3  ARG  94           HG3      ARG  94   3.500  15.482  -7.904
  728    HD2  ARG  94           2HD      ARG  94   5.106  14.549  -9.544
  729    HD3  ARG  94           3HD      ARG  94   3.767  13.770 -10.413
  730    HE   ARG  94           HE       ARG  94   3.166  16.530 -10.196
  731   HH11  ARG  94          1HH1      ARG  94   5.545  14.436 -11.767
  732   HH12  ARG  94          2HH1      ARG  94   5.797  15.534 -13.106
  733   HH21  ARG  94          1HH2      ARG  94   3.528  17.942 -11.950
  734   HH22  ARG  94          2HH2      ARG  94   4.665  17.508 -13.207
  735    H    GLY  95           H        GLY  95   1.239  15.378  -6.644
  736    HA2  GLY  95           2HA      GLY  95  -0.979  15.768  -7.124
  737    HA3  GLY  95           3HA      GLY  95  -1.140  14.076  -7.629
  738    H5'    A  96           H5'        A  96   0.844 -13.132  -3.997
  739   H5''    A  96          H5''        A  96   0.799 -14.765  -3.332
  740    H4'    A  96           H4'        A  96  -1.240 -13.481  -5.231
  741    H3'    A  96           H3'        A  96  -0.938 -13.627  -2.349
  742    H2'    A  96           H2'        A  96  -2.467 -15.251  -1.712
  743   HO2'    A  96          HO2'        A  96  -4.210 -14.160  -2.862
  744    H1'    A  96           H1'        A  96  -2.521 -16.950  -3.815
  745    H8     A  96           H8         A  96   0.774 -16.983  -4.497
  746    H61    A  96           H61        A  96   2.430 -18.864   1.173
  747    H62    A  96           H62        A  96   2.954 -18.717  -0.495
  748    H2     A  96           H2         A  96  -1.705 -17.298   1.408
  749   HO5'    A  96          H5T         A  96   2.159 -14.634  -5.163
  750    H5'    U  97           H5'        U  97  -1.668 -12.117  -0.741
  751   H5''    U  97          H5''        U  97  -1.682 -10.349  -0.642
  752    H4'    U  97           H4'        U  97   0.708 -10.260  -0.385
  753    H3'    U  97           H3'        U  97   0.888 -12.752  -1.601
  754    H2'    U  97           H2'        U  97   0.519 -14.292   0.065
  755   HO2'    U  97          HO2'        U  97   2.147 -14.496   1.637
  756    H1'    U  97           H1'        U  97   0.716 -12.808   2.496
  757    H3     U  97           H3         U  97  -3.376 -13.837   4.067
  758    H5     U  97           H5         U  97  -3.541 -14.964   0.027
  759    H6     U  97           H6         U  97  -1.355 -13.941  -0.286
  760    H5'    C  98           H5'        C  98   4.913 -11.228   0.262
  761   H5''    C  98          H5''        C  98   5.217  -9.621  -0.420
  762    H4'    C  98           H4'        C  98   7.314 -10.583   0.166
  763    H3'    C  98           H3'        C  98   6.954  -9.577  -2.350
  764    H2'    C  98           H2'        C  98   6.208 -11.641  -3.323
  765   HO2'    C  98          HO2'        C  98   9.032 -11.511  -3.622
  766    H1'    C  98           H1'        C  98   8.437 -13.181  -2.009
  767    H41    C  98           H41        C  98   4.556 -17.714  -4.226
  768    H42    C  98           H42        C  98   3.228 -17.111  -3.256
  769    H5     C  98           H5         C  98   3.393 -15.061  -1.915
  770    H6     C  98           H6         C  98   4.895 -13.255  -1.250
  771    H5'    A  99           H5'        A  99   9.685  -6.136  -1.180
  772   H5''    A  99          H5''        A  99   8.092  -6.466  -1.895
  773    H4'    A  99           H4'        A  99  10.604  -5.951  -3.535
  774    H3'    A  99           H3'        A  99   9.324  -4.011  -1.978
  775    H2'    A  99           H2'        A  99   7.245  -4.165  -3.178
  776   HO2'    A  99          HO2'        A  99   8.585  -2.030  -3.678
  777    H1'    A  99           H1'        A  99   8.948  -4.484  -5.646
  778    H8     A  99           H8         A  99   7.122  -3.636  -7.189
  779    H61    A  99           H61        A  99   1.941  -7.051  -6.839
  780    H62    A  99           H62        A  99   2.775  -5.811  -7.763
  781    H2     A  99           H2         A  99   4.583  -8.187  -3.471
  782    H5'    A 100           H5'        A 100  13.258  -3.321  -3.671
  783   H5''    A 100          H5''        A 100  14.057  -1.758  -3.494
  784    H4'    A 100           H4'        A 100  14.720  -3.182  -5.544
  785    H3'    A 100           H3'        A 100  14.685  -0.465  -5.121
  786    H2'    A 100           H2'        A 100  12.534  -0.153  -6.093
  787   HO2'    A 100          HO2'        A 100  12.912   0.688  -8.240
  788    H1'    A 100           H1'        A 100  13.362  -2.038  -8.306
  789    H8     A 100           H8         A 100  10.268  -1.838  -5.978
  790    H61    A 100           H61        A 100   7.208  -0.121 -11.127
  791    H62    A 100           H62        A 100   7.019  -0.560  -9.437
  792    H2     A 100           H2         A 100  11.506  -0.477 -12.113
  793    H5'    A 101           H5'        A 101  15.897   1.190  -7.027
  794   H5''    A 101          H5''        A 101  17.466   0.908  -7.806
  795    H4'    A 101           H4'        A 101  17.071   3.264  -7.282
  796    H3'    A 101           H3'        A 101  19.436   1.911  -6.944
  797   HO3'    A 101          H3T         A 101  20.305   4.057  -6.504
  798    H2'    A 101           H2'        A 101  19.156   1.351  -4.691
  799   HO2'    A 101          HO2'        A 101  21.079   2.590  -4.767
  800    H1'    A 101           H1'        A 101  18.081   4.075  -4.011
  801    H8     A 101           H8         A 101  17.782   0.236  -3.592
  802    H61    A 101           H61        A 101  15.770   1.574   2.134
  803    H62    A 101           H62        A 101  16.216   0.274   1.043
  804    H2     A 101           H2         A 101  16.308   5.384  -0.064
  Start of MODEL    6
    1    H1   MET   1           H1       MET   1   2.838   0.891  -1.497
    2    H2   MET   1           H2       MET   1   1.708   2.005  -1.101
    3    H3   MET   1           H3       MET   1   3.295   2.428  -1.113
    4    HA   MET   1           HA       MET   1   2.120   3.284  -3.052
    5    HB2  MET   1           HB2      MET   1   4.279   1.208  -3.466
    6    HB3  MET   1           HB3      MET   1   3.633   2.194  -4.793
    7    HG2  MET   1           HG2      MET   1   4.742   3.412  -2.239
    8    HG3  MET   1           HG3      MET   1   5.734   3.026  -3.649
    9    HE1  MET   1           HE1      MET   1   3.126   5.335  -2.045
   10    HE2  MET   1           HE2      MET   1   2.775   6.547  -3.289
   11    HE3  MET   1           HE3      MET   1   2.033   4.952  -3.411
   12    H    VAL   2           H        VAL   2  -0.041   2.675  -3.021
   13    HA   VAL   2           HA       VAL   2  -0.856   0.233  -4.353
   14    HB   VAL   2           HB       VAL   2  -2.287   1.337  -2.678
   15   HG11  VAL   2          1HG1      VAL   2  -3.344   3.521  -3.151
   16   HG12  VAL   2          HG21      VAL   2  -1.579   3.672  -3.061
   17   HG13  VAL   2          HG31      VAL   2  -2.402   3.658  -4.648
   18   HG21  VAL   2          HG32      VAL   2  -3.615   1.735  -5.376
   19   HG22  VAL   2          1HG2      VAL   2  -3.369   0.132  -4.640
   20   HG23  VAL   2          HG22      VAL   2  -4.387   1.349  -3.821
   21    H    GLU   3           H        GLU   3   0.971   2.467  -5.472
   22    HA   GLU   3           HA       GLU   3  -0.567   3.552  -7.689
   23    HB2  GLU   3           HB2      GLU   3   2.358   3.806  -6.856
   24    HB3  GLU   3           HB3      GLU   3   1.587   4.789  -8.112
   25    HG2  GLU   3           HG2      GLU   3   0.695   4.682  -5.203
   26    HG3  GLU   3           HG3      GLU   3   1.752   5.928  -5.898
   27    H    ALA   4           H        ALA   4  -0.566   2.852  -9.727
   28    HA   ALA   4           HA       ALA   4   1.117   0.478 -10.361
   29    HB1  ALA   4           1HB      ALA   4  -1.537   1.442 -11.478
   30    HB2  ALA   4           HB2      ALA   4  -0.692  -0.064 -11.928
   31    HB3  ALA   4           HB3      ALA   4  -1.306   0.168 -10.266
   32    H    ASP   5           H        ASP   5   2.891   1.164 -11.256
   33    HA   ASP   5           HA       ASP   5   3.120   3.657 -12.681
   34    HB2  ASP   5           HB2      ASP   5   4.820   2.744 -11.149
   35    HB3  ASP   5           HB3      ASP   5   5.100   1.395 -12.243
   36    H    ARG   6           H        ARG   6   1.515   3.135 -14.321
   37    HA   ARG   6           HA       ARG   6   0.924   2.872 -16.443
   38    HB2  ARG   6           HB2      ARG   6   3.017   4.148 -16.744
   39    HB3  ARG   6           HB3      ARG   6   3.893   2.629 -17.008
   40    HG2  ARG   6           HG2      ARG   6   2.408   2.140 -18.956
   41    HG3  ARG   6           HG3      ARG   6   1.600   3.704 -18.708
   42    HD2  ARG   6           2HD      ARG   6   4.562   3.299 -19.276
   43    HD3  ARG   6           3HD      ARG   6   3.363   3.815 -20.466
   44    HE   ARG   6           HE       ARG   6   4.542   5.427 -18.309
   45   HH11  ARG   6          1HH1      ARG   6   1.964   5.175 -20.729
   46   HH12  ARG   6          2HH1      ARG   6   1.631   6.886 -20.712
   47   HH21  ARG   6          1HH2      ARG   6   4.102   7.659 -18.342
   48   HH22  ARG   6          2HH2      ARG   6   2.842   8.288 -19.377
   49    HA   PRO   7           HA       PRO   7   0.290  -1.463 -17.258
   50    HB2  PRO   7           HB2      PRO   7  -0.059  -0.286 -20.021
   51    HB3  PRO   7           HB3      PRO   7  -1.060  -1.556 -19.238
   52    HG2  PRO   7           HG2      PRO   7  -1.936   0.956 -19.342
   53    HG3  PRO   7           HG3      PRO   7  -2.020   0.095 -17.762
   54    HD2  PRO   7           2HD      PRO   7   0.055   2.099 -18.709
   55    HD3  PRO   7           3HD      PRO   7  -0.755   1.995 -17.116
   56    H    GLY   8           H        GLY   8   1.534  -3.178 -18.110
   57    HA2  GLY   8           2HA      GLY   8   2.886  -4.109 -19.843
   58    HA3  GLY   8           3HA      GLY   8   3.575  -2.501 -20.162
   59    H    LYS   9           H        LYS   9   3.667  -2.251 -16.985
   60    HA   LYS   9           HA       LYS   9   6.315  -3.546 -16.854
   61    HB2  LYS   9           HB2      LYS   9   6.228  -1.186 -16.177
   62    HB3  LYS   9           HB3      LYS   9   5.042  -1.597 -14.904
   63    HG2  LYS   9           HG2      LYS   9   6.671  -3.189 -13.913
   64    HG3  LYS   9           HG3      LYS   9   7.844  -2.790 -15.174
   65    HD2  LYS   9           2HD      LYS   9   6.702  -0.767 -13.209
   66    HD3  LYS   9           3HD      LYS   9   8.215  -1.673 -12.965
   67    HE2  LYS   9           HE2      LYS   9   9.122  -0.730 -15.067
   68    HE3  LYS   9           HE3      LYS   9   7.624   0.189 -15.305
   69    HZ1  LYS   9           3HZ      LYS   9   9.389   0.474 -12.966
   70    HZ2  LYS   9           1HZ      LYS   9   9.418   1.465 -14.281
   71    HZ3  LYS   9           2HZ      LYS   9   8.084   1.406 -13.332
   72    H    LEU  10           H        LEU  10   6.660  -5.370 -15.769
   73    HA   LEU  10           HA       LEU  10   4.390  -6.427 -14.138
   74    HB2  LEU  10           HB2      LEU  10   6.516  -7.768 -15.821
   75    HB3  LEU  10           HB3      LEU  10   5.459  -8.681 -14.800
   76    HG   LEU  10           HG       LEU  10   4.600  -6.966 -17.174
   77   HD11  LEU  10          1HD1      LEU  10   4.395  -9.966 -16.680
   78   HD12  LEU  10          2HD1      LEU  10   4.171  -9.113 -18.220
   79   HD13  LEU  10          3HD1      LEU  10   5.796  -9.233 -17.474
   80   HD21  LEU  10          3HD2      LEU  10   2.949  -8.649 -15.253
   81   HD22  LEU  10          1HD2      LEU  10   2.802  -6.892 -15.549
   82   HD23  LEU  10          2HD2      LEU  10   2.379  -8.063 -16.826
   83    H    PHE  11           H        PHE  11   4.814  -7.420 -12.208
   84    HA   PHE  11           HA       PHE  11   7.520  -7.063 -11.029
   85    HB2  PHE  11           HB2      PHE  11   5.763  -6.072  -9.702
   86    HB3  PHE  11           HB3      PHE  11   4.752  -7.509  -9.859
   87    HD1  PHE  11           HD2      PHE  11   8.027  -6.341  -8.491
   88    HD2  PHE  11           HD1      PHE  11   4.876  -9.261  -8.278
   89    HE1  PHE  11           HE2      PHE  11   9.040  -7.285  -6.428
   90    HE2  PHE  11           HE1      PHE  11   5.902 -10.208  -6.225
   91    HZ   PHE  11           HZ       PHE  11   8.001  -9.222  -5.319
   92    H    ILE  12           H        ILE  12   8.759  -8.842 -10.708
   93    HA   ILE  12           HA       ILE  12   7.492 -11.478 -11.291
   94    HB   ILE  12           HB       ILE  12  10.373 -10.768 -11.870
   95   HG12  ILE  12          HG21      ILE  12   9.171  -9.152 -13.197
   96   HG13  ILE  12          HG31      ILE  12   9.860 -10.418 -14.205
   97   HG21  ILE  12          1HG2      ILE  12   8.418 -12.837 -12.938
   98   HG22  ILE  12          HG22      ILE  12  10.123 -12.670 -13.435
   99   HG23  ILE  12          HG32      ILE  12   9.709 -13.134 -11.759
  100   HD11  ILE  12          3HD1      ILE  12   6.935 -10.095 -13.440
  101   HD12  ILE  12          1HD1      ILE  12   7.685  -9.880 -15.041
  102   HD13  ILE  12          2HD1      ILE  12   7.588 -11.496 -14.324
  103    H    GLY  13           H        GLY  13   7.127 -11.642  -8.906
  104    HA2  GLY  13           2HA      GLY  13   9.596 -11.685  -7.265
  105    HA3  GLY  13           3HA      GLY  13   7.946 -11.737  -6.669
  106    H    GLY  14           H        GLY  14  10.426 -13.540  -6.264
  107    HA2  GLY  14           2HA      GLY  14  10.120 -15.678  -5.263
  108    HA3  GLY  14           3HA      GLY  14   8.827 -16.041  -6.419
  109    H    LEU  15           H        LEU  15  11.454 -14.480  -7.919
  110    HA   LEU  15           HA       LEU  15  12.086 -16.709  -9.587
  111    HB2  LEU  15           HB2      LEU  15  13.593 -14.127  -9.008
  112    HB3  LEU  15           HB3      LEU  15  13.934 -15.265 -10.340
  113    HG   LEU  15           HG       LEU  15  11.191 -14.040 -10.125
  114   HD11  LEU  15          1HD1      LEU  15  12.791 -12.152 -10.064
  115   HD12  LEU  15          2HD1      LEU  15  13.693 -12.853 -11.426
  116   HD13  LEU  15          3HD1      LEU  15  12.033 -12.268 -11.671
  117   HD21  LEU  15          3HD2      LEU  15  11.820 -15.976 -11.671
  118   HD22  LEU  15          1HD2      LEU  15  11.217 -14.527 -12.513
  119   HD23  LEU  15          2HD2      LEU  15  12.961 -14.865 -12.459
  120    H    ASN  16           H        ASN  16  14.245 -17.650  -9.898
  121    HA   ASN  16           HA       ASN  16  15.383 -18.664  -7.467
  122    HB2  ASN  16           HB2      ASN  16  15.130 -19.854  -9.629
  123    HB3  ASN  16           HB3      ASN  16  16.357 -18.774 -10.335
  124   HD21  ASN  16          2HD2      ASN  16  17.533 -20.672 -10.859
  125   HD22  ASN  16          1HD2      ASN  16  18.334 -21.626  -9.663
  126    H    THR  17           H        THR  17  17.632 -18.347  -6.797
  127    HA   THR  17           HA       THR  17  18.452 -15.573  -6.898
  128    HB   THR  17           HB       THR  17  20.338 -16.381  -5.502
  129    HG1  THR  17           1HG      THR  17  20.609 -18.441  -6.374
  130   HG21  THR  17          1HG2      THR  17  17.650 -17.573  -4.721
  131   HG22  THR  17          HG22      THR  17  18.972 -17.144  -3.612
  132   HG23  THR  17          HG32      THR  17  18.113 -15.861  -4.507
  133    H    GLU  18           H        GLU  18  18.663 -17.893  -9.176
  134    HA   GLU  18           HA       GLU  18  21.475 -17.382  -9.977
  135    HB2  GLU  18           HB2      GLU  18  19.675 -19.624 -10.914
  136    HB3  GLU  18           HB3      GLU  18  21.442 -19.570 -10.919
  137    HG2  GLU  18           HG2      GLU  18  19.656 -19.691  -8.436
  138    HG3  GLU  18           HG3      GLU  18  20.466 -21.057  -9.138
  139    H    THR  19           H        THR  19  18.310 -16.477 -10.663
  140    HA   THR  19           HA       THR  19  18.484 -16.496 -13.583
  141    HB   THR  19           HB       THR  19  16.467 -15.184 -11.717
  142    HG1  THR  19           1HG      THR  19  15.267 -17.070 -12.179
  143   HG21  THR  19          1HG2      THR  19  14.967 -15.329 -13.686
  144   HG22  THR  19          HG22      THR  19  16.372 -14.305 -14.021
  145   HG23  THR  19          HG32      THR  19  16.308 -15.969 -14.660
  146    H    ASN  20           H        ASN  20  18.802 -14.718 -14.909
  147    HA   ASN  20           HA       ASN  20  19.375 -12.129 -13.566
  148    HB2  ASN  20           HB2      ASN  20  20.958 -12.746 -15.989
  149    HB3  ASN  20           HB3      ASN  20  21.393 -11.806 -14.561
  150   HD21  ASN  20          2HD2      ASN  20  21.260 -14.944 -16.090
  151   HD22  ASN  20          1HD2      ASN  20  22.232 -15.805 -14.911
  152    H    GLU  21           H        GLU  21  19.953 -10.685 -15.799
  153    HA   GLU  21           HA       GLU  21  17.290 -10.043 -16.650
  154    HB2  GLU  21           HB2      GLU  21  20.038  -9.078 -17.518
  155    HB3  GLU  21           HB3      GLU  21  18.514  -8.381 -18.108
  156    HG2  GLU  21           HG2      GLU  21  17.835  -7.755 -15.878
  157    HG3  GLU  21           HG3      GLU  21  19.152  -8.683 -15.163
  158    H    LYS  22           H        LYS  22  19.997 -11.831 -18.180
  159    HA   LYS  22           HA       LYS  22  18.886 -11.747 -20.816
  160    HB2  LYS  22           HB2      LYS  22  21.242 -12.175 -20.386
  161    HB3  LYS  22           HB3      LYS  22  20.862 -13.645 -19.481
  162    HG2  LYS  22           HG2      LYS  22  21.652 -14.070 -21.818
  163    HG3  LYS  22           HG3      LYS  22  20.057 -14.760 -21.476
  164    HD2  LYS  22           2HD      LYS  22  18.953 -12.900 -22.630
  165    HD3  LYS  22           3HD      LYS  22  20.512 -12.074 -22.843
  166    HE2  LYS  22           HE2      LYS  22  19.872 -13.186 -24.918
  167    HE3  LYS  22           HE3      LYS  22  21.307 -13.973 -24.243
  168    HZ1  LYS  22           3HZ      LYS  22  18.540 -14.943 -23.989
  169    HZ2  LYS  22           1HZ      LYS  22  19.683 -15.559 -24.995
  170    HZ3  LYS  22           2HZ      LYS  22  19.872 -15.692 -23.374
  171    H    ALA  23           H        ALA  23  18.266 -13.776 -18.009
  172    HA   ALA  23           HA       ALA  23  16.926 -15.843 -19.630
  173    HB1  ALA  23           1HB      ALA  23  17.215 -15.462 -16.622
  174    HB2  ALA  23           HB2      ALA  23  16.524 -16.893 -17.427
  175    HB3  ALA  23           HB3      ALA  23  18.242 -16.484 -17.652
  176    H    LEU  24           H        LEU  24  16.282 -12.867 -18.047
  177    HA   LEU  24           HA       LEU  24  13.441 -13.345 -17.543
  178    HB2  LEU  24           HB2      LEU  24  15.676 -11.567 -16.774
  179    HB3  LEU  24           HB3      LEU  24  14.236 -10.633 -17.046
  180    HG   LEU  24           HG       LEU  24  14.287 -13.177 -15.392
  181   HD11  LEU  24          1HD1      LEU  24  14.673 -10.311 -14.412
  182   HD12  LEU  24          2HD1      LEU  24  14.454 -11.739 -13.368
  183   HD13  LEU  24          3HD1      LEU  24  15.898 -11.609 -14.392
  184   HD21  LEU  24          3HD2      LEU  24  12.092 -12.287 -16.173
  185   HD22  LEU  24          1HD2      LEU  24  12.237 -12.246 -14.391
  186   HD23  LEU  24          2HD2      LEU  24  12.428 -10.752 -15.347
  187    H    GLU  25           H        GLU  25  15.594 -11.735 -19.841
  188    HA   GLU  25           HA       GLU  25  13.371 -10.461 -21.229
  189    HB2  GLU  25           HB2      GLU  25  16.292 -11.006 -21.995
  190    HB3  GLU  25           HB3      GLU  25  15.148 -10.141 -23.047
  191    HG2  GLU  25           HG2      GLU  25  14.721  -8.547 -21.240
  192    HG3  GLU  25           HG3      GLU  25  15.986  -9.310 -20.254
  193    H    ALA  26           H        ALA  26  15.089 -13.468 -21.236
  194    HA   ALA  26           HA       ALA  26  14.344 -14.301 -23.921
  195    HB1  ALA  26           1HB      ALA  26  15.543 -15.757 -21.546
  196    HB2  ALA  26           HB2      ALA  26  15.430 -16.418 -23.198
  197    HB3  ALA  26           HB3      ALA  26  16.445 -14.987 -22.885
  198    H    VAL  27           H        VAL  27  12.961 -14.492 -20.712
  199    HA   VAL  27           HA       VAL  27  11.221 -16.760 -21.476
  200    HB   VAL  27           HB       VAL  27  12.687 -16.657 -19.469
  201   HG11  VAL  27          1HG1      VAL  27  12.100 -14.304 -18.860
  202   HG12  VAL  27          HG21      VAL  27  10.512 -14.930 -18.298
  203   HG13  VAL  27          HG31      VAL  27  12.020 -15.482 -17.521
  204   HG21  VAL  27          HG32      VAL  27  11.004 -17.665 -17.963
  205   HG22  VAL  27          1HG2      VAL  27   9.692 -17.019 -18.988
  206   HG23  VAL  27          HG22      VAL  27  10.802 -18.263 -19.637
  207    H    PHE  28           H        PHE  28  11.099 -13.373 -20.429
  208    HA   PHE  28           HA       PHE  28   8.150 -13.410 -20.683
  209    HB2  PHE  28           HB2      PHE  28  10.077 -11.256 -19.796
  210    HB3  PHE  28           HB3      PHE  28   8.333 -11.014 -20.014
  211    HD1  PHE  28           HD1      PHE  28   6.688 -12.163 -18.596
  212    HD2  PHE  28           HD2      PHE  28  10.906 -12.502 -17.884
  213    HE1  PHE  28           HE1      PHE  28   6.230 -13.079 -16.343
  214    HE2  PHE  28           HE2      PHE  28  10.461 -13.430 -15.631
  215    HZ   PHE  28           HZ       PHE  28   8.120 -13.715 -14.851
  216    H    GLY  29           H        GLY  29  10.848 -12.929 -22.698
  217    HA2  GLY  29           2HA      GLY  29   9.586 -11.012 -24.500
  218    HA3  GLY  29           3HA      GLY  29  11.040 -11.981 -24.832
  219    H    LYS  30           H        LYS  30   8.855 -14.141 -23.691
  220    HA   LYS  30           HA       LYS  30   8.286 -15.232 -26.328
  221    HB2  LYS  30           HB2      LYS  30   7.546 -16.132 -23.495
  222    HB3  LYS  30           HB3      LYS  30   7.464 -17.136 -24.963
  223    HG2  LYS  30           HG2      LYS  30   9.890 -16.932 -25.250
  224    HG3  LYS  30           HG3      LYS  30  10.015 -15.854 -23.860
  225    HD2  LYS  30           2HD      LYS  30  10.713 -18.152 -23.275
  226    HD3  LYS  30           3HD      LYS  30   9.365 -17.569 -22.301
  227    HE2  LYS  30           HE2      LYS  30   8.970 -19.862 -22.908
  228    HE3  LYS  30           HE3      LYS  30   7.768 -18.830 -23.691
  229    HZ1  LYS  30           3HZ      LYS  30  10.183 -19.928 -24.985
  230    HZ2  LYS  30           1HZ      LYS  30   8.648 -20.462 -25.201
  231    HZ3  LYS  30           2HZ      LYS  30   9.070 -18.959 -25.712
  232    H    TYR  31           H        TYR  31   6.804 -13.085 -24.229
  233    HA   TYR  31           HA       TYR  31   4.062 -13.741 -25.215
  234    HB2  TYR  31           HB2      TYR  31   5.000 -12.210 -22.778
  235    HB3  TYR  31           HB3      TYR  31   3.319 -12.549 -23.183
  236    HD1  TYR  31           HD1      TYR  31   2.732 -15.129 -23.401
  237    HD2  TYR  31           HD2      TYR  31   6.257 -13.611 -21.464
  238    HE1  TYR  31           HE1      TYR  31   2.998 -17.288 -22.209
  239    HE2  TYR  31           HE2      TYR  31   6.512 -15.761 -20.231
  240    HH   TYR  31           HH       TYR  31   4.276 -18.522 -20.796
  241    H    GLY  32           H        GLY  32   6.599 -11.310 -25.303
  242    HA2  GLY  32           2HA      GLY  32   5.204  -9.694 -27.196
  243    HA3  GLY  32           3HA      GLY  32   5.104  -8.945 -25.583
  244    H    ARG  33           H        ARG  33   6.301  -7.627 -27.667
  245    HA   ARG  33           HA       ARG  33   9.140  -8.036 -27.608
  246    HB2  ARG  33           HB2      ARG  33   7.528  -6.896 -29.377
  247    HB3  ARG  33           HB3      ARG  33   7.821  -5.440 -28.398
  248    HG2  ARG  33           HG2      ARG  33  10.272  -5.787 -28.673
  249    HG3  ARG  33           HG3      ARG  33   9.916  -7.285 -29.580
  250    HD2  ARG  33           2HD      ARG  33   8.655  -5.938 -31.258
  251    HD3  ARG  33           3HD      ARG  33   9.104  -4.462 -30.397
  252    HE   ARG  33           HE       ARG  33  10.829  -6.167 -32.079
  253   HH11  ARG  33          1HH1      ARG  33  10.680  -3.464 -29.786
  254   HH12  ARG  33          2HH1      ARG  33  12.263  -2.868 -30.218
  255   HH21  ARG  33          1HH2      ARG  33  12.886  -5.355 -32.612
  256   HH22  ARG  33          2HH2      ARG  33  13.497  -3.925 -31.819
  257    H    ILE  34           H        ILE  34  10.341  -7.627 -25.961
  258    HA   ILE  34           HA       ILE  34   9.478  -5.967 -23.722
  259    HB   ILE  34           HB       ILE  34  12.071  -7.400 -24.379
  260   HG12  ILE  34          HG21      ILE  34   9.673  -7.996 -22.592
  261   HG13  ILE  34          HG31      ILE  34  10.172  -8.886 -24.031
  262   HG21  ILE  34          1HG2      ILE  34  11.243  -6.099 -21.755
  263   HG22  ILE  34          HG22      ILE  34  12.748  -7.004 -22.083
  264   HG23  ILE  34          HG32      ILE  34  12.475  -5.456 -22.879
  265   HD11  ILE  34          3HD1      ILE  34  10.841 -10.137 -22.061
  266   HD12  ILE  34          1HD1      ILE  34  12.299  -9.513 -22.878
  267   HD13  ILE  34          2HD1      ILE  34  11.692  -8.736 -21.395
  268    H    VAL  35           H        VAL  35  10.092  -3.961 -23.136
  269    HA   VAL  35           HA       VAL  35  11.844  -2.474 -25.037
  270    HB   VAL  35           HB       VAL  35  10.469  -0.670 -23.306
  271   HG11  VAL  35          1HG1      VAL  35  10.111  -1.330 -26.247
  272   HG12  VAL  35          HG21      VAL  35   9.586   0.166 -25.436
  273   HG13  VAL  35          HG31      VAL  35  11.318  -0.214 -25.563
  274   HG21  VAL  35          HG32      VAL  35   8.556  -2.611 -24.666
  275   HG22  VAL  35          1HG2      VAL  35   8.720  -2.333 -22.918
  276   HG23  VAL  35          HG22      VAL  35   8.122  -1.040 -23.980
  277    H    GLU  36           H        GLU  36  11.407  -3.599 -21.765
  278    HA   GLU  36           HA       GLU  36  14.127  -2.818 -21.109
  279    HB2  GLU  36           HB2      GLU  36  12.882  -0.727 -20.612
  280    HB3  GLU  36           HB3      GLU  36  11.771  -1.625 -19.563
  281    HG2  GLU  36           HG2      GLU  36  13.575  -2.196 -18.039
  282    HG3  GLU  36           HG3      GLU  36  14.769  -1.480 -19.142
  283    H    VAL  37           H        VAL  37  14.939  -4.048 -19.365
  284    HA   VAL  37           HA       VAL  37  12.966  -5.614 -17.816
  285    HB   VAL  37           HB       VAL  37  15.153  -6.745 -19.510
  286   HG11  VAL  37          1HG1      VAL  37  14.450  -7.906 -16.779
  287   HG12  VAL  37          HG21      VAL  37  15.390  -8.716 -18.051
  288   HG13  VAL  37          HG31      VAL  37  16.046  -7.268 -17.270
  289   HG21  VAL  37          HG32      VAL  37  13.519  -8.649 -19.518
  290   HG22  VAL  37          1HG2      VAL  37  12.523  -7.775 -18.345
  291   HG23  VAL  37          HG22      VAL  37  12.754  -7.107 -19.979
  292    H    LEU  38           H        LEU  38  13.451  -5.914 -15.731
  293    HA   LEU  38           HA       LEU  38  15.987  -4.686 -14.693
  294    HB2  LEU  38           HB2      LEU  38  13.139  -4.479 -13.991
  295    HB3  LEU  38           HB3      LEU  38  14.182  -4.684 -12.599
  296    HG   LEU  38           HG       LEU  38  14.587  -2.497 -14.698
  297   HD11  LEU  38          1HD1      LEU  38  13.419  -2.396 -11.881
  298   HD12  LEU  38          2HD1      LEU  38  13.730  -0.992 -12.921
  299   HD13  LEU  38          3HD1      LEU  38  12.498  -2.186 -13.390
  300   HD21  LEU  38          3HD2      LEU  38  16.085  -1.535 -12.981
  301   HD22  LEU  38          1HD2      LEU  38  15.803  -2.942 -11.941
  302   HD23  LEU  38          2HD2      LEU  38  16.669  -3.132 -13.490
  303    H    LEU  39           H        LEU  39  16.864  -5.681 -12.820
  304    HA   LEU  39           HA       LEU  39  15.622  -8.101 -11.849
  305    HB2  LEU  39           HB2      LEU  39  16.845  -8.907 -13.821
  306    HB3  LEU  39           HB3      LEU  39  18.302  -8.047 -13.324
  307    HG   LEU  39           HG       LEU  39  18.198 -10.567 -13.095
  308   HD11  LEU  39          1HD1      LEU  39  19.957  -9.148 -12.131
  309   HD12  LEU  39          2HD1      LEU  39  19.005  -9.001 -10.625
  310   HD13  LEU  39          3HD1      LEU  39  19.628 -10.584 -11.144
  311   HD21  LEU  39          3HD2      LEU  39  17.312 -11.510 -11.056
  312   HD22  LEU  39          1HD2      LEU  39  16.706  -9.927 -10.524
  313   HD23  LEU  39          2HD2      LEU  39  16.004 -10.725 -11.965
  314    H    MET  40           H        MET  40  15.906  -8.053  -9.677
  315    HA   MET  40           HA       MET  40  17.769  -5.999  -8.640
  316    HB2  MET  40           HB2      MET  40  15.459  -7.538  -7.425
  317    HB3  MET  40           HB3      MET  40  16.495  -6.468  -6.493
  318    HG2  MET  40           HG2      MET  40  14.163  -5.771  -7.756
  319    HG3  MET  40           HG3      MET  40  15.396  -4.634  -7.216
  320    HE1  MET  40           HE3      MET  40  17.545  -4.137  -8.902
  321    HE2  MET  40           HE1      MET  40  16.997  -3.269 -10.355
  322    HE3  MET  40           HE2      MET  40  16.360  -2.816  -8.761
  323    H    LYS  41           H        LYS  41  19.514  -6.418  -7.422
  324    HA   LYS  41           HA       LYS  41  19.703  -9.042  -6.161
  325    HB2  LYS  41           HB2      LYS  41  22.288  -8.867  -6.976
  326    HB3  LYS  41           HB3      LYS  41  21.020  -9.832  -7.760
  327    HG2  LYS  41           HG2      LYS  41  20.609  -8.153  -9.406
  328    HG3  LYS  41           HG3      LYS  41  21.701  -6.994  -8.597
  329    HD2  LYS  41           2HD      LYS  41  23.607  -8.502  -9.035
  330    HD3  LYS  41           3HD      LYS  41  22.509  -9.670  -9.812
  331    HE2  LYS  41           HE2      LYS  41  21.873  -7.952 -11.484
  332    HE3  LYS  41           HE3      LYS  41  22.984  -6.803 -10.716
  333    HZ1  LYS  41           3HZ      LYS  41  24.787  -8.286 -11.247
  334    HZ2  LYS  41           1HZ      LYS  41  23.760  -9.367 -11.941
  335    HZ3  LYS  41           2HZ      LYS  41  23.970  -7.882 -12.618
  336    H    ASP  42           H        ASP  42  21.197  -9.171  -4.437
  337    HA   ASP  42           HA       ASP  42  20.939  -6.871  -2.800
  338    HB2  ASP  42           HB2      ASP  42  20.971  -9.431  -2.297
  339    HB3  ASP  42           HB3      ASP  42  22.725  -9.234  -2.216
  340    H    ARG  43           H        ARG  43  22.682  -5.747  -1.629
  341    HA   ARG  43           HA       ARG  43  24.884  -5.091  -3.469
  342    HB2  ARG  43           HB2      ARG  43  23.411  -3.371  -2.399
  343    HB3  ARG  43           HB3      ARG  43  24.072  -3.828  -0.819
  344    HG2  ARG  43           HG2      ARG  43  26.321  -3.141  -1.530
  345    HG3  ARG  43           HG3      ARG  43  25.723  -2.826  -3.176
  346    HD2  ARG  43           2HD      ARG  43  24.207  -1.087  -2.284
  347    HD3  ARG  43           3HD      ARG  43  24.811  -1.403  -0.641
  348    HE   ARG  43           HE       ARG  43  27.070  -0.854  -2.200
  349   HH11  ARG  43          1HH1      ARG  43  24.118   0.842  -1.242
  350   HH12  ARG  43          2HH1      ARG  43  24.858   2.422  -1.324
  351   HH21  ARG  43          1HH2      ARG  43  28.011   1.224  -2.298
  352   HH22  ARG  43          2HH2      ARG  43  27.057   2.636  -1.906
  353    H    GLU  44           H        GLU  44  24.371  -7.208  -0.855
  354    HA   GLU  44           HA       GLU  44  27.220  -7.063   0.017
  355    HB2  GLU  44           HB2      GLU  44  24.801  -8.371   1.303
  356    HB3  GLU  44           HB3      GLU  44  26.438  -8.321   1.978
  357    HG2  GLU  44           HG2      GLU  44  24.652  -5.916   1.415
  358    HG3  GLU  44           HG3      GLU  44  25.013  -6.596   3.003
  359    H    THR  45           H        THR  45  25.028  -8.978  -1.870
  360    HA   THR  45           HA       THR  45  27.087 -11.144  -1.962
  361    HB   THR  45           HB       THR  45  25.264 -12.788  -2.227
  362    HG1  THR  45           1HG      THR  45  23.147 -12.059  -1.683
  363   HG21  THR  45          1HG2      THR  45  24.896 -11.117   0.282
  364   HG22  THR  45          HG22      THR  45  24.513 -12.853   0.063
  365   HG23  THR  45          HG32      THR  45  26.213 -12.295   0.013
  366    H    ASN  46           H        ASN  46  25.106  -8.882  -3.658
  367    HA   ASN  46           HA       ASN  46  24.654  -8.589  -5.849
  368    HB2  ASN  46           HB2      ASN  46  27.185 -10.230  -6.044
  369    HB3  ASN  46           HB3      ASN  46  26.405  -9.492  -7.465
  370   HD21  ASN  46          2HD2      ASN  46  28.112  -8.869  -4.414
  371   HD22  ASN  46          1HD2      ASN  46  28.484  -7.191  -4.750
  372    H    LYS  47           H        LYS  47  23.782 -11.194  -4.334
  373    HA   LYS  47           HA       LYS  47  23.014 -12.914  -6.603
  374    HB2  LYS  47           HB2      LYS  47  22.639 -12.960  -3.589
  375    HB3  LYS  47           HB3      LYS  47  21.660 -13.998  -4.618
  376    HG2  LYS  47           HG2      LYS  47  24.680 -13.950  -4.854
  377    HG3  LYS  47           HG3      LYS  47  23.830 -15.004  -3.689
  378    HD2  LYS  47           2HD      LYS  47  22.508 -15.951  -5.618
  379    HD3  LYS  47           3HD      LYS  47  23.546 -15.015  -6.722
  380    HE2  LYS  47           HE2      LYS  47  25.541 -16.147  -5.763
  381    HE3  LYS  47           HE3      LYS  47  24.484 -17.079  -4.696
  382    HZ1  LYS  47           3HZ      LYS  47  23.438 -18.000  -6.684
  383    HZ2  LYS  47           1HZ      LYS  47  24.466 -17.155  -7.644
  384    HZ3  LYS  47           2HZ      LYS  47  25.042 -18.335  -6.652
  385    H    SER  48           H        SER  48  20.923 -13.188  -7.329
  386    HA   SER  48           HA       SER  48  19.312 -10.873  -7.477
  387    HB2  SER  48           HB2      SER  48  18.468 -13.770  -7.856
  388    HB3  SER  48           HB3      SER  48  17.638 -12.327  -8.483
  389    HG   SER  48           HG       SER  48  19.052 -13.248 -10.040
  390    H    ARG  49           H        ARG  49  17.659 -10.056  -6.246
  391    HA   ARG  49           HA       ARG  49  17.540 -11.059  -3.528
  392    HB2  ARG  49           HB2      ARG  49  15.802  -8.867  -4.690
  393    HB3  ARG  49           HB3      ARG  49  16.286  -9.125  -2.998
  394    HG2  ARG  49           HG2      ARG  49  18.738  -8.871  -4.158
  395    HG3  ARG  49           HG3      ARG  49  17.773  -7.926  -5.298
  396    HD2  ARG  49           2HD      ARG  49  18.627  -6.409  -3.670
  397    HD3  ARG  49           3HD      ARG  49  16.907  -6.581  -3.344
  398    HE   ARG  49           HE       ARG  49  19.076  -7.976  -1.805
  399   HH11  ARG  49          1HH1      ARG  49  15.891  -6.423  -1.888
  400   HH12  ARG  49          2HH1      ARG  49  15.648  -6.601  -0.167
  401   HH21  ARG  49          1HH2      ARG  49  18.749  -8.149   0.395
  402   HH22  ARG  49          2HH2      ARG  49  17.257  -7.606   1.130
  403    H    GLY  50           H        GLY  50  16.205 -12.264  -6.187
  404    HA2  GLY  50           2HA      GLY  50  14.651 -13.999  -6.278
  405    HA3  GLY  50           3HA      GLY  50  14.006 -13.524  -4.694
  406    H    PHE  51           H        PHE  51  14.240 -10.701  -6.564
  407    HA   PHE  51           HA       PHE  51  11.670 -11.178  -7.936
  408    HB2  PHE  51           HB2      PHE  51  10.573  -9.325  -7.035
  409    HB3  PHE  51           HB3      PHE  51  11.184 -10.248  -5.667
  410    HD1  PHE  51           HD2      PHE  51  13.427  -9.410  -4.591
  411    HD2  PHE  51           HD1      PHE  51  10.998  -7.046  -7.242
  412    HE1  PHE  51           HE2      PHE  51  14.486  -7.332  -3.727
  413    HE2  PHE  51           HE1      PHE  51  11.991  -4.978  -6.300
  414    HZ   PHE  51           HZ       PHE  51  13.739  -5.119  -4.574
  415    H    ALA  52           H        ALA  52  11.163  -9.546  -9.551
  416    HA   ALA  52           HA       ALA  52  13.318  -7.772 -10.432
  417    HB1  ALA  52           1HB      ALA  52  12.466 -10.192 -12.079
  418    HB2  ALA  52           HB2      ALA  52  13.627  -8.948 -12.576
  419    HB3  ALA  52           HB3      ALA  52  14.020 -10.035 -11.222
  420    H    PHE  53           H        PHE  53  12.618  -7.053 -12.851
  421    HA   PHE  53           HA       PHE  53   9.679  -6.848 -13.038
  422    HB2  PHE  53           HB2      PHE  53  11.534  -4.424 -13.040
  423    HB3  PHE  53           HB3      PHE  53   9.811  -4.388 -13.349
  424    HD1  PHE  53           HD1      PHE  53  12.424  -5.082 -10.821
  425    HD2  PHE  53           HD2      PHE  53   8.268  -4.273 -11.529
  426    HE1  PHE  53           HE1      PHE  53  12.073  -4.807  -8.386
  427    HE2  PHE  53           HE2      PHE  53   7.906  -3.985  -9.089
  428    HZ   PHE  53           HZ       PHE  53   9.802  -4.284  -7.511
  429    H    VAL  54           H        VAL  54   8.992  -5.943 -15.154
  430    HA   VAL  54           HA       VAL  54  11.008  -5.796 -17.277
  431    HB   VAL  54           HB       VAL  54  10.615  -8.231 -17.168
  432   HG11  VAL  54          1HG1      VAL  54   8.598  -9.263 -17.497
  433   HG12  VAL  54          HG21      VAL  54   8.637  -8.287 -16.005
  434   HG13  VAL  54          HG31      VAL  54   7.719  -7.689 -17.440
  435   HG21  VAL  54          HG32      VAL  54  10.711  -7.027 -19.467
  436   HG22  VAL  54          1HG2      VAL  54   9.907  -8.618 -19.455
  437   HG23  VAL  54          HG22      VAL  54   8.941  -7.129 -19.479
  438    H    THR  55           H        THR  55  10.269  -4.661 -19.059
  439    HA   THR  55           HA       THR  55   7.468  -3.650 -18.864
  440    HB   THR  55           HB       THR  55   9.847  -2.182 -20.053
  441    HG1  THR  55           1HG      THR  55   8.461  -1.833 -17.600
  442   HG21  THR  55          1HG2      THR  55   8.231  -0.273 -19.963
  443   HG22  THR  55          HG22      THR  55   7.699  -1.562 -21.064
  444   HG23  THR  55          HG32      THR  55   6.954  -1.407 -19.460
  445    H    PHE  56           H        PHE  56   6.179  -4.299 -20.422
  446    HA   PHE  56           HA       PHE  56   7.270  -5.387 -22.945
  447    HB2  PHE  56           HB2      PHE  56   4.541  -5.292 -21.626
  448    HB3  PHE  56           HB3      PHE  56   4.797  -5.886 -23.268
  449    HD1  PHE  56           HD2      PHE  56   6.291  -6.486 -19.815
  450    HD2  PHE  56           HD1      PHE  56   5.003  -8.098 -23.595
  451    HE1  PHE  56           HE2      PHE  56   6.870  -8.755 -19.049
  452    HE2  PHE  56           HE1      PHE  56   5.496 -10.369 -22.797
  453    HZ   PHE  56           HZ       PHE  56   6.392 -10.725 -20.506
  454    H    GLU  57           H        GLU  57   6.514  -4.694 -25.047
  455    HA   GLU  57           HA       GLU  57   6.058  -1.859 -25.305
  456    HB2  GLU  57           HB2      GLU  57   6.235  -4.261 -27.148
  457    HB3  GLU  57           HB3      GLU  57   5.611  -2.711 -27.724
  458    HG2  GLU  57           HG2      GLU  57   7.707  -1.612 -26.823
  459    HG3  GLU  57           HG3      GLU  57   8.358  -3.238 -26.532
  460    H    SER  58           H        SER  58   3.953  -4.718 -25.017
  461    HA   SER  58           HA       SER  58   1.640  -2.871 -25.439
  462    HB2  SER  58           HB2      SER  58   1.649  -4.508 -27.210
  463    HB3  SER  58           HB3      SER  58   1.944  -5.824 -26.054
  464    HG   SER  58           HG       SER  58  -0.277  -5.593 -26.692
  465    HA   PRO  59           HA       PRO  59   0.883  -3.682 -21.212
  466    HB2  PRO  59           HB2      PRO  59  -1.662  -2.810 -20.960
  467    HB3  PRO  59           HB3      PRO  59  -0.345  -1.660 -21.413
  468    HG2  PRO  59           HG2      PRO  59  -2.214  -3.164 -23.262
  469    HG3  PRO  59           HG3      PRO  59  -1.979  -1.391 -23.187
  470    HD2  PRO  59           2HD      PRO  59  -0.563  -2.873 -24.961
  471    HD3  PRO  59           3HD      PRO  59   0.276  -1.590 -24.034
  472    H    ALA  60           H        ALA  60  -0.588  -5.353 -23.842
  473    HA   ALA  60           HA       ALA  60  -2.071  -7.127 -21.979
  474    HB1  ALA  60           1HB      ALA  60  -2.512  -6.624 -24.941
  475    HB2  ALA  60           HB2      ALA  60  -3.448  -7.733 -23.912
  476    HB3  ALA  60           HB3      ALA  60  -3.493  -5.987 -23.591
  477    H    ASP  61           H        ASP  61   0.644  -6.892 -24.149
  478    HA   ASP  61           HA       ASP  61   0.979  -9.764 -24.462
  479    HB2  ASP  61           HB2      ASP  61   2.920  -7.403 -24.537
  480    HB3  ASP  61           HB3      ASP  61   3.399  -9.035 -24.793
  481    H    ALA  62           H        ALA  62   1.617  -7.280 -22.036
  482    HA   ALA  62           HA       ALA  62   3.187  -8.981 -20.297
  483    HB1  ALA  62           1HB      ALA  62   1.665  -6.390 -19.820
  484    HB2  ALA  62           HB2      ALA  62   2.793  -7.154 -18.675
  485    HB3  ALA  62           HB3      ALA  62   3.392  -6.556 -20.248
  486    H    LYS  63           H        LYS  63  -0.281  -8.263 -20.772
  487    HA   LYS  63           HA       LYS  63  -1.184  -9.567 -18.351
  488    HB2  LYS  63           HB2      LYS  63  -2.513  -9.046 -21.040
  489    HB3  LYS  63           HB3      LYS  63  -3.341  -9.777 -19.657
  490    HG2  LYS  63           HG2      LYS  63  -2.988  -7.802 -18.294
  491    HG3  LYS  63           HG3      LYS  63  -1.987  -7.064 -19.556
  492    HD2  LYS  63           2HD      LYS  63  -4.252  -6.103 -19.555
  493    HD3  LYS  63           3HD      LYS  63  -3.943  -6.951 -21.069
  494    HE2  LYS  63           HE2      LYS  63  -5.125  -8.961 -20.187
  495    HE3  LYS  63           HE3      LYS  63  -5.456  -8.095 -18.684
  496    HZ1  LYS  63           3HZ      LYS  63  -6.409  -7.292 -21.353
  497    HZ2  LYS  63           1HZ      LYS  63  -7.317  -7.992 -20.184
  498    HZ3  LYS  63           2HZ      LYS  63  -6.704  -6.484 -19.949
  499    H    ASP  64           H        ASP  64  -0.445 -10.626 -21.690
  500    HA   ASP  64           HA       ASP  64  -1.553 -13.246 -21.348
  501    HB2  ASP  64           HB2      ASP  64  -1.049 -11.975 -23.501
  502    HB3  ASP  64           HB3      ASP  64   0.657 -12.331 -23.231
  503    H    ALA  65           H        ALA  65   1.621 -11.787 -20.770
  504    HA   ALA  65           HA       ALA  65   2.908 -14.295 -20.085
  505    HB1  ALA  65           1HB      ALA  65   3.655 -11.462 -19.238
  506    HB2  ALA  65           HB2      ALA  65   4.707 -12.898 -19.259
  507    HB3  ALA  65           HB3      ALA  65   4.123 -12.197 -20.785
  508    H    ALA  66           H        ALA  66   1.378 -11.613 -18.223
  509    HA   ALA  66           HA       ALA  66   1.959 -12.782 -15.684
  510    HB1  ALA  66           1HB      ALA  66  -0.175 -10.749 -16.499
  511    HB2  ALA  66           HB2      ALA  66   0.443 -11.005 -14.851
  512    HB3  ALA  66           HB3      ALA  66   1.502 -10.345 -16.127
  513    H    ARG  67           H        ARG  67  -0.256 -13.659 -18.073
  514    HA   ARG  67           HA       ARG  67  -2.011 -15.114 -16.167
  515    HB2  ARG  67           HB2      ARG  67  -2.225 -14.441 -19.113
  516    HB3  ARG  67           HB3      ARG  67  -3.344 -15.548 -18.295
  517    HG2  ARG  67           HG2      ARG  67  -4.113 -13.852 -16.794
  518    HG3  ARG  67           HG3      ARG  67  -2.839 -12.728 -17.269
  519    HD2  ARG  67           2HD      ARG  67  -4.964 -12.092 -18.271
  520    HD3  ARG  67           3HD      ARG  67  -3.813 -12.530 -19.525
  521    HE   ARG  67           HE       ARG  67  -6.143 -14.161 -18.604
  522   HH11  ARG  67          1HH1      ARG  67  -3.570 -13.600 -20.967
  523   HH12  ARG  67          2HH1      ARG  67  -4.217 -14.746 -22.117
  524   HH21  ARG  67          1HH2      ARG  67  -6.970 -15.636 -20.136
  525   HH22  ARG  67          2HH2      ARG  67  -6.138 -15.876 -21.656
  526    H    ASP  68           H        ASP  68   0.964 -15.811 -17.399
  527    HA   ASP  68           HA       ASP  68   0.262 -18.650 -18.009
  528    HB2  ASP  68           HB2      ASP  68   1.727 -16.498 -19.483
  529    HB3  ASP  68           HB3      ASP  68   2.618 -17.963 -19.290
  530    H    MET  69           H        MET  69   2.743 -16.249 -17.329
  531    HA   MET  69           HA       MET  69   4.646 -18.086 -16.180
  532    HB2  MET  69           HB2      MET  69   4.354 -15.100 -16.709
  533    HB3  MET  69           HB3      MET  69   5.660 -15.685 -15.739
  534    HG2  MET  69           HG2      MET  69   5.050 -16.485 -18.602
  535    HG3  MET  69           HG3      MET  69   6.353 -15.421 -18.053
  536    HE1  MET  69           HE3      MET  69   8.461 -18.065 -15.873
  537    HE2  MET  69           HE1      MET  69   8.103 -16.336 -16.125
  538    HE3  MET  69           HE2      MET  69   6.930 -17.385 -15.294
  539    H    ASN  70           H        ASN  70   1.938 -16.253 -14.942
  540    HA   ASN  70           HA       ASN  70   3.038 -15.868 -12.289
  541    HB2  ASN  70           HB2      ASN  70   1.244 -14.455 -13.242
  542    HB3  ASN  70           HB3      ASN  70   0.168 -15.847 -13.310
  543   HD21  ASN  70          2HD2      ASN  70  -1.194 -14.342 -11.980
  544   HD22  ASN  70          1HD2      ASN  70  -0.967 -14.353 -10.244
  545    H    GLY  71           H        GLY  71   3.424 -17.449 -10.875
  546    HA2  GLY  71           2HA      GLY  71   2.773 -19.196  -9.447
  547    HA3  GLY  71           3HA      GLY  71   1.507 -19.668 -10.594
  548    H    LYS  72           H        LYS  72   3.995 -19.312 -12.685
  549    HA   LYS  72           HA       LYS  72   4.789 -22.142 -12.480
  550    HB2  LYS  72           HB2      LYS  72   5.283 -22.113 -14.589
  551    HB3  LYS  72           HB3      LYS  72   4.070 -20.830 -14.588
  552    HG2  LYS  72           HG2      LYS  72   5.703 -19.161 -14.979
  553    HG3  LYS  72           HG3      LYS  72   7.040 -20.148 -14.383
  554    HD2  LYS  72           2HD      LYS  72   7.180 -20.186 -16.782
  555    HD3  LYS  72           3HD      LYS  72   6.678 -21.787 -16.196
  556    HE2  LYS  72           HE2      LYS  72   4.364 -21.361 -16.758
  557    HE3  LYS  72           HE3      LYS  72   4.725 -19.658 -17.095
  558    HZ1  LYS  72           3HZ      LYS  72   5.753 -21.959 -18.636
  559    HZ2  LYS  72           1HZ      LYS  72   4.548 -20.955 -19.119
  560    HZ3  LYS  72           2HZ      LYS  72   6.078 -20.376 -18.946
  561    H    SER  73           H        SER  73   7.159 -22.416 -13.297
  562    HA   SER  73           HA       SER  73   8.863 -20.992 -11.279
  563    HB2  SER  73           HB2      SER  73   8.554 -23.397 -10.888
  564    HB3  SER  73           HB3      SER  73   9.053 -23.755 -12.548
  565    HG   SER  73           HG       SER  73  10.770 -23.997 -11.058
  566    H    LEU  74           H        LEU  74  10.877 -20.288 -11.786
  567    HA   LEU  74           HA       LEU  74  11.091 -19.599 -14.675
  568    HB2  LEU  74           HB2      LEU  74  11.284 -17.906 -12.573
  569    HB3  LEU  74           HB3      LEU  74  12.915 -18.482 -12.549
  570    HG   LEU  74           HG       LEU  74  12.781 -16.447 -13.821
  571   HD11  LEU  74          1HD1      LEU  74  13.193 -18.680 -15.834
  572   HD12  LEU  74          2HD1      LEU  74  13.837 -17.023 -15.885
  573   HD13  LEU  74          3HD1      LEU  74  14.401 -18.140 -14.631
  574   HD21  LEU  74          3HD2      LEU  74  11.371 -16.189 -15.776
  575   HD22  LEU  74          1HD2      LEU  74  10.923 -17.912 -15.747
  576   HD23  LEU  74          2HD2      LEU  74  10.352 -16.821 -14.466
  577    H    ASP  75           H        ASP  75  13.346 -20.432 -12.062
  578    HA   ASP  75           HA       ASP  75  14.959 -21.971 -14.035
  579    HB2  ASP  75           HB2      ASP  75  15.811 -19.571 -13.086
  580    HB3  ASP  75           HB3      ASP  75  16.026 -20.452 -11.640
  581    H    GLY  76           H        GLY  76  12.935 -22.310 -11.635
  582    HA2  GLY  76           2HA      GLY  76  13.134 -24.789 -10.918
  583    HA3  GLY  76           3HA      GLY  76  14.569 -24.187 -10.041
  584    H    LYS  77           H        LYS  77  12.835 -21.539  -9.926
  585    HA   LYS  77           HA       LYS  77  11.438 -22.277  -7.407
  586    HB2  LYS  77           HB2      LYS  77  12.759 -19.639  -8.124
  587    HB3  LYS  77           HB3      LYS  77  12.022 -20.068  -6.576
  588    HG2  LYS  77           HG2      LYS  77  14.474 -21.371  -7.840
  589    HG3  LYS  77           HG3      LYS  77  14.488 -20.265  -6.460
  590    HD2  LYS  77           2HD      LYS  77  13.416 -21.863  -5.037
  591    HD3  LYS  77           3HD      LYS  77  13.020 -22.939  -6.396
  592    HE2  LYS  77           HE2      LYS  77  15.370 -23.332  -6.859
  593    HE3  LYS  77           HE3      LYS  77  15.844 -22.229  -5.550
  594    HZ1  LYS  77           3HZ      LYS  77  14.758 -23.708  -3.999
  595    HZ2  LYS  77           1HZ      LYS  77  14.303 -24.718  -5.213
  596    HZ3  LYS  77           2HZ      LYS  77  15.897 -24.527  -4.858
  597    H    ALA  78           H        ALA  78   9.362 -21.704  -7.178
  598    HA   ALA  78           HA       ALA  78   7.951 -20.920  -9.580
  599    HB1  ALA  78           1HB      ALA  78   7.066 -22.591  -8.038
  600    HB2  ALA  78           HB2      ALA  78   6.959 -21.367  -6.747
  601    HB3  ALA  78           HB3      ALA  78   5.948 -21.218  -8.212
  602    H    ILE  79           H        ILE  79   6.964 -19.009 -10.098
  603    HA   ILE  79           HA       ILE  79   7.716 -16.737  -8.351
  604    HB   ILE  79           HB       ILE  79   8.022 -15.401 -10.275
  605   HG12  ILE  79          HG21      ILE  79   7.127 -17.736 -12.004
  606   HG13  ILE  79          HG31      ILE  79   6.137 -16.312 -11.627
  607   HG21  ILE  79          1HG2      ILE  79   9.285 -18.115 -10.847
  608   HG22  ILE  79          HG22      ILE  79   9.891 -16.520 -11.340
  609   HG23  ILE  79          HG32      ILE  79   9.860 -16.962  -9.617
  610   HD11  ILE  79          3HD1      ILE  79   8.777 -16.327 -13.137
  611   HD12  ILE  79          1HD1      ILE  79   7.156 -15.956 -13.774
  612   HD13  ILE  79          2HD1      ILE  79   7.911 -14.858 -12.603
  613    H    LYS  80           H        LYS  80   6.503 -14.711  -8.888
  614    HA   LYS  80           HA       LYS  80   3.618 -15.144  -9.466
  615    HB2  LYS  80           HB2      LYS  80   4.249 -14.381  -7.086
  616    HB3  LYS  80           HB3      LYS  80   4.852 -12.891  -7.826
  617    HG2  LYS  80           HG2      LYS  80   2.568 -12.589  -8.915
  618    HG3  LYS  80           HG3      LYS  80   1.997 -13.960  -7.947
  619    HD2  LYS  80           2HD      LYS  80   2.713 -12.673  -5.881
  620    HD3  LYS  80           3HD      LYS  80   3.112 -11.310  -6.949
  621    HE2  LYS  80           HE2      LYS  80   0.906 -10.942  -6.033
  622    HE3  LYS  80           HE3      LYS  80   0.762 -11.284  -7.762
  623    HZ1  LYS  80           3HZ      LYS  80   0.180 -13.551  -7.197
  624    HZ2  LYS  80           1HZ      LYS  80   0.305 -13.226  -5.590
  625    HZ3  LYS  80           2HZ      LYS  80  -0.860 -12.496  -6.483
  626    H    VAL  81           H        VAL  81   2.757 -13.736 -11.043
  627    HA   VAL  81           HA       VAL  81   4.532 -11.551 -11.988
  628    HB   VAL  81           HB       VAL  81   3.108 -13.523 -13.817
  629   HG11  VAL  81          1HG1      VAL  81   4.929 -11.148 -14.410
  630   HG12  VAL  81          HG21      VAL  81   4.209 -12.252 -15.611
  631   HG13  VAL  81          HG31      VAL  81   3.172 -11.172 -14.664
  632   HG21  VAL  81          HG32      VAL  81   6.056 -13.036 -13.209
  633   HG22  VAL  81          1HG2      VAL  81   5.126 -14.513 -12.849
  634   HG23  VAL  81          HG22      VAL  81   5.449 -14.050 -14.532
  635    H    GLU  82           H        GLU  82   3.518  -9.686 -12.132
  636    HA   GLU  82           HA       GLU  82   0.648  -9.462 -12.605
  637    HB2  GLU  82           HB2      GLU  82   0.815 -10.164 -10.185
  638    HB3  GLU  82           HB3      GLU  82   1.855  -8.779  -9.881
  639    HG2  GLU  82           HG2      GLU  82  -0.485  -8.388  -9.182
  640    HG3  GLU  82           HG3      GLU  82   0.031  -7.237 -10.410
  641    H    GLN  83           H        GLN  83   0.048  -7.054 -12.695
  642    HA   GLN  83           HA       GLN  83   2.135  -5.456 -13.795
  643    HB2  GLN  83           HB2      GLN  83  -0.141  -4.935 -14.335
  644    HB3  GLN  83           HB3      GLN  83  -0.604  -4.878 -12.629
  645    HG2  GLN  83           HG2      GLN  83  -0.562  -2.647 -13.446
  646    HG3  GLN  83           HG3      GLN  83   0.760  -2.849 -12.295
  647   HE21  GLN  83          HE22      GLN  83   2.211  -1.359 -12.951
  648   HE22  GLN  83          HE12      GLN  83   2.859  -1.223 -14.568
  649    H    ALA  84           H        ALA  84   3.627  -4.113 -12.837
  650    HA   ALA  84           HA       ALA  84   4.097  -4.624 -10.019
  651    HB1  ALA  84           1HB      ALA  84   5.578  -2.871 -12.016
  652    HB2  ALA  84           HB2      ALA  84   6.180  -3.370 -10.422
  653    HB3  ALA  84           HB3      ALA  84   5.920  -4.588 -11.688
  654    H    THR  85           H        THR  85   4.515  -3.018  -8.400
  655    HA   THR  85           HA       THR  85   3.179  -0.401  -8.909
  656    HB   THR  85           HB       THR  85   2.861  -0.243  -6.477
  657    HG1  THR  85           1HG      THR  85   3.046  -2.157  -5.272
  658   HG21  THR  85          1HG2      THR  85   0.934  -1.789  -6.352
  659   HG22  THR  85          HG22      THR  85   1.022  -1.037  -7.960
  660   HG23  THR  85          HG32      THR  85   1.576  -2.716  -7.729
  661    H    LYS  86           H        LYS  86   4.058   1.362  -7.558
  662    HA   LYS  86           HA       LYS  86   6.792   1.716  -8.206
  663    HB2  LYS  86           HB2      LYS  86   4.892   3.247  -6.382
  664    HB3  LYS  86           HB3      LYS  86   6.489   3.837  -6.875
  665    HG2  LYS  86           HG2      LYS  86   5.782   3.516  -9.283
  666    HG3  LYS  86           HG3      LYS  86   4.158   3.103  -8.702
  667    HD2  LYS  86           2HD      LYS  86   4.058   5.367  -7.583
  668    HD3  LYS  86           3HD      LYS  86   5.611   5.748  -8.373
  669    HE2  LYS  86           HE2      LYS  86   4.548   5.152 -10.580
  670    HE3  LYS  86           HE3      LYS  86   3.002   4.970  -9.739
  671    HZ1  LYS  86           3HZ      LYS  86   4.597   7.449  -9.804
  672    HZ2  LYS  86           1HZ      LYS  86   3.293   7.165 -10.744
  673    HZ3  LYS  86           2HZ      LYS  86   3.112   7.263  -9.110
  674    HA   PRO  87           HA       PRO  87   9.002  -0.038  -4.916
  675    HB2  PRO  87           HB2      PRO  87  11.185   1.602  -4.639
  676    HB3  PRO  87           HB3      PRO  87  10.914   0.582  -6.079
  677    HG2  PRO  87           HG2      PRO  87  10.182   3.504  -5.745
  678    HG3  PRO  87           HG3      PRO  87  11.111   2.735  -7.081
  679    HD2  PRO  87           2HD      PRO  87   8.463   3.205  -7.327
  680    HD3  PRO  87           3HD      PRO  87   9.164   1.673  -7.930
  681    H    SER  88           H        SER  88   9.525   0.130  -2.688
  682    HA   SER  88           HA       SER  88   7.621   1.823  -1.304
  683    HB2  SER  88           HB2      SER  88   9.535  -0.344  -0.347
  684    HB3  SER  88           HB3      SER  88   8.317   0.454   0.672
  685    HG   SER  88           HG       SER  88   7.842  -1.027  -1.702
  686    H    PHE  89           H        PHE  89  10.737   2.486  -2.290
  687    HA   PHE  89           HA       PHE  89  11.237   4.166   0.104
  688    HB2  PHE  89           HB2      PHE  89  13.456   4.548  -0.767
  689    HB3  PHE  89           HB3      PHE  89  13.118   2.844  -0.454
  690    HD1  PHE  89           HD2      PHE  89  12.917   1.235  -2.304
  691    HD2  PHE  89           HD1      PHE  89  13.871   5.366  -3.016
  692    HE1  PHE  89           HE2      PHE  89  13.778   0.649  -4.541
  693    HE2  PHE  89           HE1      PHE  89  14.721   4.778  -5.279
  694    HZ   PHE  89           HZ       PHE  89  14.663   2.418  -6.043
  695    H    GLU  90           H        GLU  90   9.208   4.526  -2.174
  696    HA   GLU  90           HA       GLU  90   9.866   7.384  -2.638
  697    HB2  GLU  90           HB2      GLU  90  10.282   5.709  -4.636
  698    HB3  GLU  90           HB3      GLU  90   8.511   5.754  -4.779
  699    HG2  GLU  90           HG2      GLU  90   8.698   8.293  -4.837
  700    HG3  GLU  90           HG3      GLU  90  10.460   8.095  -4.856
  701    H    SER  91           H        SER  91   7.870   8.600  -3.358
  702    HA   SER  91           HA       SER  91   5.538   7.598  -1.805
  703    HB2  SER  91           HB2      SER  91   6.929   9.467  -0.809
  704    HB3  SER  91           HB3      SER  91   6.380  10.493  -2.151
  705    HG   SER  91           HG       SER  91   5.046  10.683  -0.295
  706    H    GLY  92           H        GLY  92   6.326   7.589  -4.834
  707    HA2  GLY  92           2HA      GLY  92   5.022   7.534  -6.729
  708    HA3  GLY  92           3HA      GLY  92   3.631   8.107  -5.787
  709    H    ARG  93           H        ARG  93   6.507  10.009  -5.491
  710    HA   ARG  93           HA       ARG  93   5.217  12.326  -6.595
  711    HB2  ARG  93           HB2      ARG  93   7.318  13.463  -6.050
  712    HB3  ARG  93           HB3      ARG  93   6.773  12.447  -4.702
  713    HG2  ARG  93           HG2      ARG  93   8.380  10.699  -5.316
  714    HG3  ARG  93           HG3      ARG  93   8.871  11.617  -6.758
  715    HD2  ARG  93           2HD      ARG  93   9.699  13.439  -5.363
  716    HD3  ARG  93           3HD      ARG  93   9.133  12.617  -3.898
  717    HE   ARG  93           HE       ARG  93  11.433  11.842  -5.625
  718   HH11  ARG  93          1HH1      ARG  93   9.513  11.262  -2.706
  719   HH12  ARG  93          2HH1      ARG  93  10.713  10.213  -1.990
  720   HH21  ARG  93          1HH2      ARG  93  12.980  10.476  -4.654
  721   HH22  ARG  93          2HH2      ARG  93  12.661   9.769  -3.090
  722    H    ARG  94           H        ARG  94   6.626   9.776  -8.231
  723    HA   ARG  94           HA       ARG  94   7.113  11.482 -10.605
  724    HB2  ARG  94           HB2      ARG  94   9.282  11.007  -9.468
  725    HB3  ARG  94           HB3      ARG  94   8.966   9.271  -9.628
  726    HG2  ARG  94           HG2      ARG  94   8.974   9.476 -12.085
  727    HG3  ARG  94           HG3      ARG  94   9.184  11.236 -11.954
  728    HD2  ARG  94           2HD      ARG  94  11.342  10.877 -10.788
  729    HD3  ARG  94           3HD      ARG  94  11.124   9.127 -10.918
  730    HE   ARG  94           HE       ARG  94  11.644   9.205 -13.194
  731   HH11  ARG  94          1HH1      ARG  94  11.377  12.489 -11.896
  732   HH12  ARG  94          2HH1      ARG  94  12.096  13.227 -13.307
  733   HH21  ARG  94          1HH2      ARG  94  12.585  10.202 -15.019
  734   HH22  ARG  94          2HH2      ARG  94  12.777  11.938 -15.065
  735    H    GLY  95           H        GLY  95   6.835  10.353 -12.619
  736    HA2  GLY  95           2HA      GLY  95   5.973   8.737 -14.028
  737    HA3  GLY  95           3HA      GLY  95   5.857   7.609 -12.662
  738    H5'    A  96           H5'        A  96   1.027   1.779   0.441
  739   H5''    A  96          H5''        A  96  -0.639   2.091   0.926
  740    H4'    A  96           H4'        A  96   1.539   4.248   0.897
  741    H3'    A  96           H3'        A  96   1.069   2.022   2.756
  742    H2'    A  96           H2'        A  96   0.323   3.201   4.654
  743   HO2'    A  96          HO2'        A  96   2.044   4.784   4.506
  744    H1'    A  96           H1'        A  96  -1.205   5.109   3.535
  745    H8     A  96           H8         A  96  -2.551   3.279   1.031
  746    H61    A  96           H61        A  96  -4.878  -1.056   4.801
  747    H62    A  96           H62        A  96  -4.944  -0.380   3.183
  748    H2     A  96           H2         A  96  -1.822   1.215   7.059
  749   HO5'    A  96          H5T         A  96  -0.682   3.730  -0.722
  750    H5'    U  97           H5'        U  97   2.903   0.782   3.990
  751   H5''    U  97          H5''        U  97   4.466   0.169   3.452
  752    H4'    U  97           H4'        U  97   3.517  -1.611   2.237
  753    H3'    U  97           H3'        U  97   1.291  -0.075   1.717
  754    H2'    U  97           H2'        U  97  -0.013  -0.230   3.603
  755   HO2'    U  97          HO2'        U  97  -0.986  -1.877   2.269
  756    H1'    U  97           H1'        U  97   0.938  -2.644   4.877
  757    H3     U  97           H3         U  97   1.527  -0.869   8.973
  758    H5     U  97           H5         U  97   1.113   2.487   6.491
  759    H6     U  97           H6         U  97   1.118   0.991   4.566
  760    H5'    C  98           H5'        C  98   4.087  -4.102  -0.962
  761   H5''    C  98          H5''        C  98   3.156  -4.492   0.488
  762    H4'    C  98           H4'        C  98   5.936  -3.242   0.552
  763    H3'    C  98           H3'        C  98   5.643  -5.722  -0.421
  764    H2'    C  98           H2'        C  98   3.989  -6.394   1.191
  765   HO2'    C  98          HO2'        C  98   5.990  -7.824   1.201
  766    H1'    C  98           H1'        C  98   5.694  -5.447   3.474
  767    H41    C  98           H41        C  98   0.080  -6.784   6.153
  768    H42    C  98           H42        C  98  -0.752  -5.674   5.081
  769    H5     C  98           H5         C  98   0.405  -4.438   3.302
  770    H6     C  98           H6         C  98   2.574  -4.061   2.252
  771    H5'    A  99           H5'        A  99   9.609  -7.455  -1.969
  772   H5''    A  99          H5''        A  99  10.633  -6.274  -1.136
  773    H4'    A  99           H4'        A  99  10.957  -5.909  -3.471
  774    H3'    A  99           H3'        A  99   9.888  -3.857  -1.828
  775    H2'    A  99           H2'        A  99   7.777  -3.870  -2.952
  776   HO2'    A  99          HO2'        A  99   9.249  -1.913  -3.655
  777    H1'    A  99           H1'        A  99   9.352  -4.555  -5.440
  778    H8     A  99           H8         A  99   7.555  -3.557  -6.966
  779    H61    A  99           H61        A  99   2.103  -6.472  -6.328
  780    H62    A  99           H62        A  99   3.000  -5.323  -7.304
  781    H2     A  99           H2         A  99   4.756  -7.737  -3.008
  782    H5'    A 100           H5'        A 100  13.755  -3.527  -3.700
  783   H5''    A 100          H5''        A 100  14.699  -2.055  -3.515
  784    H4'    A 100           H4'        A 100  15.230  -3.443  -5.586
  785    H3'    A 100           H3'        A 100  15.270  -0.732  -5.170
  786    H2'    A 100           H2'        A 100  13.111  -0.334  -6.107
  787   HO2'    A 100          HO2'        A 100  14.949  -0.180  -8.284
  788    H1'    A 100           H1'        A 100  13.793  -2.262  -8.323
  789    H8     A 100           H8         A 100  10.826  -2.072  -5.857
  790    H61    A 100           H61        A 100   7.506  -0.235 -10.799
  791    H62    A 100           H62        A 100   7.403  -0.712  -9.115
  792    H2     A 100           H2         A 100  11.752  -0.531 -12.004
  793    H5'    A 101           H5'        A 101  16.686   0.965  -7.128
  794   H5''    A 101          H5''        A 101  18.269   0.546  -7.807
  795    H4'    A 101           H4'        A 101  18.125   2.916  -7.301
  796    H3'    A 101           H3'        A 101  20.265   1.326  -6.699
  797   HO3'    A 101          H3T         A 101  21.295   3.368  -6.129
  798    H2'    A 101           H2'        A 101  19.692   0.816  -4.494
  799   HO2'    A 101          HO2'        A 101  20.928   2.166  -3.106
  800    H1'    A 101           H1'        A 101  18.800   3.632  -3.908
  801    H8     A 101           H8         A 101  18.279  -0.155  -3.456
  802    H61    A 101           H61        A 101  15.179   1.424   1.696
  803    H62    A 101           H62        A 101  15.789   0.076   0.755
  804    H2     A 101           H2         A 101  16.196   5.134  -0.501
  Start of MODEL    7
    1    H1   MET   1           H1       MET   1  -0.692   1.548  -1.011
    2    H2   MET   1           H2       MET   1   0.917   1.596  -0.695
    3    H3   MET   1           H3       MET   1   0.214   0.175  -1.135
    4    HA   MET   1           HA       MET   1   0.458   2.549  -2.852
    5    HB2  MET   1           HB2      MET   1   1.970  -0.069  -2.792
    6    HB3  MET   1           HB3      MET   1   1.930   0.978  -4.217
    7    HG2  MET   1           HG2      MET   1   2.792   2.007  -1.492
    8    HG3  MET   1           HG3      MET   1   3.901   1.208  -2.596
    9    HE1  MET   1           HE1      MET   1   1.778   4.346  -1.840
   10    HE2  MET   1           HE2      MET   1   2.123   5.432  -3.207
   11    HE3  MET   1           HE3      MET   1   1.035   4.059  -3.438
   12    H    VAL   2           H        VAL   2  -1.719   2.583  -3.388
   13    HA   VAL   2           HA       VAL   2  -2.886   0.305  -4.768
   14    HB   VAL   2           HB       VAL   2  -4.286   1.917  -3.525
   15   HG11  VAL   2          1HG1      VAL   2  -3.268   3.976  -5.533
   16   HG12  VAL   2          HG21      VAL   2  -4.540   4.250  -4.323
   17   HG13  VAL   2          HG31      VAL   2  -2.874   3.931  -3.801
   18   HG21  VAL   2          HG32      VAL   2  -5.207   0.860  -5.643
   19   HG22  VAL   2          1HG2      VAL   2  -5.974   2.401  -5.170
   20   HG23  VAL   2          HG22      VAL   2  -4.786   2.380  -6.485
   21    H    GLU   3           H        GLU   3  -0.359   2.024  -5.444
   22    HA   GLU   3           HA       GLU   3  -0.951   3.227  -7.994
   23    HB2  GLU   3           HB2      GLU   3   1.654   2.668  -6.510
   24    HB3  GLU   3           HB3      GLU   3   1.519   3.712  -7.933
   25    HG2  GLU   3           HG2      GLU   3  -0.048   4.139  -5.355
   26    HG3  GLU   3           HG3      GLU   3   1.506   4.913  -5.699
   27    H    ALA   4           H        ALA   4  -0.268   2.643 -10.023
   28    HA   ALA   4           HA       ALA   4   1.011  -0.004 -10.385
   29    HB1  ALA   4           1HB      ALA   4  -1.621   0.867 -11.648
   30    HB2  ALA   4           HB2      ALA   4  -0.710  -0.611 -12.056
   31    HB3  ALA   4           HB3      ALA   4  -1.405  -0.406 -10.427
   32    H    ASP   5           H        ASP   5   2.856   0.854 -11.199
   33    HA   ASP   5           HA       ASP   5   2.794   3.245 -12.864
   34    HB2  ASP   5           HB2      ASP   5   4.410   2.965 -11.093
   35    HB3  ASP   5           HB3      ASP   5   5.028   1.484 -11.817
   36    H    ARG   6           H        ARG   6   2.677   3.310 -14.948
   37    HA   ARG   6           HA       ARG   6   2.679   2.823 -17.137
   38    HB2  ARG   6           HB2      ARG   6   5.048   3.250 -16.686
   39    HB3  ARG   6           HB3      ARG   6   5.312   1.539 -16.346
   40    HG2  ARG   6           HG2      ARG   6   6.066   2.112 -18.613
   41    HG3  ARG   6           HG3      ARG   6   4.732   0.954 -18.670
   42    HD2  ARG   6           2HD      ARG   6   4.464   2.696 -20.371
   43    HD3  ARG   6           3HD      ARG   6   3.149   2.762 -19.189
   44    HE   ARG   6           HE       ARG   6   5.247   4.530 -18.370
   45   HH11  ARG   6          1HH1      ARG   6   2.737   4.236 -20.838
   46   HH12  ARG   6          2HH1      ARG   6   2.592   5.966 -21.062
   47   HH21  ARG   6          1HH2      ARG   6   5.035   6.774 -18.679
   48   HH22  ARG   6          2HH2      ARG   6   3.886   7.394 -19.836
   49    HA   PRO   7           HA       PRO   7   0.697  -1.265 -17.409
   50    HB2  PRO   7           HB2      PRO   7   0.359   0.068 -20.104
   51    HB3  PRO   7           HB3      PRO   7  -0.822  -0.990 -19.249
   52    HG2  PRO   7           HG2      PRO   7  -1.122   1.647 -19.238
   53    HG3  PRO   7           HG3      PRO   7  -1.269   0.766 -17.671
   54    HD2  PRO   7           2HD      PRO   7   1.100   2.329 -18.738
   55    HD3  PRO   7           3HD      PRO   7   0.436   2.304 -17.069
   56    H    GLY   8           H        GLY   8   1.698  -3.146 -18.194
   57    HA2  GLY   8           2HA      GLY   8   2.907  -4.338 -19.870
   58    HA3  GLY   8           3HA      GLY   8   3.709  -2.824 -20.358
   59    H    LYS   9           H        LYS   9   3.784  -2.351 -17.147
   60    HA   LYS   9           HA       LYS   9   6.433  -3.626 -16.974
   61    HB2  LYS   9           HB2      LYS   9   6.262  -1.242 -16.356
   62    HB3  LYS   9           HB3      LYS   9   5.125  -1.682 -15.050
   63    HG2  LYS   9           HG2      LYS   9   6.842  -3.235 -14.119
   64    HG3  LYS   9           HG3      LYS   9   7.973  -2.737 -15.387
   65    HD2  LYS   9           2HD      LYS   9   6.741  -0.846 -13.352
   66    HD3  LYS   9           3HD      LYS   9   8.328  -1.642 -13.179
   67    HE2  LYS   9           HE2      LYS   9   9.109  -0.576 -15.252
   68    HE3  LYS   9           HE3      LYS   9   7.530   0.195 -15.480
   69    HZ1  LYS   9           3HZ      LYS   9   9.280   0.658 -13.156
   70    HZ2  LYS   9           1HZ      LYS   9   9.193   1.642 -14.472
   71    HZ3  LYS   9           2HZ      LYS   9   7.882   1.456 -13.513
   72    H    LEU  10           H        LEU  10   6.765  -5.434 -15.844
   73    HA   LEU  10           HA       LEU  10   4.463  -6.482 -14.247
   74    HB2  LEU  10           HB2      LEU  10   6.590  -7.846 -15.904
   75    HB3  LEU  10           HB3      LEU  10   5.521  -8.742 -14.873
   76    HG   LEU  10           HG       LEU  10   4.671  -7.025 -17.251
   77   HD11  LEU  10          1HD1      LEU  10   4.478 -10.033 -16.744
   78   HD12  LEU  10          2HD1      LEU  10   4.219  -9.188 -18.284
   79   HD13  LEU  10          3HD1      LEU  10   5.858  -9.296 -17.567
   80   HD21  LEU  10          3HD2      LEU  10   2.441  -8.118 -16.889
   81   HD22  LEU  10          1HD2      LEU  10   3.027  -8.692 -15.314
   82   HD23  LEU  10          2HD2      LEU  10   2.884  -6.939 -15.634
   83    H    PHE  11           H        PHE  11   4.889  -7.599 -12.362
   84    HA   PHE  11           HA       PHE  11   7.576  -7.205 -11.137
   85    HB2  PHE  11           HB2      PHE  11   5.847  -6.182  -9.816
   86    HB3  PHE  11           HB3      PHE  11   4.784  -7.581 -10.013
   87    HD1  PHE  11           HD1      PHE  11   8.080  -6.581  -8.545
   88    HD2  PHE  11           HD2      PHE  11   4.774  -9.333  -8.456
   89    HE1  PHE  11           HE1      PHE  11   8.965  -7.588  -6.458
   90    HE2  PHE  11           HE2      PHE  11   5.682 -10.353  -6.381
   91    HZ   PHE  11           HZ       PHE  11   7.783  -9.470  -5.386
   92    H    ILE  12           H        ILE  12   8.786  -8.983 -10.818
   93    HA   ILE  12           HA       ILE  12   7.500 -11.619 -11.362
   94    HB   ILE  12           HB       ILE  12  10.391 -10.973 -11.938
   95   HG12  ILE  12          HG21      ILE  12   9.244  -9.325 -13.286
   96   HG13  ILE  12          HG31      ILE  12   9.903 -10.615 -14.281
   97   HG21  ILE  12          1HG2      ILE  12  10.103 -12.882 -13.481
   98   HG22  ILE  12          HG22      ILE  12   9.652 -13.311 -11.808
   99   HG23  ILE  12          HG32      ILE  12   8.390 -12.997 -13.009
  100   HD11  ILE  12          3HD1      ILE  12   6.981 -10.195 -13.550
  101   HD12  ILE  12          1HD1      ILE  12   7.761 -10.029 -15.141
  102   HD13  ILE  12          2HD1      ILE  12   7.599 -11.633 -14.402
  103    H    GLY  13           H        GLY  13   7.134 -11.755  -8.984
  104    HA2  GLY  13           2HA      GLY  13   9.603 -11.736  -7.334
  105    HA3  GLY  13           3HA      GLY  13   7.952 -11.743  -6.737
  106    H    GLY  14           H        GLY  14  10.406 -13.511  -6.214
  107    HA2  GLY  14           2HA      GLY  14  10.140 -15.620  -5.147
  108    HA3  GLY  14           3HA      GLY  14   8.864 -16.056  -6.305
  109    H    LEU  15           H        LEU  15  11.522 -14.477  -7.769
  110    HA   LEU  15           HA       LEU  15  12.152 -16.707  -9.431
  111    HB2  LEU  15           HB2      LEU  15  13.645 -14.121  -8.841
  112    HB3  LEU  15           HB3      LEU  15  14.010 -15.264 -10.164
  113    HG   LEU  15           HG       LEU  15  11.289 -13.960  -9.969
  114   HD11  LEU  15          1HD1      LEU  15  12.169 -12.347 -11.658
  115   HD12  LEU  15          2HD1      LEU  15  12.982 -12.157 -10.089
  116   HD13  LEU  15          3HD1      LEU  15  13.803 -13.002 -11.419
  117   HD21  LEU  15          3HD2      LEU  15  12.973 -15.126 -12.234
  118   HD22  LEU  15          1HD2      LEU  15  11.698 -16.011 -11.375
  119   HD23  LEU  15          2HD2      LEU  15  11.284 -14.588 -12.364
  120    H    ASN  16           H        ASN  16  14.303 -17.645  -9.758
  121    HA   ASN  16           HA       ASN  16  15.423 -18.707  -7.353
  122    HB2  ASN  16           HB2      ASN  16  15.104 -19.841  -9.544
  123    HB3  ASN  16           HB3      ASN  16  16.405 -18.828 -10.209
  124   HD21  ASN  16          2HD2      ASN  16  17.148 -21.088 -10.677
  125   HD22  ASN  16          1HD2      ASN  16  18.112 -21.875  -9.477
  126    H    THR  17           H        THR  17  17.762 -18.533  -6.812
  127    HA   THR  17           HA       THR  17  18.734 -15.797  -6.881
  128    HB   THR  17           HB       THR  17  20.618 -16.726  -5.591
  129    HG1  THR  17           1HG      THR  17  20.806 -18.738  -6.623
  130   HG21  THR  17          1HG2      THR  17  19.355 -17.584  -3.688
  131   HG22  THR  17          HG22      THR  17  18.428 -16.271  -4.461
  132   HG23  THR  17          HG32      THR  17  17.977 -17.977  -4.743
  133    H    GLU  18           H        GLU  18  18.678 -18.163  -9.164
  134    HA   GLU  18           HA       GLU  18  21.440 -17.768 -10.163
  135    HB2  GLU  18           HB2      GLU  18  19.376 -19.809 -11.034
  136    HB3  GLU  18           HB3      GLU  18  21.133 -19.884 -11.247
  137    HG2  GLU  18           HG2      GLU  18  19.630 -20.005  -8.588
  138    HG3  GLU  18           HG3      GLU  18  20.264 -21.394  -9.428
  139    H    THR  19           H        THR  19  18.297 -16.624 -10.623
  140    HA   THR  19           HA       THR  19  18.298 -16.563 -13.543
  141    HB   THR  19           HB       THR  19  16.499 -15.142 -11.543
  142    HG1  THR  19           1HG      THR  19  16.205 -17.639 -12.848
  143   HG21  THR  19          1HG2      THR  19  14.871 -15.197 -13.428
  144   HG22  THR  19          HG22      THR  19  16.304 -14.229 -13.811
  145   HG23  THR  19          HG32      THR  19  16.131 -15.879 -14.477
  146    H    ASN  20           H        ASN  20  18.685 -14.817 -14.862
  147    HA   ASN  20           HA       ASN  20  19.394 -12.243 -13.564
  148    HB2  ASN  20           HB2      ASN  20  20.908 -12.955 -16.004
  149    HB3  ASN  20           HB3      ASN  20  21.397 -11.985 -14.622
  150   HD21  ASN  20          2HD2      ASN  20  21.152 -15.169 -16.041
  151   HD22  ASN  20          1HD2      ASN  20  22.131 -16.013 -14.859
  152    H    GLU  21           H        GLU  21  19.972 -10.844 -15.822
  153    HA   GLU  21           HA       GLU  21  17.310 -10.170 -16.685
  154    HB2  GLU  21           HB2      GLU  21  20.077  -9.265 -17.541
  155    HB3  GLU  21           HB3      GLU  21  18.570  -8.537 -18.145
  156    HG2  GLU  21           HG2      GLU  21  17.906  -7.872 -15.926
  157    HG3  GLU  21           HG3      GLU  21  19.197  -8.823 -15.195
  158    H    LYS  22           H        LYS  22  20.007 -11.994 -18.185
  159    HA   LYS  22           HA       LYS  22  18.898 -11.951 -20.822
  160    HB2  LYS  22           HB2      LYS  22  21.251 -12.418 -20.358
  161    HB3  LYS  22           HB3      LYS  22  20.826 -13.878 -19.450
  162    HG2  LYS  22           HG2      LYS  22  21.636 -14.327 -21.778
  163    HG3  LYS  22           HG3      LYS  22  20.029 -14.986 -21.433
  164    HD2  LYS  22           2HD      LYS  22  18.962 -13.113 -22.624
  165    HD3  LYS  22           3HD      LYS  22  20.531 -12.315 -22.821
  166    HE2  LYS  22           HE2      LYS  22  19.909 -13.429 -24.902
  167    HE3  LYS  22           HE3      LYS  22  21.320 -14.227 -24.192
  168    HZ1  LYS  22           3HZ      LYS  22  19.671 -15.805 -24.961
  169    HZ2  LYS  22           1HZ      LYS  22  19.838 -15.919 -23.332
  170    HZ3  LYS  22           2HZ      LYS  22  18.529 -15.159 -23.977
  171    H    ALA  23           H        ALA  23  18.225 -13.923 -17.987
  172    HA   ALA  23           HA       ALA  23  16.853 -15.981 -19.598
  173    HB1  ALA  23           1HB      ALA  23  17.143 -15.594 -16.584
  174    HB2  ALA  23           HB2      ALA  23  16.436 -17.018 -17.379
  175    HB3  ALA  23           HB3      ALA  23  18.157 -16.642 -17.601
  176    H    LEU  24           H        LEU  24  16.262 -12.985 -18.040
  177    HA   LEU  24           HA       LEU  24  13.409 -13.406 -17.543
  178    HB2  LEU  24           HB2      LEU  24  15.678 -11.663 -16.784
  179    HB3  LEU  24           HB3      LEU  24  14.251 -10.705 -17.057
  180    HG   LEU  24           HG       LEU  24  14.261 -13.241 -15.390
  181   HD11  LEU  24          1HD1      LEU  24  14.448 -11.816 -13.375
  182   HD12  LEU  24          2HD1      LEU  24  15.896 -11.680 -14.394
  183   HD13  LEU  24          3HD1      LEU  24  14.677 -10.383 -14.408
  184   HD21  LEU  24          3HD2      LEU  24  12.229 -12.262 -14.393
  185   HD22  LEU  24          1HD2      LEU  24  12.446 -10.782 -15.353
  186   HD23  LEU  24          2HD2      LEU  24  12.079 -12.310 -16.175
  187    H    GLU  25           H        GLU  25  15.603 -11.854 -19.824
  188    HA   GLU  25           HA       GLU  25  13.429 -10.552 -21.264
  189    HB2  GLU  25           HB2      GLU  25  16.345 -11.158 -21.989
  190    HB3  GLU  25           HB3      GLU  25  15.227 -10.287 -23.061
  191    HG2  GLU  25           HG2      GLU  25  14.791  -8.667 -21.280
  192    HG3  GLU  25           HG3      GLU  25  16.027  -9.435 -20.262
  193    H    ALA  26           H        ALA  26  15.097 -13.590 -21.234
  194    HA   ALA  26           HA       ALA  26  14.341 -14.435 -23.913
  195    HB1  ALA  26           1HB      ALA  26  15.509 -15.879 -21.514
  196    HB2  ALA  26           HB2      ALA  26  15.376 -16.571 -23.153
  197    HB3  ALA  26           HB3      ALA  26  16.418 -15.153 -22.871
  198    H    VAL  27           H        VAL  27  12.936 -14.581 -20.703
  199    HA   VAL  27           HA       VAL  27  11.187 -16.836 -21.461
  200    HB   VAL  27           HB       VAL  27  12.612 -16.703 -19.429
  201   HG11  VAL  27          1HG1      VAL  27  10.434 -14.913 -18.362
  202   HG12  VAL  27          HG21      VAL  27  11.902 -15.467 -17.510
  203   HG13  VAL  27          HG31      VAL  27  12.050 -14.335 -18.880
  204   HG21  VAL  27          HG32      VAL  27  10.721 -18.290 -19.621
  205   HG22  VAL  27          1HG2      VAL  27  10.898 -17.687 -17.948
  206   HG23  VAL  27          HG22      VAL  27   9.609 -17.028 -18.992
  207    H    PHE  28           H        PHE  28  11.072 -13.425 -20.478
  208    HA   PHE  28           HA       PHE  28   8.122 -13.462 -20.759
  209    HB2  PHE  28           HB2      PHE  28  10.017 -11.303 -19.817
  210    HB3  PHE  28           HB3      PHE  28   8.273 -11.091 -20.043
  211    HD1  PHE  28           HD1      PHE  28   6.648 -12.491 -18.721
  212    HD2  PHE  28           HD2      PHE  28  10.852 -12.370 -17.852
  213    HE1  PHE  28           HE1      PHE  28   6.210 -13.462 -16.486
  214    HE2  PHE  28           HE2      PHE  28  10.433 -13.370 -15.633
  215    HZ   PHE  28           HZ       PHE  28   8.100 -13.893 -14.927
  216    H    GLY  29           H        GLY  29  10.851 -12.959 -22.730
  217    HA2  GLY  29           2HA      GLY  29   9.621 -11.012 -24.524
  218    HA3  GLY  29           3HA      GLY  29  11.059 -11.999 -24.852
  219    H    LYS  30           H        LYS  30   8.882 -14.155 -23.742
  220    HA   LYS  30           HA       LYS  30   8.276 -15.218 -26.374
  221    HB2  LYS  30           HB2      LYS  30   7.523 -16.122 -23.548
  222    HB3  LYS  30           HB3      LYS  30   7.430 -17.112 -25.021
  223    HG2  LYS  30           HG2      LYS  30   9.854 -16.955 -25.311
  224    HG3  LYS  30           HG3      LYS  30  10.001 -15.872 -23.924
  225    HD2  LYS  30           2HD      LYS  30  10.664 -18.188 -23.346
  226    HD3  LYS  30           3HD      LYS  30   9.341 -17.568 -22.359
  227    HE2  LYS  30           HE2      LYS  30   8.869 -19.852 -22.960
  228    HE3  LYS  30           HE3      LYS  30   7.707 -18.783 -23.751
  229    HZ1  LYS  30           3HZ      LYS  30   8.563 -20.470 -25.244
  230    HZ2  LYS  30           1HZ      LYS  30   9.008 -18.976 -25.773
  231    HZ3  LYS  30           2HZ      LYS  30  10.103 -19.942 -25.029
  232    H    TYR  31           H        TYR  31   6.808 -13.077 -24.229
  233    HA   TYR  31           HA       TYR  31   4.067 -13.690 -25.247
  234    HB2  TYR  31           HB2      TYR  31   5.002 -12.216 -22.776
  235    HB3  TYR  31           HB3      TYR  31   3.318 -12.502 -23.222
  236    HD1  TYR  31           HD2      TYR  31   2.624 -15.015 -23.454
  237    HD2  TYR  31           HD1      TYR  31   6.226 -13.707 -21.503
  238    HE1  TYR  31           HE2      TYR  31   2.824 -17.226 -22.356
  239    HE2  TYR  31           HE1      TYR  31   6.422 -15.915 -20.367
  240    HH   TYR  31           HH       TYR  31   5.577 -18.073 -20.238
  241    H    GLY  32           H        GLY  32   6.628 -11.287 -25.315
  242    HA2  GLY  32           2HA      GLY  32   5.276  -9.692 -27.250
  243    HA3  GLY  32           3HA      GLY  32   5.132  -8.926 -25.646
  244    H    ARG  33           H        ARG  33   6.408  -7.710 -27.816
  245    HA   ARG  33           HA       ARG  33   9.223  -8.033 -27.658
  246    HB2  ARG  33           HB2      ARG  33   7.755  -6.905 -29.458
  247    HB3  ARG  33           HB3      ARG  33   7.724  -5.483 -28.377
  248    HG2  ARG  33           HG2      ARG  33  10.214  -5.480 -28.375
  249    HG3  ARG  33           HG3      ARG  33  10.168  -6.919 -29.435
  250    HD2  ARG  33           2HD      ARG  33   9.000  -5.591 -31.166
  251    HD3  ARG  33           3HD      ARG  33   9.021  -4.173 -30.102
  252    HE   ARG  33           HE       ARG  33  11.691  -5.087 -30.410
  253   HH11  ARG  33          1HH1      ARG  33   9.115  -3.612 -32.331
  254   HH12  ARG  33          2HH1      ARG  33  10.226  -2.826 -33.432
  255   HH21  ARG  33          1HH2      ARG  33  13.115  -4.044 -31.862
  256   HH22  ARG  33          2HH2      ARG  33  12.479  -3.071 -33.166
  257    H    ILE  34           H        ILE  34  10.392  -7.711 -25.983
  258    HA   ILE  34           HA       ILE  34   9.590  -6.060 -23.726
  259    HB   ILE  34           HB       ILE  34  12.164  -7.512 -24.427
  260   HG12  ILE  34          HG21      ILE  34   9.765  -8.091 -22.642
  261   HG13  ILE  34          HG31      ILE  34  10.273  -8.982 -24.076
  262   HG21  ILE  34          1HG2      ILE  34  11.379  -6.189 -21.801
  263   HG22  ILE  34          HG22      ILE  34  12.869  -7.124 -22.123
  264   HG23  ILE  34          HG32      ILE  34  12.615  -5.581 -22.932
  265   HD11  ILE  34          3HD1      ILE  34  12.383  -9.627 -22.909
  266   HD12  ILE  34          1HD1      ILE  34  11.783  -8.832 -21.432
  267   HD13  ILE  34          2HD1      ILE  34  10.920 -10.230 -22.085
  268    H    VAL  35           H        VAL  35  10.267  -4.083 -23.120
  269    HA   VAL  35           HA       VAL  35  11.962  -2.581 -25.062
  270    HB   VAL  35           HB       VAL  35  10.450  -0.822 -23.363
  271   HG11  VAL  35          1HG1      VAL  35  10.302  -1.460 -26.336
  272   HG12  VAL  35          HG21      VAL  35   9.642  -0.006 -25.547
  273   HG13  VAL  35          HG31      VAL  35  11.398  -0.288 -25.567
  274   HG21  VAL  35          HG32      VAL  35   8.741  -2.864 -24.846
  275   HG22  VAL  35          1HG2      VAL  35   8.760  -2.553 -23.093
  276   HG23  VAL  35          HG22      VAL  35   8.164  -1.314 -24.211
  277    H    GLU  36           H        GLU  36  11.512  -3.664 -21.783
  278    HA   GLU  36           HA       GLU  36  14.211  -2.832 -21.109
  279    HB2  GLU  36           HB2      GLU  36  12.925  -0.751 -20.637
  280    HB3  GLU  36           HB3      GLU  36  11.835  -1.667 -19.579
  281    HG2  GLU  36           HG2      GLU  36  13.680  -2.190 -18.068
  282    HG3  GLU  36           HG3      GLU  36  14.836  -1.432 -19.183
  283    H    VAL  37           H        VAL  37  15.014  -4.053 -19.337
  284    HA   VAL  37           HA       VAL  37  13.035  -5.630 -17.812
  285    HB   VAL  37           HB       VAL  37  15.252  -6.768 -19.478
  286   HG11  VAL  37          1HG1      VAL  37  14.431  -7.959 -16.799
  287   HG12  VAL  37          HG21      VAL  37  15.413  -8.761 -18.039
  288   HG13  VAL  37          HG31      VAL  37  16.047  -7.327 -17.217
  289   HG21  VAL  37          HG32      VAL  37  12.571  -7.768 -18.401
  290   HG22  VAL  37          1HG2      VAL  37  12.846  -7.090 -20.022
  291   HG23  VAL  37          HG22      VAL  37  13.586  -8.645 -19.550
  292    H    LEU  38           H        LEU  38  13.504  -5.982 -15.734
  293    HA   LEU  38           HA       LEU  38  16.007  -4.751 -14.609
  294    HB2  LEU  38           HB2      LEU  38  13.134  -4.643 -13.958
  295    HB3  LEU  38           HB3      LEU  38  14.185  -4.771 -12.564
  296    HG   LEU  38           HG       LEU  38  14.470  -2.606 -14.699
  297   HD11  LEU  38          1HD1      LEU  38  13.338  -2.514 -11.869
  298   HD12  LEU  38          2HD1      LEU  38  13.597  -1.111 -12.928
  299   HD13  LEU  38          3HD1      LEU  38  12.405  -2.347 -13.379
  300   HD21  LEU  38          3HD2      LEU  38  16.604  -3.089 -13.562
  301   HD22  LEU  38          1HD2      LEU  38  15.936  -1.542 -12.999
  302   HD23  LEU  38          2HD2      LEU  38  15.779  -2.989 -11.982
  303    H    LEU  39           H        LEU  39  16.906  -5.839 -12.848
  304    HA   LEU  39           HA       LEU  39  15.647  -8.285 -11.927
  305    HB2  LEU  39           HB2      LEU  39  16.914  -9.039 -13.885
  306    HB3  LEU  39           HB3      LEU  39  18.363  -8.203 -13.325
  307    HG   LEU  39           HG       LEU  39  18.182 -10.740 -13.116
  308   HD11  LEU  39          1HD1      LEU  39  19.976  -9.355 -12.153
  309   HD12  LEU  39          2HD1      LEU  39  19.016  -9.162 -10.659
  310   HD13  LEU  39          3HD1      LEU  39  19.599 -10.764 -11.140
  311   HD21  LEU  39          3HD2      LEU  39  15.979 -10.822 -12.005
  312   HD22  LEU  39          1HD2      LEU  39  17.258 -11.649 -11.089
  313   HD23  LEU  39          2HD2      LEU  39  16.697 -10.047 -10.558
  314    H    MET  40           H        MET  40  15.838  -8.165  -9.722
  315    HA   MET  40           HA       MET  40  17.628  -6.012  -8.793
  316    HB2  MET  40           HB2      MET  40  15.560  -7.481  -7.145
  317    HB3  MET  40           HB3      MET  40  16.289  -5.911  -6.834
  318    HG2  MET  40           HG2      MET  40  14.033  -6.700  -8.594
  319    HG3  MET  40           HG3      MET  40  14.254  -5.241  -7.642
  320    HE1  MET  40           HE3      MET  40  17.033  -4.177  -8.727
  321    HE2  MET  40           HE1      MET  40  16.594  -3.176 -10.144
  322    HE3  MET  40           HE2      MET  40  15.674  -3.044  -8.620
  323    H    LYS  41           H        LYS  41  19.311  -6.269  -7.376
  324    HA   LYS  41           HA       LYS  41  19.623  -8.830  -6.016
  325    HB2  LYS  41           HB2      LYS  41  22.180  -8.651  -6.914
  326    HB3  LYS  41           HB3      LYS  41  20.941  -9.695  -7.615
  327    HG2  LYS  41           HG2      LYS  41  20.457  -8.140  -9.355
  328    HG3  LYS  41           HG3      LYS  41  21.514  -6.892  -8.632
  329    HD2  LYS  41           2HD      LYS  41  23.468  -8.372  -8.971
  330    HD3  LYS  41           3HD      LYS  41  22.410  -9.618  -9.670
  331    HE2  LYS  41           HE2      LYS  41  21.739  -8.029 -11.455
  332    HE3  LYS  41           HE3      LYS  41  22.810  -6.800 -10.759
  333    HZ1  LYS  41           3HZ      LYS  41  23.680  -9.405 -11.826
  334    HZ2  LYS  41           1HZ      LYS  41  23.858  -7.949 -12.569
  335    HZ3  LYS  41           2HZ      LYS  41  24.665  -8.263 -11.173
  336    H    ASP  42           H        ASP  42  21.166  -8.847  -4.367
  337    HA   ASP  42           HA       ASP  42  21.248  -6.466  -2.822
  338    HB2  ASP  42           HB2      ASP  42  21.283  -9.027  -2.225
  339    HB3  ASP  42           HB3      ASP  42  23.032  -8.851  -2.395
  340    H    ARG  43           H        ARG  43  23.248  -5.497  -1.872
  341    HA   ARG  43           HA       ARG  43  25.283  -5.087  -4.010
  342    HB2  ARG  43           HB2      ARG  43  25.794  -3.002  -2.876
  343    HB3  ARG  43           HB3      ARG  43  24.080  -3.082  -3.322
  344    HG2  ARG  43           HG2      ARG  43  23.422  -3.544  -1.048
  345    HG3  ARG  43           HG3      ARG  43  25.111  -3.820  -0.560
  346    HD2  ARG  43           2HD      ARG  43  24.372  -1.615   0.187
  347    HD3  ARG  43           3HD      ARG  43  25.676  -1.498  -1.001
  348    HE   ARG  43           HE       ARG  43  22.769  -0.995  -1.571
  349   HH11  ARG  43          1HH1      ARG  43  26.188  -0.421  -2.297
  350   HH12  ARG  43          2HH1      ARG  43  25.837   0.814  -3.484
  351   HH21  ARG  43          1HH2      ARG  43  22.359   0.624  -3.100
  352   HH22  ARG  43          2HH2      ARG  43  23.683   1.400  -3.939
  353    H    GLU  44           H        GLU  44  24.868  -6.777  -1.099
  354    HA   GLU  44           HA       GLU  44  27.778  -6.654  -0.471
  355    HB2  GLU  44           HB2      GLU  44  25.418  -7.710   1.127
  356    HB3  GLU  44           HB3      GLU  44  27.112  -7.742   1.650
  357    HG2  GLU  44           HG2      GLU  44  27.200  -5.255   1.463
  358    HG3  GLU  44           HG3      GLU  44  25.475  -5.246   1.060
  359    H    THR  45           H        THR  45  25.379  -8.606  -2.002
  360    HA   THR  45           HA       THR  45  27.321 -10.875  -2.061
  361    HB   THR  45           HB       THR  45  25.481 -12.464  -1.967
  362    HG1  THR  45           1HG      THR  45  23.370 -11.632  -1.543
  363   HG21  THR  45          1HG2      THR  45  26.457 -11.609   0.164
  364   HG22  THR  45          HG22      THR  45  25.119 -10.421   0.240
  365   HG23  THR  45          HG32      THR  45  24.766 -12.170   0.314
  366    H    ASN  46           H        ASN  46  25.317  -8.646  -3.784
  367    HA   ASN  46           HA       ASN  46  24.757  -8.481  -5.974
  368    HB2  ASN  46           HB2      ASN  46  27.158 -10.307  -6.196
  369    HB3  ASN  46           HB3      ASN  46  26.367  -9.544  -7.601
  370   HD21  ASN  46          2HD2      ASN  46  26.168  -7.107  -7.505
  371   HD22  ASN  46          1HD2      ASN  46  27.492  -6.222  -6.774
  372    H    LYS  47           H        LYS  47  23.844 -10.929  -4.219
  373    HA   LYS  47           HA       LYS  47  22.923 -12.782  -6.301
  374    HB2  LYS  47           HB2      LYS  47  22.518 -12.558  -3.294
  375    HB3  LYS  47           HB3      LYS  47  21.687 -13.773  -4.270
  376    HG2  LYS  47           HG2      LYS  47  24.681 -13.434  -4.414
  377    HG3  LYS  47           HG3      LYS  47  23.936 -14.427  -3.132
  378    HD2  LYS  47           2HD      LYS  47  22.853 -15.830  -4.852
  379    HD3  LYS  47           3HD      LYS  47  23.611 -14.863  -6.138
  380    HE2  LYS  47           HE2      LYS  47  25.129 -16.351  -3.961
  381    HE3  LYS  47           HE3      LYS  47  24.839 -16.987  -5.590
  382    HZ1  LYS  47           3HZ      LYS  47  26.985 -15.953  -5.423
  383    HZ2  LYS  47           1HZ      LYS  47  26.040 -15.104  -6.469
  384    HZ3  LYS  47           2HZ      LYS  47  26.328 -14.522  -4.959
  385    H    SER  48           H        SER  48  20.853 -13.043  -6.948
  386    HA   SER  48           HA       SER  48  19.234 -10.795  -7.309
  387    HB2  SER  48           HB2      SER  48  18.326 -13.700  -7.202
  388    HB3  SER  48           HB3      SER  48  17.504 -12.352  -8.022
  389    HG   SER  48           HG       SER  48  18.819 -13.554  -9.460
  390    H    ARG  49           H        ARG  49  17.565  -9.845  -6.239
  391    HA   ARG  49           HA       ARG  49  17.280 -10.321  -3.395
  392    HB2  ARG  49           HB2      ARG  49  15.716  -8.575  -5.325
  393    HB3  ARG  49           HB3      ARG  49  15.599  -8.484  -3.557
  394    HG2  ARG  49           HG2      ARG  49  18.373  -8.263  -4.496
  395    HG3  ARG  49           HG3      ARG  49  17.332  -7.055  -5.261
  396    HD2  ARG  49           2HD      ARG  49  17.530  -7.483  -2.262
  397    HD3  ARG  49           3HD      ARG  49  18.440  -6.277  -3.198
  398    HE   ARG  49           HE       ARG  49  16.391  -5.140  -3.748
  399   HH11  ARG  49          1HH1      ARG  49  16.091  -7.591  -1.209
  400   HH12  ARG  49          2HH1      ARG  49  14.631  -6.882  -0.554
  401   HH21  ARG  49          1HH2      ARG  49  14.508  -4.243  -2.850
  402   HH22  ARG  49          2HH2      ARG  49  13.736  -5.002  -1.487
  403    H    GLY  50           H        GLY  50  16.147 -11.975  -6.030
  404    HA2  GLY  50           2HA      GLY  50  14.722 -13.801  -6.042
  405    HA3  GLY  50           3HA      GLY  50  14.002 -13.275  -4.509
  406    H    PHE  51           H        PHE  51  14.072 -10.531  -6.481
  407    HA   PHE  51           HA       PHE  51  11.692 -11.311  -8.031
  408    HB2  PHE  51           HB2      PHE  51  10.355  -9.504  -7.297
  409    HB3  PHE  51           HB3      PHE  51  10.845 -10.440  -5.891
  410    HD1  PHE  51           HD1      PHE  51  12.687  -9.532  -4.382
  411    HD2  PHE  51           HD2      PHE  51  10.844  -7.194  -7.492
  412    HE1  PHE  51           HE1      PHE  51  13.447  -7.447  -3.273
  413    HE2  PHE  51           HE2      PHE  51  11.564  -5.117  -6.348
  414    HZ   PHE  51           HZ       PHE  51  12.902  -5.237  -4.286
  415    H    ALA  52           H        ALA  52  11.108  -9.620  -9.647
  416    HA   ALA  52           HA       ALA  52  13.253  -7.779 -10.431
  417    HB1  ALA  52           1HB      ALA  52  12.495 -10.236 -12.082
  418    HB2  ALA  52           HB2      ALA  52  13.592  -8.945 -12.602
  419    HB3  ALA  52           HB3      ALA  52  14.040  -9.999 -11.238
  420    H    PHE  53           H        PHE  53  12.604  -7.063 -12.887
  421    HA   PHE  53           HA       PHE  53   9.669  -6.872 -13.104
  422    HB2  PHE  53           HB2      PHE  53  11.515  -4.444 -13.063
  423    HB3  PHE  53           HB3      PHE  53   9.815  -4.402 -13.451
  424    HD1  PHE  53           HD1      PHE  53  12.304  -5.150 -10.824
  425    HD2  PHE  53           HD2      PHE  53   8.204  -4.241 -11.690
  426    HE1  PHE  53           HE1      PHE  53  11.865  -4.891  -8.399
  427    HE2  PHE  53           HE2      PHE  53   7.740  -3.987  -9.257
  428    HZ   PHE  53           HZ       PHE  53   9.570  -4.334  -7.609
  429    H    VAL  54           H        VAL  54   8.991  -6.011 -15.253
  430    HA   VAL  54           HA       VAL  54  11.037  -5.877 -17.347
  431    HB   VAL  54           HB       VAL  54  10.689  -8.317 -17.229
  432   HG11  VAL  54          1HG1      VAL  54   7.790  -7.848 -17.499
  433   HG12  VAL  54          HG21      VAL  54   8.697  -9.400 -17.514
  434   HG13  VAL  54          HG31      VAL  54   8.722  -8.388 -16.043
  435   HG21  VAL  54          HG32      VAL  54   9.967  -8.743 -19.503
  436   HG22  VAL  54          1HG2      VAL  54   8.991  -7.258 -19.545
  437   HG23  VAL  54          HG22      VAL  54  10.753  -7.147 -19.546
  438    H    THR  55           H        THR  55  10.370  -4.602 -19.017
  439    HA   THR  55           HA       THR  55   7.534  -3.681 -18.915
  440    HB   THR  55           HB       THR  55   9.931  -2.238 -20.083
  441    HG1  THR  55           1HG      THR  55   9.643  -0.915 -18.261
  442   HG21  THR  55          1HG2      THR  55   8.277  -0.333 -20.116
  443   HG22  THR  55          HG22      THR  55   7.863  -1.654 -21.228
  444   HG23  THR  55          HG32      THR  55   6.998  -1.500 -19.690
  445    H    PHE  56           H        PHE  56   6.265  -4.339 -20.449
  446    HA   PHE  56           HA       PHE  56   7.317  -5.375 -23.006
  447    HB2  PHE  56           HB2      PHE  56   4.601  -5.296 -21.653
  448    HB3  PHE  56           HB3      PHE  56   4.839  -5.867 -23.303
  449    HD1  PHE  56           HD2      PHE  56   6.373  -6.521 -19.872
  450    HD2  PHE  56           HD1      PHE  56   5.035  -8.069 -23.665
  451    HE1  PHE  56           HE2      PHE  56   6.933  -8.808 -19.144
  452    HE2  PHE  56           HE1      PHE  56   5.518 -10.356 -22.903
  453    HZ   PHE  56           HZ       PHE  56   6.414 -10.748 -20.620
  454    H    GLU  57           H        GLU  57   6.525  -4.624 -25.043
  455    HA   GLU  57           HA       GLU  57   6.118  -1.751 -25.183
  456    HB2  GLU  57           HB2      GLU  57   6.694  -3.982 -26.989
  457    HB3  GLU  57           HB3      GLU  57   5.492  -2.888 -27.674
  458    HG2  GLU  57           HG2      GLU  57   8.134  -1.930 -26.537
  459    HG3  GLU  57           HG3      GLU  57   7.863  -2.294 -28.245
  460    H    SER  58           H        SER  58   3.992  -4.577 -24.974
  461    HA   SER  58           HA       SER  58   1.720  -2.682 -25.347
  462    HB2  SER  58           HB2      SER  58   1.681  -4.298 -27.138
  463    HB3  SER  58           HB3      SER  58   1.955  -5.634 -25.997
  464    HG   SER  58           HG       SER  58  -0.263  -5.359 -26.606
  465    HA   PRO  59           HA       PRO  59   0.980  -3.565 -21.118
  466    HB2  PRO  59           HB2      PRO  59  -1.527  -2.594 -20.819
  467    HB3  PRO  59           HB3      PRO  59  -0.169  -1.484 -21.231
  468    HG2  PRO  59           HG2      PRO  59  -2.110  -2.845 -23.123
  469    HG3  PRO  59           HG3      PRO  59  -1.784  -1.089 -22.997
  470    HD2  PRO  59           2HD      PRO  59  -0.461  -2.598 -24.826
  471    HD3  PRO  59           3HD      PRO  59   0.444  -1.370 -23.881
  472    H    ALA  60           H        ALA  60  -0.415  -5.195 -23.749
  473    HA   ALA  60           HA       ALA  60  -1.968  -6.961 -21.925
  474    HB1  ALA  60           1HB      ALA  60  -2.448  -6.358 -24.863
  475    HB2  ALA  60           HB2      ALA  60  -3.393  -7.482 -23.844
  476    HB3  ALA  60           HB3      ALA  60  -3.400  -5.743 -23.488
  477    H    ASP  61           H        ASP  61   0.728  -6.738 -24.144
  478    HA   ASP  61           HA       ASP  61   0.974  -9.609 -24.529
  479    HB2  ASP  61           HB2      ASP  61   2.999  -7.312 -24.539
  480    HB3  ASP  61           HB3      ASP  61   3.411  -8.944 -24.871
  481    H    ALA  62           H        ALA  62   1.681  -7.216 -22.060
  482    HA   ALA  62           HA       ALA  62   3.237  -8.965 -20.360
  483    HB1  ALA  62           1HB      ALA  62   2.878  -7.152 -18.715
  484    HB2  ALA  62           HB2      ALA  62   3.479  -6.544 -20.287
  485    HB3  ALA  62           HB3      ALA  62   1.769  -6.345 -19.851
  486    H    LYS  63           H        LYS  63  -0.220  -8.177 -20.798
  487    HA   LYS  63           HA       LYS  63  -1.107  -9.476 -18.359
  488    HB2  LYS  63           HB2      LYS  63  -2.494  -8.862 -21.003
  489    HB3  LYS  63           HB3      LYS  63  -3.311  -9.569 -19.603
  490    HG2  LYS  63           HG2      LYS  63  -2.805  -7.634 -18.226
  491    HG3  LYS  63           HG3      LYS  63  -1.801  -6.939 -19.510
  492    HD2  LYS  63           2HD      LYS  63  -4.007  -5.844 -19.419
  493    HD3  LYS  63           3HD      LYS  63  -3.785  -6.673 -20.952
  494    HE2  LYS  63           HE2      LYS  63  -5.075  -8.632 -20.100
  495    HE3  LYS  63           HE3      LYS  63  -5.292  -7.802 -18.553
  496    HZ1  LYS  63           3HZ      LYS  63  -7.201  -7.522 -19.960
  497    HZ2  LYS  63           1HZ      LYS  63  -6.479  -6.066 -19.734
  498    HZ3  LYS  63           2HZ      LYS  63  -6.292  -6.861 -21.162
  499    H    ASP  64           H        ASP  64  -0.475 -10.505 -21.718
  500    HA   ASP  64           HA       ASP  64  -1.679 -13.087 -21.400
  501    HB2  ASP  64           HB2      ASP  64  -1.129 -11.821 -23.542
  502    HB3  ASP  64           HB3      ASP  64   0.567 -12.217 -23.263
  503    H    ALA  65           H        ALA  65   1.534 -11.751 -20.776
  504    HA   ALA  65           HA       ALA  65   2.724 -14.333 -20.128
  505    HB1  ALA  65           1HB      ALA  65   4.601 -13.053 -19.346
  506    HB2  ALA  65           HB2      ALA  65   4.024 -12.278 -20.836
  507    HB3  ALA  65           HB3      ALA  65   3.628 -11.562 -19.257
  508    H    ALA  66           H        ALA  66   1.280 -11.597 -18.275
  509    HA   ALA  66           HA       ALA  66   1.831 -12.802 -15.732
  510    HB1  ALA  66           1HB      ALA  66  -0.158 -10.627 -16.531
  511    HB2  ALA  66           HB2      ALA  66   0.451 -10.932 -14.885
  512    HB3  ALA  66           HB3      ALA  66   1.549 -10.344 -16.158
  513    H    ARG  67           H        ARG  67  -0.410 -13.559 -18.129
  514    HA   ARG  67           HA       ARG  67  -2.245 -14.931 -16.228
  515    HB2  ARG  67           HB2      ARG  67  -2.426 -14.221 -19.171
  516    HB3  ARG  67           HB3      ARG  67  -3.597 -15.270 -18.357
  517    HG2  ARG  67           HG2      ARG  67  -4.260 -13.533 -16.840
  518    HG3  ARG  67           HG3      ARG  67  -2.931 -12.480 -17.332
  519    HD2  ARG  67           2HD      ARG  67  -5.016 -11.733 -18.338
  520    HD3  ARG  67           3HD      ARG  67  -3.905 -12.282 -19.600
  521    HE   ARG  67           HE       ARG  67  -5.793 -14.306 -18.616
  522   HH11  ARG  67          1HH1      ARG  67  -5.155 -11.807 -21.046
  523   HH12  ARG  67          2HH1      ARG  67  -6.315 -12.456 -22.182
  524   HH21  ARG  67          1HH2      ARG  67  -7.286 -15.129 -20.130
  525   HH22  ARG  67          2HH2      ARG  67  -7.510 -14.329 -21.669
  526    H    ASP  68           H        ASP  68   0.692 -15.719 -17.576
  527    HA   ASP  68           HA       ASP  68  -0.156 -18.516 -18.169
  528    HB2  ASP  68           HB2      ASP  68   1.421 -16.448 -19.647
  529    HB3  ASP  68           HB3      ASP  68   2.210 -17.977 -19.482
  530    H    MET  69           H        MET  69   2.519 -16.301 -17.504
  531    HA   MET  69           HA       MET  69   4.250 -18.321 -16.366
  532    HB2  MET  69           HB2      MET  69   4.277 -15.454 -17.241
  533    HB3  MET  69           HB3      MET  69   5.371 -15.850 -15.967
  534    HG2  MET  69           HG2      MET  69   5.102 -17.227 -18.673
  535    HG3  MET  69           HG3      MET  69   6.387 -16.104 -18.216
  536    HE1  MET  69           HE3      MET  69   6.839 -17.229 -15.174
  537    HE2  MET  69           HE1      MET  69   8.365 -18.084 -15.524
  538    HE3  MET  69           HE2      MET  69   8.015 -16.518 -16.310
  539    H    ASN  70           H        ASN  70   1.720 -16.342 -15.099
  540    HA   ASN  70           HA       ASN  70   2.920 -15.891 -12.504
  541    HB2  ASN  70           HB2      ASN  70   1.083 -14.500 -13.456
  542    HB3  ASN  70           HB3      ASN  70  -0.005 -15.886 -13.368
  543   HD21  ASN  70          2HD2      ASN  70  -1.308 -14.388 -12.022
  544   HD22  ASN  70          1HD2      ASN  70  -0.949 -14.273 -10.311
  545    H    GLY  71           H        GLY  71   3.136 -17.287 -10.873
  546    HA2  GLY  71           2HA      GLY  71   2.547 -18.999  -9.410
  547    HA3  GLY  71           3HA      GLY  71   1.257 -19.509 -10.508
  548    H    LYS  72           H        LYS  72   3.730 -19.237 -12.645
  549    HA   LYS  72           HA       LYS  72   4.543 -22.030 -12.543
  550    HB2  LYS  72           HB2      LYS  72   5.420 -19.709 -14.279
  551    HB3  LYS  72           HB3      LYS  72   5.625 -21.428 -14.603
  552    HG2  LYS  72           HG2      LYS  72   2.949 -19.982 -14.507
  553    HG3  LYS  72           HG3      LYS  72   3.770 -20.616 -15.953
  554    HD2  LYS  72           2HD      LYS  72   3.654 -22.910 -14.979
  555    HD3  LYS  72           3HD      LYS  72   2.680 -22.261 -13.636
  556    HE2  LYS  72           HE2      LYS  72   1.972 -22.012 -16.588
  557    HE3  LYS  72           HE3      LYS  72   1.328 -23.248 -15.504
  558    HZ1  LYS  72           3HZ      LYS  72  -0.180 -21.417 -15.673
  559    HZ2  LYS  72           1HZ      LYS  72   0.423 -21.456 -14.141
  560    HZ3  LYS  72           2HZ      LYS  72   0.969 -20.338 -15.220
  561    H    SER  73           H        SER  73   7.143 -21.389 -13.637
  562    HA   SER  73           HA       SER  73   8.651 -20.487 -11.216
  563    HB2  SER  73           HB2      SER  73   8.090 -22.907 -11.117
  564    HB3  SER  73           HB3      SER  73   8.921 -23.152 -12.663
  565    HG   SER  73           HG       SER  73  10.269 -23.604 -10.862
  566    H    LEU  74           H        LEU  74  10.809 -20.192 -11.460
  567    HA   LEU  74           HA       LEU  74  11.780 -19.832 -14.252
  568    HB2  LEU  74           HB2      LEU  74  11.147 -17.684 -12.505
  569    HB3  LEU  74           HB3      LEU  74  12.830 -17.928 -12.263
  570    HG   LEU  74           HG       LEU  74  12.641 -16.327 -13.978
  571   HD11  LEU  74          1HD1      LEU  74  13.292 -18.919 -15.425
  572   HD12  LEU  74          2HD1      LEU  74  13.751 -17.280 -15.905
  573   HD13  LEU  74          3HD1      LEU  74  14.420 -17.967 -14.413
  574   HD21  LEU  74          3HD2      LEU  74  10.896 -18.339 -15.478
  575   HD22  LEU  74          1HD2      LEU  74  10.285 -16.909 -14.606
  576   HD23  LEU  74          2HD2      LEU  74  11.323 -16.707 -16.033
  577    H    ASP  75           H        ASP  75  13.643 -20.833 -14.522
  578    HA   ASP  75           HA       ASP  75  15.543 -21.953 -14.166
  579    HB2  ASP  75           HB2      ASP  75  15.957 -19.516 -13.020
  580    HB3  ASP  75           HB3      ASP  75  15.851 -20.383 -11.586
  581    H    GLY  76           H        GLY  76  13.207 -22.027 -11.628
  582    HA2  GLY  76           2HA      GLY  76  13.152 -24.648 -11.246
  583    HA3  GLY  76           3HA      GLY  76  14.563 -24.217 -10.253
  584    H    LYS  77           H        LYS  77  12.745 -21.479 -10.020
  585    HA   LYS  77           HA       LYS  77  11.485 -22.435  -7.495
  586    HB2  LYS  77           HB2      LYS  77  12.783 -19.740  -7.987
  587    HB3  LYS  77           HB3      LYS  77  12.139 -20.354  -6.457
  588    HG2  LYS  77           HG2      LYS  77  14.496 -21.504  -7.999
  589    HG3  LYS  77           HG3      LYS  77  14.606 -20.511  -6.541
  590    HD2  LYS  77           2HD      LYS  77  13.590 -22.228  -5.181
  591    HD3  LYS  77           3HD      LYS  77  13.146 -23.184  -6.607
  592    HE2  LYS  77           HE2      LYS  77  15.503 -23.516  -7.182
  593    HE3  LYS  77           HE3      LYS  77  16.002 -22.518  -5.808
  594    HZ1  LYS  77           3HZ      LYS  77  16.110 -24.847  -5.279
  595    HZ2  LYS  77           1HZ      LYS  77  14.957 -24.130  -4.352
  596    HZ3  LYS  77           2HZ      LYS  77  14.522 -25.059  -5.638
  597    H    ALA  78           H        ALA  78   9.444 -21.803  -7.064
  598    HA   ALA  78           HA       ALA  78   7.898 -20.968  -9.329
  599    HB1  ALA  78           1HB      ALA  78   7.100 -21.342  -6.423
  600    HB2  ALA  78           HB2      ALA  78   5.983 -21.192  -7.798
  601    HB3  ALA  78           HB3      ALA  78   7.079 -22.591  -7.693
  602    H    ILE  79           H        ILE  79   6.846 -19.088  -9.783
  603    HA   ILE  79           HA       ILE  79   7.636 -16.732  -8.136
  604    HB   ILE  79           HB       ILE  79   7.909 -15.475 -10.142
  605   HG12  ILE  79          HG21      ILE  79   7.076 -17.922 -11.753
  606   HG13  ILE  79          HG31      ILE  79   6.022 -16.534 -11.416
  607   HG21  ILE  79          1HG2      ILE  79   9.807 -16.917  -9.438
  608   HG22  ILE  79          HG22      ILE  79   9.247 -18.178 -10.563
  609   HG23  ILE  79          HG32      ILE  79   9.779 -16.598 -11.189
  610   HD11  ILE  79          3HD1      ILE  79   6.944 -16.136 -13.564
  611   HD12  ILE  79          1HD1      ILE  79   7.762 -15.038 -12.444
  612   HD13  ILE  79          2HD1      ILE  79   8.598 -16.507 -13.020
  613    H    LYS  80           H        LYS  80   6.463 -14.759  -8.831
  614    HA   LYS  80           HA       LYS  80   3.557 -15.150  -9.333
  615    HB2  LYS  80           HB2      LYS  80   4.183 -14.293  -6.999
  616    HB3  LYS  80           HB3      LYS  80   4.959 -12.917  -7.784
  617    HG2  LYS  80           HG2      LYS  80   2.736 -12.396  -8.915
  618    HG3  LYS  80           HG3      LYS  80   2.000 -13.628  -7.873
  619    HD2  LYS  80           2HD      LYS  80   2.794 -12.361  -5.874
  620    HD3  LYS  80           3HD      LYS  80   3.534 -11.155  -6.963
  621    HE2  LYS  80           HE2      LYS  80   1.325 -10.674  -7.939
  622    HE3  LYS  80           HE3      LYS  80   0.569 -11.823  -6.820
  623    HZ1  LYS  80           3HZ      LYS  80   0.451  -9.538  -6.056
  624    HZ2  LYS  80           1HZ      LYS  80   1.326 -10.458  -5.006
  625    HZ3  LYS  80           2HZ      LYS  80   2.085  -9.417  -6.034
  626    H    VAL  81           H        VAL  81   2.718 -13.780 -10.983
  627    HA   VAL  81           HA       VAL  81   4.548 -11.689 -12.035
  628    HB   VAL  81           HB       VAL  81   3.009 -13.640 -13.785
  629   HG11  VAL  81          1HG1      VAL  81   4.919 -11.357 -14.444
  630   HG12  VAL  81          HG21      VAL  81   4.170 -12.461 -15.622
  631   HG13  VAL  81          HG31      VAL  81   3.162 -11.331 -14.695
  632   HG21  VAL  81          HG32      VAL  81   5.996 -13.291 -13.275
  633   HG22  VAL  81          1HG2      VAL  81   5.010 -14.700 -12.824
  634   HG23  VAL  81          HG22      VAL  81   5.282 -14.319 -14.536
  635    H    GLU  82           H        GLU  82   3.586  -9.778 -12.228
  636    HA   GLU  82           HA       GLU  82   0.691  -9.520 -12.579
  637    HB2  GLU  82           HB2      GLU  82   1.067 -10.101 -10.130
  638    HB3  GLU  82           HB3      GLU  82   2.037  -8.637  -9.982
  639    HG2  GLU  82           HG2      GLU  82   0.091  -7.249 -10.517
  640    HG3  GLU  82           HG3      GLU  82  -0.874  -8.691 -10.882
  641    H    GLN  83           H        GLN  83   0.111  -7.108 -12.737
  642    HA   GLN  83           HA       GLN  83   2.196  -5.576 -13.974
  643    HB2  GLN  83           HB2      GLN  83  -0.051  -5.030 -14.542
  644    HB3  GLN  83           HB3      GLN  83  -0.547  -4.973 -12.847
  645    HG2  GLN  83           HG2      GLN  83  -0.507  -2.740 -13.680
  646    HG3  GLN  83           HG3      GLN  83   0.758  -2.937 -12.471
  647   HE21  GLN  83          HE22      GLN  83   2.254  -1.504 -12.984
  648   HE22  GLN  83          HE12      GLN  83   2.989  -1.280 -14.548
  649    H    ALA  84           H        ALA  84   3.614  -4.101 -13.114
  650    HA   ALA  84           HA       ALA  84   4.302  -4.611 -10.357
  651    HB1  ALA  84           1HB      ALA  84   5.467  -2.654 -12.369
  652    HB2  ALA  84           HB2      ALA  84   6.223  -3.159 -10.844
  653    HB3  ALA  84           HB3      ALA  84   5.975  -4.348 -12.146
  654    H    THR  85           H        THR  85   4.495  -3.176  -8.641
  655    HA   THR  85           HA       THR  85   2.914  -0.656  -8.863
  656    HB   THR  85           HB       THR  85   2.674  -0.745  -6.469
  657    HG1  THR  85           1HG      THR  85   3.414  -2.583  -5.343
  658   HG21  THR  85          1HG2      THR  85   1.986  -3.492  -7.635
  659   HG22  THR  85          HG22      THR  85   1.185  -2.687  -6.265
  660   HG23  THR  85          HG32      THR  85   1.023  -2.024  -7.908
  661    H    LYS  86           H        LYS  86   3.763   0.973  -7.141
  662    HA   LYS  86           HA       LYS  86   6.478   1.610  -7.912
  663    HB2  LYS  86           HB2      LYS  86   4.434   2.877  -6.059
  664    HB3  LYS  86           HB3      LYS  86   6.037   3.580  -6.371
  665    HG2  LYS  86           HG2      LYS  86   5.565   3.545  -8.821
  666    HG3  LYS  86           HG3      LYS  86   3.958   2.874  -8.496
  667    HD2  LYS  86           2HD      LYS  86   3.402   4.921  -7.179
  668    HD3  LYS  86           3HD      LYS  86   4.987   5.601  -7.637
  669    HE2  LYS  86           HE2      LYS  86   4.397   5.389 -10.024
  670    HE3  LYS  86           HE3      LYS  86   2.864   4.631  -9.599
  671    HZ1  LYS  86           3HZ      LYS  86   2.193   6.652  -8.537
  672    HZ2  LYS  86           1HZ      LYS  86   3.637   7.377  -8.863
  673    HZ3  LYS  86           2HZ      LYS  86   2.614   6.971 -10.085
  674    HA   PRO  87           HA       PRO  87   8.739  -0.327  -4.737
  675    HB2  PRO  87           HB2      PRO  87  10.879   1.326  -4.370
  676    HB3  PRO  87           HB3      PRO  87  10.608   0.413  -5.881
  677    HG2  PRO  87           HG2      PRO  87   9.824   3.285  -5.303
  678    HG3  PRO  87           HG3      PRO  87  10.748   2.656  -6.714
  679    HD2  PRO  87           2HD      PRO  87   8.079   3.083  -6.875
  680    HD3  PRO  87           3HD      PRO  87   8.807   1.633  -7.632
  681    H    SER  88           H        SER  88   9.502  -0.165  -2.474
  682    HA   SER  88           HA       SER  88   7.497   1.350  -0.985
  683    HB2  SER  88           HB2      SER  88   7.931  -1.076  -0.641
  684    HB3  SER  88           HB3      SER  88   9.542  -0.667  -0.007
  685    HG   SER  88           HG       SER  88   8.495   0.557   1.607
  686    H    PHE  89           H        PHE  89  10.722   2.010  -1.885
  687    HA   PHE  89           HA       PHE  89  11.227   3.500   0.615
  688    HB2  PHE  89           HB2      PHE  89  13.470   3.809  -0.137
  689    HB3  PHE  89           HB3      PHE  89  13.026   2.098  -0.132
  690    HD1  PHE  89           HD2      PHE  89  12.550   0.961  -2.350
  691    HD2  PHE  89           HD1      PHE  89  14.244   4.893  -2.072
  692    HE1  PHE  89           HE2      PHE  89  13.393   0.763  -4.678
  693    HE2  PHE  89           HE1      PHE  89  15.121   4.684  -4.390
  694    HZ   PHE  89           HZ       PHE  89  14.687   2.620  -5.693
  695    H    GLU  90           H        GLU  90   9.263   4.241  -1.663
  696    HA   GLU  90           HA       GLU  90  10.381   6.960  -2.168
  697    HB2  GLU  90           HB2      GLU  90   9.956   5.233  -4.108
  698    HB3  GLU  90           HB3      GLU  90   8.260   5.726  -3.901
  699    HG2  GLU  90           HG2      GLU  90   9.001   8.115  -4.132
  700    HG3  GLU  90           HG3      GLU  90  10.667   7.538  -4.353
  701    H    SER  91           H        SER  91   9.089   8.701  -2.109
  702    HA   SER  91           HA       SER  91   7.112   8.589   0.038
  703    HB2  SER  91           HB2      SER  91   8.686  10.696  -1.417
  704    HB3  SER  91           HB3      SER  91   7.399  11.139  -0.242
  705    HG   SER  91           HG       SER  91   9.473  10.977   0.731
  706    H    GLY  92           H        GLY  92   6.617   7.799  -2.988
  707    HA2  GLY  92           2HA      GLY  92   4.712   9.682  -3.984
  708    HA3  GLY  92           3HA      GLY  92   4.914   7.995  -4.505
  709    H    ARG  93           H        ARG  93   4.485   7.689  -1.267
  710    HA   ARG  93           HA       ARG  93   1.674   6.965  -1.535
  711    HB2  ARG  93           HB2      ARG  93   1.940   6.085   0.732
  712    HB3  ARG  93           HB3      ARG  93   3.250   5.525  -0.316
  713    HG2  ARG  93           HG2      ARG  93   4.785   7.196   0.641
  714    HG3  ARG  93           HG3      ARG  93   3.465   7.898   1.592
  715    HD2  ARG  93           2HD      ARG  93   4.823   6.444   3.008
  716    HD3  ARG  93           3HD      ARG  93   3.198   5.778   2.821
  717    HE   ARG  93           HE       ARG  93   4.040   4.008   1.534
  718   HH11  ARG  93          1HH1      ARG  93   6.615   6.282   2.375
  719   HH12  ARG  93          2HH1      ARG  93   7.894   5.164   1.948
  720   HH21  ARG  93          1HH2      ARG  93   5.725   2.581   0.992
  721   HH22  ARG  93          2HH2      ARG  93   7.391   3.087   1.156
  722    H    ARG  94           H        ARG  94   3.136   9.895  -1.028
  723    HA   ARG  94           HA       ARG  94   0.706  10.977   0.246
  724    HB2  ARG  94           HB2      ARG  94   2.010  12.253   1.897
  725    HB3  ARG  94           HB3      ARG  94   2.170  10.509   2.157
  726    HG2  ARG  94           HG2      ARG  94   4.366  10.485   1.102
  727    HG3  ARG  94           HG3      ARG  94   4.213  12.192   0.632
  728    HD2  ARG  94           2HD      ARG  94   4.198  11.183   3.499
  729    HD3  ARG  94           3HD      ARG  94   5.624  11.829   2.662
  730    HE   ARG  94           HE       ARG  94   3.764  13.820   2.336
  731   HH11  ARG  94          1HH1      ARG  94   5.018  12.102   5.159
  732   HH12  ARG  94          2HH1      ARG  94   4.793  13.467   6.233
  733   HH21  ARG  94          1HH2      ARG  94   3.481  15.576   3.755
  734   HH22  ARG  94          2HH2      ARG  94   3.927  15.425   5.442
  735    H    GLY  95           H        GLY  95   0.752  13.395   0.263
  736    HA2  GLY  95           2HA      GLY  95   1.514  14.420  -2.333
  737    HA3  GLY  95           3HA      GLY  95   0.759  15.318  -0.998
  738    H5'    A  96           H5'        A  96   5.030 -10.283   4.101
  739   H5''    A  96          H5''        A  96   6.641  -9.579   4.272
  740    H4'    A  96           H4'        A  96   5.108 -11.149   6.419
  741    H3'    A  96           H3'        A  96   5.201  -8.311   5.638
  742    H2'    A  96           H2'        A  96   6.266  -7.384   7.512
  743   HO2'    A  96          HO2'        A  96   4.889  -8.563   9.018
  744    H1'    A  96           H1'        A  96   8.100  -9.265   8.087
  745    H8     A  96           H8         A  96   8.766 -10.097   4.815
  746    H61    A  96           H61        A  96  10.535  -4.332   3.340
  747    H62    A  96           H62        A  96  10.580  -6.012   2.832
  748    H2     A  96           H2         A  96   8.290  -4.147   7.154
  749   HO5'    A  96          H5T         A  96   6.649 -11.668   3.269
  750    H5'    U  97           H5'        U  97   3.235  -6.593   6.012
  751   H5''    U  97          H5''        U  97   1.537  -6.750   5.556
  752    H4'    U  97           H4'        U  97   1.952  -6.347   3.273
  753    H3'    U  97           H3'        U  97   4.428  -7.514   3.435
  754    H2'    U  97           H2'        U  97   5.770  -5.911   4.422
  755   HO2'    U  97          HO2'        U  97   5.274  -4.783   1.878
  756    H1'    U  97           H1'        U  97   4.402  -3.440   3.768
  757    H3     U  97           H3         U  97   4.567  -1.673   7.894
  758    H5     U  97           H5         U  97   5.572  -5.709   8.502
  759    H6     U  97           H6         U  97   5.049  -6.126   6.156
  760    H5'    C  98           H5'        C  98   4.719  -9.557   1.993
  761   H5''    C  98          H5''        C  98   5.867  -8.249   1.704
  762    H4'    C  98           H4'        C  98   7.083 -10.098   1.060
  763    H3'    C  98           H3'        C  98   6.512  -8.402  -1.012
  764    H2'    C  98           H2'        C  98   4.509  -9.464  -1.713
  765   HO2'    C  98          HO2'        C  98   6.633 -10.755  -3.088
  766    H1'    C  98           H1'        C  98   5.629 -12.225  -1.488
  767    H41    C  98           H41        C  98  -0.669 -13.097  -1.833
  768    H42    C  98           H42        C  98  -0.933 -12.104  -0.407
  769    H5     C  98           H5         C  98   0.889 -10.936   0.744
  770    H6     C  98           H6         C  98   3.295 -10.519   0.718
  771    H5'    A  99           H5'        A  99   9.267  -6.472  -0.969
  772   H5''    A  99          H5''        A  99   7.778  -6.980  -1.807
  773    H4'    A  99           H4'        A  99  10.313  -6.239  -3.311
  774    H3'    A  99           H3'        A  99   8.882  -4.388  -1.743
  775    H2'    A  99           H2'        A  99   6.879  -4.581  -3.083
  776   HO2'    A  99          HO2'        A  99   8.601  -2.643  -4.258
  777    H1'    A  99           H1'        A  99   8.801  -4.801  -5.416
  778    H8     A  99           H8         A  99   7.146  -3.866  -7.090
  779    H61    A  99           H61        A  99   1.912  -7.200  -7.398
  780    H62    A  99           H62        A  99   2.861  -5.948  -8.170
  781    H2     A  99           H2         A  99   4.162  -8.455  -3.773
  782    H5'    A 100           H5'        A 100  12.647  -1.409  -4.144
  783   H5''    A 100          H5''        A 100  11.490  -2.509  -4.929
  784    H4'    A 100           H4'        A 100  14.113  -3.673  -5.191
  785    H3'    A 100           H3'        A 100  14.632  -1.048  -4.969
  786    H2'    A 100           H2'        A 100  12.636  -0.435  -6.154
  787   HO2'    A 100          HO2'        A 100  14.813  -0.331  -8.003
  788    H1'    A 100           H1'        A 100  13.397  -2.182  -8.473
  789    H8     A 100           H8         A 100  10.235  -1.987  -6.187
  790    H61    A 100           H61        A 100   7.373   0.082 -11.282
  791    H62    A 100           H62        A 100   7.157  -0.418  -9.618
  792    H2     A 100           H2         A 100  11.674  -0.440 -12.239
  793    H5'    A 101           H5'        A 101  16.487   0.434  -6.392
  794   H5''    A 101          H5''        A 101  18.051  -0.200  -6.942
  795    H4'    A 101           H4'        A 101  18.289   2.104  -6.190
  796    H3'    A 101           H3'        A 101  19.938   0.010  -5.470
  797   HO3'    A 101          H3T         A 101  21.319   1.764  -4.710
  798    H2'    A 101           H2'        A 101  18.987  -0.399  -3.377
  799   HO2'    A 101          HO2'        A 101  20.302   0.651  -1.786
  800    H1'    A 101           H1'        A 101  18.703   2.570  -2.858
  801    H8     A 101           H8         A 101  17.246  -0.984  -2.536
  802    H61    A 101           H61        A 101  14.462   1.198   2.579
  803    H62    A 101           H62        A 101  14.754  -0.240   1.613
  804    H2     A 101           H2         A 101  16.472   4.583   0.546
  Start of MODEL    8
    1    H1   MET   1           H1       MET   1  -5.616   5.073  -1.122
    2    H2   MET   1           H2       MET   1  -5.589   5.892  -2.545
    3    H3   MET   1           H3       MET   1  -5.100   6.636  -1.163
    4    HA   MET   1           HA       MET   1  -3.203   6.038  -2.505
    5    HB2  MET   1           HB2      MET   1  -2.993   6.082  -0.028
    6    HB3  MET   1           HB3      MET   1  -3.453   4.370   0.031
    7    HG2  MET   1           HG2      MET   1  -0.998   4.665   0.110
    8    HG3  MET   1           HG3      MET   1  -1.503   3.759  -1.312
    9    HE1  MET   1           HE1      MET   1   0.655   3.999  -2.630
   10    HE2  MET   1           HE2      MET   1   1.585   5.506  -2.771
   11    HE3  MET   1           HE3      MET   1   1.361   4.748  -1.177
   12    H    VAL   2           H        VAL   2  -3.857   5.089  -4.437
   13    HA   VAL   2           HA       VAL   2  -2.996   2.279  -4.471
   14    HB   VAL   2           HB       VAL   2  -5.389   2.087  -4.655
   15   HG11  VAL   2          1HG1      VAL   2  -5.946   4.417  -5.318
   16   HG12  VAL   2          HG21      VAL   2  -5.280   4.104  -6.939
   17   HG13  VAL   2          HG31      VAL   2  -6.708   3.211  -6.372
   18   HG21  VAL   2          HG32      VAL   2  -4.114   1.981  -7.411
   19   HG22  VAL   2          1HG2      VAL   2  -3.950   0.731  -6.149
   20   HG23  VAL   2          HG22      VAL   2  -5.545   1.066  -6.875
   21    H    GLU   3           H        GLU   3  -1.336   2.081  -5.801
   22    HA   GLU   3           HA       GLU   3  -0.995   4.038  -8.027
   23    HB2  GLU   3           HB2      GLU   3   1.384   4.190  -7.465
   24    HB3  GLU   3           HB3      GLU   3   0.345   4.833  -6.177
   25    HG2  GLU   3           HG2      GLU   3   0.579   2.638  -4.966
   26    HG3  GLU   3           HG3      GLU   3   1.724   2.122  -6.212
   27    H    ALA   4           H        ALA   4  -0.378   3.345  -9.845
   28    HA   ALA   4           HA       ALA   4   0.982   0.746 -10.143
   29    HB1  ALA   4           1HB      ALA   4  -0.544   0.124 -11.983
   30    HB2  ALA   4           HB2      ALA   4  -1.429   0.250 -10.447
   31    HB3  ALA   4           HB3      ALA   4  -1.543   1.555 -11.656
   32    H    ASP   5           H        ASP   5   2.687   1.151 -11.245
   33    HA   ASP   5           HA       ASP   5   3.161   3.675 -12.551
   34    HB2  ASP   5           HB2      ASP   5   4.827   2.407 -11.216
   35    HB3  ASP   5           HB3      ASP   5   4.871   1.174 -12.473
   36    H    ARG   6           H        ARG   6   1.052   2.721 -13.815
   37    HA   ARG   6           HA       ARG   6   0.076   2.421 -15.776
   38    HB2  ARG   6           HB2      ARG   6   2.770   3.108 -16.983
   39    HB3  ARG   6           HB3      ARG   6   1.216   3.169 -17.812
   40    HG2  ARG   6           HG2      ARG   6   2.010   4.870 -15.409
   41    HG3  ARG   6           HG3      ARG   6   1.915   5.405 -17.094
   42    HD2  ARG   6           2HD      ARG   6  -0.510   4.865 -17.123
   43    HD3  ARG   6           3HD      ARG   6  -0.419   4.393 -15.415
   44    HE   ARG   6           HE       ARG   6   0.638   7.025 -15.707
   45   HH11  ARG   6          1HH1      ARG   6  -2.441   5.293 -15.874
   46   HH12  ARG   6          2HH1      ARG   6  -3.387   6.687 -15.408
   47   HH21  ARG   6          1HH2      ARG   6  -0.623   8.826 -15.083
   48   HH22  ARG   6          2HH2      ARG   6  -2.359   8.676 -14.961
   49    HA   PRO   7           HA       PRO   7   0.195  -1.684 -17.190
   50    HB2  PRO   7           HB2      PRO   7  -0.249  -0.430 -19.900
   51    HB3  PRO   7           HB3      PRO   7  -1.108  -1.838 -19.196
   52    HG2  PRO   7           HG2      PRO   7  -2.261   0.569 -19.229
   53    HG3  PRO   7           HG3      PRO   7  -2.299  -0.366 -17.686
   54    HD2  PRO   7           2HD      PRO   7  -0.441   1.895 -18.475
   55    HD3  PRO   7           3HD      PRO   7  -1.284   1.616 -16.921
   56    H    GLY   8           H        GLY   8   1.568  -3.215 -18.209
   57    HA2  GLY   8           2HA      GLY   8   2.948  -3.841 -20.055
   58    HA3  GLY   8           3HA      GLY   8   3.568  -2.178 -20.151
   59    H    LYS   9           H        LYS   9   3.620  -2.305 -16.981
   60    HA   LYS   9           HA       LYS   9   6.301  -3.586 -16.967
   61    HB2  LYS   9           HB2      LYS   9   6.269  -1.225 -16.321
   62    HB3  LYS   9           HB3      LYS   9   5.106  -1.594 -15.019
   63    HG2  LYS   9           HG2      LYS   9   6.739  -3.192 -14.028
   64    HG3  LYS   9           HG3      LYS   9   7.883  -2.849 -15.329
   65    HD2  LYS   9           2HD      LYS   9   6.840  -0.770 -13.366
   66    HD3  LYS   9           3HD      LYS   9   8.353  -1.683 -13.171
   67    HE2  LYS   9           HE2      LYS   9   9.198  -0.789 -15.301
   68    HE3  LYS   9           HE3      LYS   9   7.693   0.111 -15.545
   69    HZ1  LYS   9           3HZ      LYS   9   8.159   1.388 -13.621
   70    HZ2  LYS   9           1HZ      LYS   9   9.506   0.510 -13.261
   71    HZ3  LYS   9           2HZ      LYS   9   9.470   1.460 -14.603
   72    H    LEU  10           H        LEU  10   6.665  -5.379 -15.853
   73    HA   LEU  10           HA       LEU  10   4.415  -6.414 -14.188
   74    HB2  LEU  10           HB2      LEU  10   6.530  -7.789 -15.851
   75    HB3  LEU  10           HB3      LEU  10   5.457  -8.674 -14.822
   76    HG   LEU  10           HG       LEU  10   4.640  -6.993 -17.232
   77   HD11  LEU  10          1HD1      LEU  10   4.411  -9.985 -16.645
   78   HD12  LEU  10          2HD1      LEU  10   4.146  -9.178 -18.207
   79   HD13  LEU  10          3HD1      LEU  10   5.788  -9.278 -17.501
   80   HD21  LEU  10          3HD2      LEU  10   2.949  -8.586 -15.266
   81   HD22  LEU  10          1HD2      LEU  10   2.840  -6.835 -15.629
   82   HD23  LEU  10          2HD2      LEU  10   2.388  -8.040 -16.857
   83    H    PHE  11           H        PHE  11   4.918  -7.576 -12.335
   84    HA   PHE  11           HA       PHE  11   7.623  -7.124 -11.161
   85    HB2  PHE  11           HB2      PHE  11   5.883  -6.132  -9.820
   86    HB3  PHE  11           HB3      PHE  11   4.878  -7.586  -9.947
   87    HD1  PHE  11           HD1      PHE  11   8.181  -6.389  -8.677
   88    HD2  PHE  11           HD2      PHE  11   5.040  -9.302  -8.340
   89    HE1  PHE  11           HE1      PHE  11   9.237  -7.290  -6.625
   90    HE2  PHE  11           HE2      PHE  11   6.114 -10.222  -6.296
   91    HZ   PHE  11           HZ       PHE  11   8.228  -9.208  -5.450
   92    H    ILE  12           H        ILE  12   8.863  -8.900 -10.812
   93    HA   ILE  12           HA       ILE  12   7.587 -11.554 -11.297
   94    HB   ILE  12           HB       ILE  12  10.448 -10.899 -11.999
   95   HG12  ILE  12          HG21      ILE  12   9.242  -9.280 -13.333
   96   HG13  ILE  12          HG31      ILE  12   9.884 -10.580 -14.325
   97   HG21  ILE  12          1HG2      ILE  12   8.417 -12.943 -12.962
   98   HG22  ILE  12          HG22      ILE  12  10.106 -12.830 -13.510
   99   HG23  ILE  12          HG32      ILE  12   9.737 -13.239 -11.811
  100   HD11  ILE  12          3HD1      ILE  12   6.984 -10.167 -13.519
  101   HD12  ILE  12          1HD1      ILE  12   7.713 -10.013 -15.136
  102   HD13  ILE  12          2HD1      ILE  12   7.576 -11.609 -14.374
  103    H    GLY  13           H        GLY  13   7.319 -11.719  -8.933
  104    HA2  GLY  13           2HA      GLY  13   9.824 -11.691  -7.351
  105    HA3  GLY  13           3HA      GLY  13   8.193 -11.814  -6.713
  106    H    GLY  14           H        GLY  14  10.690 -13.523  -6.285
  107    HA2  GLY  14           2HA      GLY  14  10.428 -15.640  -5.260
  108    HA3  GLY  14           3HA      GLY  14   9.141 -16.055  -6.408
  109    H    LEU  15           H        LEU  15  11.826 -14.496  -7.863
  110    HA   LEU  15           HA       LEU  15  12.379 -16.739  -9.550
  111    HB2  LEU  15           HB2      LEU  15  13.911 -14.163  -9.037
  112    HB3  LEU  15           HB3      LEU  15  14.173 -15.291 -10.392
  113    HG   LEU  15           HG       LEU  15  11.451 -14.042 -10.010
  114   HD11  LEU  15          1HD1      LEU  15  13.884 -12.882 -11.439
  115   HD12  LEU  15          2HD1      LEU  15  12.218 -12.284 -11.615
  116   HD13  LEU  15          3HD1      LEU  15  13.049 -12.170 -10.042
  117   HD21  LEU  15          3HD2      LEU  15  11.958 -15.987 -11.588
  118   HD22  LEU  15          1HD2      LEU  15  11.379 -14.518 -12.426
  119   HD23  LEU  15          2HD2      LEU  15  13.110 -14.911 -12.413
  120    H    ASN  16           H        ASN  16  14.502 -17.701  -9.928
  121    HA   ASN  16           HA       ASN  16  15.685 -18.752  -7.553
  122    HB2  ASN  16           HB2      ASN  16  15.320 -19.808  -9.814
  123    HB3  ASN  16           HB3      ASN  16  16.725 -18.872 -10.393
  124   HD21  ASN  16          2HD2      ASN  16  17.240 -21.228 -10.882
  125   HD22  ASN  16          1HD2      ASN  16  18.084 -22.107  -9.671
  126    H    THR  17           H        THR  17  18.186 -18.652  -7.274
  127    HA   THR  17           HA       THR  17  18.827 -15.803  -7.005
  128    HB   THR  17           HB       THR  17  20.655 -16.602  -5.604
  129    HG1  THR  17           1HG      THR  17  20.916 -18.846  -5.332
  130   HG21  THR  17          1HG2      THR  17  18.328 -16.488  -4.673
  131   HG22  THR  17          HG22      THR  17  18.117 -18.207  -5.082
  132   HG23  THR  17          HG32      THR  17  19.341 -17.722  -3.879
  133    H    GLU  18           H        GLU  18  19.303 -18.185  -9.322
  134    HA   GLU  18           HA       GLU  18  21.888 -17.112 -10.256
  135    HB2  GLU  18           HB2      GLU  18  21.604 -19.329 -11.616
  136    HB3  GLU  18           HB3      GLU  18  22.166 -19.394  -9.917
  137    HG2  GLU  18           HG2      GLU  18  19.822 -19.934  -9.227
  138    HG3  GLU  18           HG3      GLU  18  19.324 -19.840 -10.903
  139    H    THR  19           H        THR  19  18.596 -16.719 -10.739
  140    HA   THR  19           HA       THR  19  18.594 -16.608 -13.642
  141    HB   THR  19           HB       THR  19  16.688 -15.392 -11.606
  142    HG1  THR  19           1HG      THR  19  15.480 -17.274 -12.109
  143   HG21  THR  19          1HG2      THR  19  16.425 -14.406 -13.845
  144   HG22  THR  19          HG22      THR  19  16.362 -16.031 -14.571
  145   HG23  THR  19          HG32      THR  19  15.065 -15.484 -13.485
  146    H    ASN  20           H        ASN  20  18.787 -14.776 -14.942
  147    HA   ASN  20           HA       ASN  20  19.393 -12.202 -13.582
  148    HB2  ASN  20           HB2      ASN  20  20.935 -12.776 -16.041
  149    HB3  ASN  20           HB3      ASN  20  21.396 -11.856 -14.608
  150   HD21  ASN  20          2HD2      ASN  20  21.364 -14.920 -16.245
  151   HD22  ASN  20          1HD2      ASN  20  22.334 -15.807 -15.086
  152    H    GLU  21           H        GLU  21  19.928 -10.758 -15.871
  153    HA   GLU  21           HA       GLU  21  17.225 -10.170 -16.667
  154    HB2  GLU  21           HB2      GLU  21  19.936  -9.134 -17.573
  155    HB3  GLU  21           HB3      GLU  21  18.386  -8.461 -18.114
  156    HG2  GLU  21           HG2      GLU  21  17.765  -7.875 -15.838
  157    HG3  GLU  21           HG3      GLU  21  19.128  -8.777 -15.191
  158    H    LYS  22           H        LYS  22  19.947 -11.940 -18.144
  159    HA   LYS  22           HA       LYS  22  18.969 -11.871 -20.818
  160    HB2  LYS  22           HB2      LYS  22  21.278 -12.566 -19.690
  161    HB3  LYS  22           HB3      LYS  22  20.571 -14.181 -19.689
  162    HG2  LYS  22           HG2      LYS  22  21.104 -12.377 -22.089
  163    HG3  LYS  22           HG3      LYS  22  21.984 -13.844 -21.631
  164    HD2  LYS  22           2HD      LYS  22  19.833 -15.147 -22.009
  165    HD3  LYS  22           3HD      LYS  22  19.128 -13.640 -22.649
  166    HE2  LYS  22           HE2      LYS  22  19.923 -14.965 -24.505
  167    HE3  LYS  22           HE3      LYS  22  20.931 -13.520 -24.342
  168    HZ1  LYS  22           3HZ      LYS  22  21.623 -16.209 -23.350
  169    HZ2  LYS  22           1HZ      LYS  22  22.238 -15.508 -24.700
  170    HZ3  LYS  22           2HZ      LYS  22  22.568 -14.864 -23.223
  171    H    ALA  23           H        ALA  23  18.188 -13.877 -17.995
  172    HA   ALA  23           HA       ALA  23  16.858 -15.910 -19.651
  173    HB1  ALA  23           1HB      ALA  23  16.426 -16.973 -17.453
  174    HB2  ALA  23           HB2      ALA  23  18.146 -16.569 -17.650
  175    HB3  ALA  23           HB3      ALA  23  17.107 -15.552 -16.632
  176    H    LEU  24           H        LEU  24  16.203 -12.952 -18.020
  177    HA   LEU  24           HA       LEU  24  13.368 -13.428 -17.542
  178    HB2  LEU  24           HB2      LEU  24  15.607 -11.649 -16.790
  179    HB3  LEU  24           HB3      LEU  24  14.171 -10.703 -17.068
  180    HG   LEU  24           HG       LEU  24  14.248 -13.221 -15.361
  181   HD11  LEU  24          1HD1      LEU  24  15.817 -11.607 -14.396
  182   HD12  LEU  24          2HD1      LEU  24  14.584 -10.324 -14.475
  183   HD13  LEU  24          3HD1      LEU  24  14.357 -11.720 -13.386
  184   HD21  LEU  24          3HD2      LEU  24  12.030 -12.415 -16.151
  185   HD22  LEU  24          1HD2      LEU  24  12.181 -12.289 -14.375
  186   HD23  LEU  24          2HD2      LEU  24  12.336 -10.837 -15.391
  187    H    GLU  25           H        GLU  25  15.525 -11.865 -19.850
  188    HA   GLU  25           HA       GLU  25  13.321 -10.563 -21.245
  189    HB2  GLU  25           HB2      GLU  25  16.246 -11.109 -21.979
  190    HB3  GLU  25           HB3      GLU  25  15.113 -10.267 -23.055
  191    HG2  GLU  25           HG2      GLU  25  14.634  -8.663 -21.254
  192    HG3  GLU  25           HG3      GLU  25  15.887  -9.408 -20.248
  193    H    ALA  26           H        ALA  26  15.021 -13.577 -21.252
  194    HA   ALA  26           HA       ALA  26  14.238 -14.420 -23.931
  195    HB1  ALA  26           1HB      ALA  26  15.370 -16.520 -23.217
  196    HB2  ALA  26           HB2      ALA  26  16.371 -15.074 -22.908
  197    HB3  ALA  26           HB3      ALA  26  15.493 -15.854 -21.569
  198    H    VAL  27           H        VAL  27  12.854 -14.551 -20.739
  199    HA   VAL  27           HA       VAL  27  11.125 -16.846 -21.467
  200    HB   VAL  27           HB       VAL  27  12.587 -16.738 -19.468
  201   HG11  VAL  27          1HG1      VAL  27  10.448 -14.962 -18.315
  202   HG12  VAL  27          HG21      VAL  27  11.964 -15.525 -17.548
  203   HG13  VAL  27          HG31      VAL  27  12.041 -14.368 -18.904
  204   HG21  VAL  27          HG32      VAL  27   9.593 -17.051 -18.984
  205   HG22  VAL  27          1HG2      VAL  27  10.681 -18.318 -19.625
  206   HG23  VAL  27          HG22      VAL  27  10.889 -17.714 -17.954
  207    H    PHE  28           H        PHE  28  11.008 -13.454 -20.410
  208    HA   PHE  28           HA       PHE  28   8.061 -13.482 -20.683
  209    HB2  PHE  28           HB2      PHE  28   9.971 -11.320 -19.764
  210    HB3  PHE  28           HB3      PHE  28   8.225 -11.104 -19.980
  211    HD1  PHE  28           HD2      PHE  28   6.595 -12.360 -18.596
  212    HD2  PHE  28           HD1      PHE  28  10.820 -12.519 -17.851
  213    HE1  PHE  28           HE2      PHE  28   6.163 -13.323 -16.354
  214    HE2  PHE  28           HE1      PHE  28  10.398 -13.492 -15.613
  215    HZ   PHE  28           HZ       PHE  28   8.065 -13.872 -14.853
  216    H    GLY  29           H        GLY  29  10.788 -12.956 -22.670
  217    HA2  GLY  29           2HA      GLY  29   9.537 -11.019 -24.456
  218    HA3  GLY  29           3HA      GLY  29  10.988 -11.983 -24.788
  219    H    LYS  30           H        LYS  30   8.831 -14.169 -23.691
  220    HA   LYS  30           HA       LYS  30   8.244 -15.235 -26.323
  221    HB2  LYS  30           HB2      LYS  30   7.486 -16.140 -23.495
  222    HB3  LYS  30           HB3      LYS  30   7.394 -17.133 -24.969
  223    HG2  LYS  30           HG2      LYS  30   9.814 -16.962 -25.261
  224    HG3  LYS  30           HG3      LYS  30   9.961 -15.888 -23.871
  225    HD2  LYS  30           2HD      LYS  30  10.630 -18.202 -23.304
  226    HD3  LYS  30           3HD      LYS  30   9.296 -17.610 -22.318
  227    HE2  LYS  30           HE2      LYS  30   8.855 -19.885 -22.941
  228    HE3  LYS  30           HE3      LYS  30   7.680 -18.825 -23.727
  229    HZ1  LYS  30           3HZ      LYS  30   8.987 -18.985 -25.747
  230    HZ2  LYS  30           1HZ      LYS  30  10.092 -19.956 -25.005
  231    HZ3  LYS  30           2HZ      LYS  30   8.552 -20.479 -25.240
  232    H    TYR  31           H        TYR  31   6.757 -13.098 -24.194
  233    HA   TYR  31           HA       TYR  31   4.022 -13.723 -25.217
  234    HB2  TYR  31           HB2      TYR  31   4.951 -12.235 -22.741
  235    HB3  TYR  31           HB3      TYR  31   3.268 -12.538 -23.183
  236    HD1  TYR  31           HD2      TYR  31   2.592 -15.059 -23.412
  237    HD2  TYR  31           HD1      TYR  31   6.177 -13.719 -21.461
  238    HE1  TYR  31           HE2      TYR  31   2.793 -17.263 -22.283
  239    HE2  TYR  31           HE1      TYR  31   6.384 -15.923 -20.309
  240    HH   TYR  31           HH       TYR  31   5.565 -18.091 -20.189
  241    H    GLY  32           H        GLY  32   6.566 -11.321 -25.290
  242    HA2  GLY  32           2HA      GLY  32   5.207  -9.714 -27.211
  243    HA3  GLY  32           3HA      GLY  32   5.086  -8.949 -25.599
  244    H    ARG  33           H        ARG  33   6.358  -7.695 -27.748
  245    HA   ARG  33           HA       ARG  33   9.180  -8.141 -27.595
  246    HB2  ARG  33           HB2      ARG  33   7.755  -7.074 -29.468
  247    HB3  ARG  33           HB3      ARG  33   7.785  -5.590 -28.479
  248    HG2  ARG  33           HG2      ARG  33  10.261  -5.693 -28.454
  249    HG3  ARG  33           HG3      ARG  33  10.174  -7.220 -29.377
  250    HD2  ARG  33           2HD      ARG  33   9.129  -4.523 -30.353
  251    HD3  ARG  33           3HD      ARG  33  10.707  -5.194 -30.785
  252    HE   ARG  33           HE       ARG  33   9.633  -6.966 -32.001
  253   HH11  ARG  33          1HH1      ARG  33   7.376  -4.463 -30.880
  254   HH12  ARG  33          2HH1      ARG  33   6.150  -4.914 -32.041
  255   HH21  ARG  33          1HH2      ARG  33   8.006  -7.506 -33.488
  256   HH22  ARG  33          2HH2      ARG  33   6.493  -6.625 -33.490
  257    H    ILE  34           H        ILE  34  10.353  -7.729 -25.939
  258    HA   ILE  34           HA       ILE  34   9.518  -6.019 -23.741
  259    HB   ILE  34           HB       ILE  34  12.086  -7.502 -24.376
  260   HG12  ILE  34          HG21      ILE  34   9.681  -8.004 -22.572
  261   HG13  ILE  34          HG31      ILE  34  10.142  -8.931 -24.000
  262   HG21  ILE  34          1HG2      ILE  34  12.763  -7.082 -22.080
  263   HG22  ILE  34          HG22      ILE  34  12.541  -5.539 -22.902
  264   HG23  ILE  34          HG32      ILE  34  11.286  -6.124 -21.777
  265   HD11  ILE  34          3HD1      ILE  34  12.255  -9.609 -22.857
  266   HD12  ILE  34          1HD1      ILE  34  11.682  -8.786 -21.381
  267   HD13  ILE  34          2HD1      ILE  34  10.784 -10.168 -22.024
  268    H    VAL  35           H        VAL  35  10.177  -4.019 -23.175
  269    HA   VAL  35           HA       VAL  35  11.904  -2.564 -25.116
  270    HB   VAL  35           HB       VAL  35  10.510  -0.787 -23.327
  271   HG11  VAL  35          1HG1      VAL  35  10.248  -1.314 -26.310
  272   HG12  VAL  35          HG21      VAL  35   9.725   0.152 -25.449
  273   HG13  VAL  35          HG31      VAL  35  11.455  -0.253 -25.536
  274   HG21  VAL  35          HG32      VAL  35   8.673  -2.669 -24.863
  275   HG22  VAL  35          1HG2      VAL  35   8.743  -2.463 -23.097
  276   HG23  VAL  35          HG22      VAL  35   8.197  -1.129 -24.130
  277    H    GLU  36           H        GLU  36  11.482  -3.624 -21.811
  278    HA   GLU  36           HA       GLU  36  14.218  -2.868 -21.169
  279    HB2  GLU  36           HB2      GLU  36  13.046  -0.736 -20.728
  280    HB3  GLU  36           HB3      GLU  36  11.874  -1.573 -19.700
  281    HG2  GLU  36           HG2      GLU  36  13.620  -2.171 -18.108
  282    HG3  GLU  36           HG3      GLU  36  14.867  -1.524 -19.195
  283    H    VAL  37           H        VAL  37  15.000  -4.049 -19.365
  284    HA   VAL  37           HA       VAL  37  13.001  -5.575 -17.813
  285    HB   VAL  37           HB       VAL  37  15.179  -6.760 -19.487
  286   HG11  VAL  37          1HG1      VAL  37  14.419  -7.900 -16.761
  287   HG12  VAL  37          HG21      VAL  37  15.368  -8.723 -18.016
  288   HG13  VAL  37          HG31      VAL  37  16.022  -7.278 -17.233
  289   HG21  VAL  37          HG32      VAL  37  12.767  -7.081 -19.977
  290   HG22  VAL  37          1HG2      VAL  37  13.497  -8.632 -19.490
  291   HG23  VAL  37          HG22      VAL  37  12.514  -7.726 -18.338
  292    H    LEU  38           H        LEU  38  13.477  -5.921 -15.742
  293    HA   LEU  38           HA       LEU  38  16.006  -4.726 -14.615
  294    HB2  LEU  38           HB2      LEU  38  13.140  -4.584 -13.949
  295    HB3  LEU  38           HB3      LEU  38  14.185  -4.785 -12.562
  296    HG   LEU  38           HG       LEU  38  14.421  -2.517 -14.598
  297   HD11  LEU  38          1HD1      LEU  38  13.714  -1.130 -12.670
  298   HD12  LEU  38          2HD1      LEU  38  12.477  -2.336 -13.086
  299   HD13  LEU  38          3HD1      LEU  38  13.541  -2.588 -11.677
  300   HD21  LEU  38          3HD2      LEU  38  16.642  -3.042 -13.689
  301   HD22  LEU  38          1HD2      LEU  38  16.010  -1.559 -12.943
  302   HD23  LEU  38          2HD2      LEU  38  15.962  -3.092 -12.042
  303    H    LEU  39           H        LEU  39  16.910  -5.833 -12.867
  304    HA   LEU  39           HA       LEU  39  15.613  -8.245 -11.923
  305    HB2  LEU  39           HB2      LEU  39  16.874  -9.030 -13.884
  306    HB3  LEU  39           HB3      LEU  39  18.332  -8.222 -13.314
  307    HG   LEU  39           HG       LEU  39  18.132 -10.751 -13.104
  308   HD11  LEU  39          1HD1      LEU  39  18.893  -9.201 -10.610
  309   HD12  LEU  39          2HD1      LEU  39  19.461 -10.815 -11.077
  310   HD13  LEU  39          3HD1      LEU  39  19.895  -9.411 -12.079
  311   HD21  LEU  39          3HD2      LEU  39  17.145 -11.668 -11.107
  312   HD22  LEU  39          1HD2      LEU  39  16.525 -10.071 -10.619
  313   HD23  LEU  39          2HD2      LEU  39  15.901 -10.864 -12.091
  314    H    MET  40           H        MET  40  15.835  -8.109  -9.725
  315    HA   MET  40           HA       MET  40  17.650  -5.960  -8.829
  316    HB2  MET  40           HB2      MET  40  15.511  -7.306  -7.161
  317    HB3  MET  40           HB3      MET  40  16.264  -5.728  -6.926
  318    HG2  MET  40           HG2      MET  40  14.067  -6.575  -8.761
  319    HG3  MET  40           HG3      MET  40  14.210  -5.124  -7.779
  320    HE1  MET  40           HE3      MET  40  15.802  -2.943  -8.638
  321    HE2  MET  40           HE1      MET  40  17.122  -4.119  -8.734
  322    HE3  MET  40           HE2      MET  40  16.759  -3.087 -10.143
  323    H    LYS  41           H        LYS  41  19.217  -6.198  -7.193
  324    HA   LYS  41           HA       LYS  41  19.477  -8.949  -6.173
  325    HB2  LYS  41           HB2      LYS  41  22.015  -7.605  -6.934
  326    HB3  LYS  41           HB3      LYS  41  21.537  -9.324  -6.811
  327    HG2  LYS  41           HG2      LYS  41  20.433  -9.224  -8.959
  328    HG3  LYS  41           HG3      LYS  41  20.651  -7.456  -9.049
  329    HD2  LYS  41           2HD      LYS  41  23.100  -7.741  -9.026
  330    HD3  LYS  41           3HD      LYS  41  22.904  -9.507  -8.967
  331    HE2  LYS  41           HE2      LYS  41  21.705  -9.451 -11.114
  332    HE3  LYS  41           HE3      LYS  41  21.856  -7.686 -11.168
  333    HZ1  LYS  41           3HZ      LYS  41  23.548  -8.776 -12.483
  334    HZ2  LYS  41           1HZ      LYS  41  24.241  -7.957 -11.236
  335    HZ3  LYS  41           2HZ      LYS  41  24.104  -9.594 -11.172
  336    H    ASP  42           H        ASP  42  20.821  -9.257  -4.383
  337    HA   ASP  42           HA       ASP  42  20.626  -7.304  -2.329
  338    HB2  ASP  42           HB2      ASP  42  20.838  -9.904  -2.248
  339    HB3  ASP  42           HB3      ASP  42  22.568  -9.621  -2.436
  340    H    ARG  43           H        ARG  43  22.157  -5.881  -1.470
  341    HA   ARG  43           HA       ARG  43  24.289  -5.121  -3.351
  342    HB2  ARG  43           HB2      ARG  43  24.430  -3.086  -2.011
  343    HB3  ARG  43           HB3      ARG  43  22.775  -3.411  -2.569
  344    HG2  ARG  43           HG2      ARG  43  22.219  -4.363  -0.342
  345    HG3  ARG  43           HG3      ARG  43  23.866  -3.990   0.223
  346    HD2  ARG  43           2HD      ARG  43  21.892  -1.946  -0.862
  347    HD3  ARG  43           3HD      ARG  43  22.158  -2.273   0.866
  348    HE   ARG  43           HE       ARG  43  24.687  -1.734  -0.068
  349   HH11  ARG  43          1HH1      ARG  43  21.610   0.000  -0.190
  350   HH12  ARG  43          2HH1      ARG  43  22.368   1.579  -0.195
  351   HH21  ARG  43          1HH2      ARG  43  25.645   0.326  -0.077
  352   HH22  ARG  43          2HH2      ARG  43  24.644   1.759  -0.132
  353    H    GLU  44           H        GLU  44  24.103  -7.223  -0.795
  354    HA   GLU  44           HA       GLU  44  26.931  -6.709   0.024
  355    HB2  GLU  44           HB2      GLU  44  24.683  -8.124   1.498
  356    HB3  GLU  44           HB3      GLU  44  26.345  -7.942   2.084
  357    HG2  GLU  44           HG2      GLU  44  24.384  -5.681   1.520
  358    HG3  GLU  44           HG3      GLU  44  24.841  -6.290   3.116
  359    H    THR  45           H        THR  45  24.838  -8.885  -1.664
  360    HA   THR  45           HA       THR  45  27.010 -10.927  -1.583
  361    HB   THR  45           HB       THR  45  25.453 -12.715  -1.554
  362    HG1  THR  45           1HG      THR  45  23.216 -12.299  -1.544
  363   HG21  THR  45          1HG2      THR  45  25.907 -11.581   0.633
  364   HG22  THR  45          HG22      THR  45  24.406 -10.643   0.406
  365   HG23  THR  45          HG32      THR  45  24.330 -12.414   0.577
  366    H    ASN  46           H        ASN  46  24.924  -8.926  -3.473
  367    HA   ASN  46           HA       ASN  46  24.736  -8.668  -5.730
  368    HB2  ASN  46           HB2      ASN  46  27.417 -10.052  -5.512
  369    HB3  ASN  46           HB3      ASN  46  26.794  -9.424  -7.046
  370   HD21  ASN  46          2HD2      ASN  46  29.109  -8.353  -6.414
  371   HD22  ASN  46          1HD2      ASN  46  28.947  -6.749  -5.726
  372    H    LYS  47           H        LYS  47  23.765 -11.246  -4.407
  373    HA   LYS  47           HA       LYS  47  23.640 -13.207  -6.567
  374    HB2  LYS  47           HB2      LYS  47  22.205 -12.827  -3.910
  375    HB3  LYS  47           HB3      LYS  47  21.909 -14.201  -4.983
  376    HG2  LYS  47           HG2      LYS  47  24.658 -13.482  -3.887
  377    HG3  LYS  47           HG3      LYS  47  23.551 -14.654  -3.135
  378    HD2  LYS  47           2HD      LYS  47  23.547 -15.959  -5.277
  379    HD3  LYS  47           3HD      LYS  47  24.760 -14.833  -5.930
  380    HE2  LYS  47           HE2      LYS  47  26.276 -15.384  -4.048
  381    HE3  LYS  47           HE3      LYS  47  25.076 -16.530  -3.427
  382    HZ1  LYS  47           3HZ      LYS  47  26.389 -16.710  -6.057
  383    HZ2  LYS  47           1HZ      LYS  47  26.752 -17.626  -4.743
  384    HZ3  LYS  47           2HZ      LYS  47  25.283 -17.769  -5.467
  385    H    SER  48           H        SER  48  20.589 -12.990  -5.381
  386    HA   SER  48           HA       SER  48  19.615 -10.803  -7.111
  387    HB2  SER  48           HB2      SER  48  18.645 -13.692  -7.065
  388    HB3  SER  48           HB3      SER  48  17.714 -12.335  -7.729
  389    HG   SER  48           HG       SER  48  18.952 -13.411  -9.332
  390    H    ARG  49           H        ARG  49  17.771  -9.788  -6.170
  391    HA   ARG  49           HA       ARG  49  17.249 -10.221  -3.354
  392    HB2  ARG  49           HB2      ARG  49  15.618  -8.809  -5.509
  393    HB3  ARG  49           HB3      ARG  49  15.341  -8.685  -3.760
  394    HG2  ARG  49           HG2      ARG  49  17.974  -7.912  -5.021
  395    HG3  ARG  49           HG3      ARG  49  16.629  -6.767  -4.966
  396    HD2  ARG  49           2HD      ARG  49  17.927  -8.073  -2.550
  397    HD3  ARG  49           3HD      ARG  49  18.183  -6.413  -3.140
  398    HE   ARG  49           HE       ARG  49  15.813  -7.463  -1.732
  399   HH11  ARG  49          1HH1      ARG  49  17.290  -4.771  -3.493
  400   HH12  ARG  49          2HH1      ARG  49  16.166  -3.595  -2.875
  401   HH21  ARG  49          1HH2      ARG  49  14.342  -5.911  -0.957
  402   HH22  ARG  49          2HH2      ARG  49  14.499  -4.237  -1.441
  403    H    GLY  50           H        GLY  50  16.437 -11.892  -6.144
  404    HA2  GLY  50           2HA      GLY  50  15.075 -13.767  -6.396
  405    HA3  GLY  50           3HA      GLY  50  14.323 -13.443  -4.820
  406    H    PHE  51           H        PHE  51  14.280 -10.491  -6.512
  407    HA   PHE  51           HA       PHE  51  11.860 -11.224  -8.045
  408    HB2  PHE  51           HB2      PHE  51  10.582  -9.434  -7.209
  409    HB3  PHE  51           HB3      PHE  51  11.148 -10.369  -5.830
  410    HD1  PHE  51           HD2      PHE  51  12.967  -9.441  -4.359
  411    HD2  PHE  51           HD1      PHE  51  11.172  -7.149  -7.523
  412    HE1  PHE  51           HE2      PHE  51  13.835  -7.337  -3.341
  413    HE2  PHE  51           HE1      PHE  51  12.002  -5.056  -6.465
  414    HZ   PHE  51           HZ       PHE  51  13.399  -5.158  -4.453
  415    H    ALA  52           H        ALA  52  11.227  -9.561  -9.618
  416    HA   ALA  52           HA       ALA  52  13.362  -7.753 -10.534
  417    HB1  ALA  52           1HB      ALA  52  12.449 -10.201 -12.115
  418    HB2  ALA  52           HB2      ALA  52  13.586  -8.959 -12.680
  419    HB3  ALA  52           HB3      ALA  52  14.026 -10.024 -11.320
  420    H    PHE  53           H        PHE  53  12.611  -7.017 -12.925
  421    HA   PHE  53           HA       PHE  53   9.666  -6.821 -13.087
  422    HB2  PHE  53           HB2      PHE  53  11.513  -4.387 -13.095
  423    HB3  PHE  53           HB3      PHE  53   9.809  -4.366 -13.454
  424    HD1  PHE  53           HD1      PHE  53  12.351  -5.007 -10.855
  425    HD2  PHE  53           HD2      PHE  53   8.205  -4.260 -11.678
  426    HE1  PHE  53           HE1      PHE  53  11.940  -4.686  -8.434
  427    HE2  PHE  53           HE2      PHE  53   7.780  -3.929  -9.248
  428    HZ   PHE  53           HZ       PHE  53   9.639  -4.170  -7.624
  429    H    VAL  54           H        VAL  54   8.978  -5.956 -15.216
  430    HA   VAL  54           HA       VAL  54  11.007  -5.844 -17.334
  431    HB   VAL  54           HB       VAL  54  10.626  -8.271 -17.200
  432   HG11  VAL  54          1HG1      VAL  54   8.605  -9.329 -17.478
  433   HG12  VAL  54          HG21      VAL  54   8.673  -8.324 -16.007
  434   HG13  VAL  54          HG31      VAL  54   7.732  -7.750 -17.440
  435   HG21  VAL  54          HG32      VAL  54  10.703  -7.124 -19.517
  436   HG22  VAL  54          1HG2      VAL  54   9.883  -8.704 -19.466
  437   HG23  VAL  54          HG22      VAL  54   8.931  -7.201 -19.507
  438    H    THR  55           H        THR  55  10.323  -4.659 -19.079
  439    HA   THR  55           HA       THR  55   7.518  -3.643 -18.942
  440    HB   THR  55           HB       THR  55   9.943  -2.219 -20.085
  441    HG1  THR  55           1HG      THR  55   9.985  -2.332 -17.819
  442   HG21  THR  55          1HG2      THR  55   8.332  -0.291 -20.091
  443   HG22  THR  55          HG22      THR  55   7.840  -1.593 -21.190
  444   HG23  THR  55          HG32      THR  55   7.034  -1.419 -19.619
  445    H    PHE  56           H        PHE  56   6.245  -4.305 -20.500
  446    HA   PHE  56           HA       PHE  56   7.326  -5.411 -23.010
  447    HB2  PHE  56           HB2      PHE  56   4.587  -5.263 -21.722
  448    HB3  PHE  56           HB3      PHE  56   4.854  -5.890 -23.345
  449    HD1  PHE  56           HD1      PHE  56   6.342  -6.434 -19.884
  450    HD2  PHE  56           HD2      PHE  56   4.997  -8.111 -23.613
  451    HE1  PHE  56           HE1      PHE  56   6.860  -8.700 -19.056
  452    HE2  PHE  56           HE2      PHE  56   5.449 -10.380 -22.757
  453    HZ   PHE  56           HZ       PHE  56   6.333 -10.689 -20.450
  454    H    GLU  57           H        GLU  57   6.603  -4.705 -25.128
  455    HA   GLU  57           HA       GLU  57   6.137  -1.883 -25.424
  456    HB2  GLU  57           HB2      GLU  57   6.260  -4.313 -27.226
  457    HB3  GLU  57           HB3      GLU  57   5.644  -2.767 -27.811
  458    HG2  GLU  57           HG2      GLU  57   7.792  -1.703 -26.905
  459    HG3  GLU  57           HG3      GLU  57   8.427  -3.354 -26.746
  460    H    SER  58           H        SER  58   4.023  -4.727 -25.060
  461    HA   SER  58           HA       SER  58   1.714  -2.881 -25.517
  462    HB2  SER  58           HB2      SER  58   1.710  -4.555 -27.255
  463    HB3  SER  58           HB3      SER  58   2.005  -5.851 -26.070
  464    HG   SER  58           HG       SER  58  -0.214  -5.635 -26.697
  465    HA   PRO  59           HA       PRO  59   0.934  -3.578 -21.277
  466    HB2  PRO  59           HB2      PRO  59  -1.631  -2.736 -21.082
  467    HB3  PRO  59           HB3      PRO  59  -0.312  -1.580 -21.505
  468    HG2  PRO  59           HG2      PRO  59  -2.150  -3.095 -23.378
  469    HG3  PRO  59           HG3      PRO  59  -1.894  -1.320 -23.314
  470    HD2  PRO  59           2HD      PRO  59  -0.476  -2.851 -25.056
  471    HD3  PRO  59           3HD      PRO  59   0.367  -1.561 -24.143
  472    H    ALA  60           H        ALA  60  -0.571  -5.303 -23.871
  473    HA   ALA  60           HA       ALA  60  -2.025  -7.034 -21.939
  474    HB1  ALA  60           1HB      ALA  60  -2.533  -6.579 -24.897
  475    HB2  ALA  60           HB2      ALA  60  -3.456  -7.663 -23.822
  476    HB3  ALA  60           HB3      ALA  60  -3.478  -5.905 -23.542
  477    H    ASP  61           H        ASP  61   0.648  -6.871 -24.158
  478    HA   ASP  61           HA       ASP  61   0.952  -9.750 -24.423
  479    HB2  ASP  61           HB2      ASP  61   2.899  -7.395 -24.565
  480    HB3  ASP  61           HB3      ASP  61   3.378  -9.030 -24.785
  481    H    ALA  62           H        ALA  62   1.603  -7.246 -22.037
  482    HA   ALA  62           HA       ALA  62   3.187  -8.932 -20.286
  483    HB1  ALA  62           1HB      ALA  62   1.693  -6.314 -19.847
  484    HB2  ALA  62           HB2      ALA  62   2.816  -7.075 -18.694
  485    HB3  ALA  62           HB3      ALA  62   3.410  -6.500 -20.282
  486    H    LYS  63           H        LYS  63  -0.280  -8.122 -20.702
  487    HA   LYS  63           HA       LYS  63  -1.171  -9.390 -18.264
  488    HB2  LYS  63           HB2      LYS  63  -2.542  -8.876 -20.937
  489    HB3  LYS  63           HB3      LYS  63  -3.364  -9.564 -19.530
  490    HG2  LYS  63           HG2      LYS  63  -2.941  -7.573 -18.208
  491    HG3  LYS  63           HG3      LYS  63  -1.928  -6.891 -19.494
  492    HD2  LYS  63           2HD      LYS  63  -4.174  -5.859 -19.478
  493    HD3  LYS  63           3HD      LYS  63  -3.884  -6.729 -20.984
  494    HE2  LYS  63           HE2      LYS  63  -5.137  -8.686 -20.087
  495    HE3  LYS  63           HE3      LYS  63  -5.416  -7.806 -18.575
  496    HZ1  LYS  63           3HZ      LYS  63  -6.377  -6.991 -21.236
  497    HZ2  LYS  63           1HZ      LYS  63  -7.295  -7.638 -20.040
  498    HZ3  LYS  63           2HZ      LYS  63  -6.619  -6.154 -19.838
  499    H    ASP  64           H        ASP  64  -0.557 -10.512 -21.619
  500    HA   ASP  64           HA       ASP  64  -1.727 -13.085 -21.227
  501    HB2  ASP  64           HB2      ASP  64  -1.198 -11.872 -23.407
  502    HB3  ASP  64           HB3      ASP  64   0.506 -12.250 -23.129
  503    H    ALA  65           H        ALA  65   1.525 -11.765 -20.724
  504    HA   ALA  65           HA       ALA  65   2.705 -14.333 -20.061
  505    HB1  ALA  65           1HB      ALA  65   4.596 -13.043 -19.299
  506    HB2  ALA  65           HB2      ALA  65   4.001 -12.288 -20.795
  507    HB3  ALA  65           HB3      ALA  65   3.623 -11.551 -19.225
  508    H    ALA  66           H        ALA  66   1.313 -11.588 -18.188
  509    HA   ALA  66           HA       ALA  66   1.917 -12.779 -15.653
  510    HB1  ALA  66           1HB      ALA  66  -0.075 -10.592 -16.423
  511    HB2  ALA  66           HB2      ALA  66   0.576 -10.894 -14.790
  512    HB3  ALA  66           HB3      ALA  66   1.638 -10.319 -16.102
  513    H    ARG  67           H        ARG  67  -0.374 -13.557 -17.990
  514    HA   ARG  67           HA       ARG  67  -2.172 -14.893 -16.028
  515    HB2  ARG  67           HB2      ARG  67  -2.440 -14.200 -18.969
  516    HB3  ARG  67           HB3      ARG  67  -3.598 -15.228 -18.107
  517    HG2  ARG  67           HG2      ARG  67  -4.184 -13.479 -16.583
  518    HG3  ARG  67           HG3      ARG  67  -2.864 -12.438 -17.127
  519    HD2  ARG  67           2HD      ARG  67  -4.957 -11.668 -18.078
  520    HD3  ARG  67           3HD      ARG  67  -3.919 -12.274 -19.370
  521    HE   ARG  67           HE       ARG  67  -5.395 -14.049 -19.749
  522   HH11  ARG  67          1HH1      ARG  67  -6.322 -12.330 -16.803
  523   HH12  ARG  67          2HH1      ARG  67  -7.863 -13.145 -16.674
  524   HH21  ARG  67          1HH2      ARG  67  -7.409 -15.085 -19.566
  525   HH22  ARG  67          2HH2      ARG  67  -8.475 -14.705 -18.234
  526    H    ASP  68           H        ASP  68   0.713 -15.703 -17.473
  527    HA   ASP  68           HA       ASP  68  -0.183 -18.488 -18.086
  528    HB2  ASP  68           HB2      ASP  68   1.402 -16.431 -19.554
  529    HB3  ASP  68           HB3      ASP  68   2.183 -17.965 -19.404
  530    H    MET  69           H        MET  69   2.515 -16.322 -17.394
  531    HA   MET  69           HA       MET  69   4.226 -18.380 -16.290
  532    HB2  MET  69           HB2      MET  69   4.281 -15.505 -17.140
  533    HB3  MET  69           HB3      MET  69   5.407 -15.934 -15.901
  534    HG2  MET  69           HG2      MET  69   5.033 -17.269 -18.613
  535    HG3  MET  69           HG3      MET  69   6.360 -16.183 -18.179
  536    HE1  MET  69           HE3      MET  69   8.338 -18.261 -15.560
  537    HE2  MET  69           HE1      MET  69   8.014 -16.671 -16.308
  538    HE3  MET  69           HE2      MET  69   6.845 -17.382 -15.160
  539    H    ASN  70           H        ASN  70   1.740 -16.365 -14.967
  540    HA   ASN  70           HA       ASN  70   3.011 -15.899 -12.416
  541    HB2  ASN  70           HB2      ASN  70   1.155 -14.517 -13.335
  542    HB3  ASN  70           HB3      ASN  70   0.070 -15.902 -13.204
  543   HD21  ASN  70          2HD2      ASN  70  -1.219 -14.415 -11.837
  544   HD22  ASN  70          1HD2      ASN  70  -0.806 -14.263 -10.143
  545    H    GLY  71           H        GLY  71   3.286 -17.288 -10.776
  546    HA2  GLY  71           2HA      GLY  71   2.733 -18.962  -9.265
  547    HA3  GLY  71           3HA      GLY  71   1.387 -19.470 -10.312
  548    H    LYS  72           H        LYS  72   3.778 -19.292 -12.540
  549    HA   LYS  72           HA       LYS  72   4.518 -22.100 -12.424
  550    HB2  LYS  72           HB2      LYS  72   5.431 -19.861 -14.234
  551    HB3  LYS  72           HB3      LYS  72   5.476 -21.595 -14.548
  552    HG2  LYS  72           HG2      LYS  72   2.949 -19.918 -14.332
  553    HG3  LYS  72           HG3      LYS  72   3.657 -20.599 -15.815
  554    HD2  LYS  72           2HD      LYS  72   3.313 -22.887 -14.912
  555    HD3  LYS  72           3HD      LYS  72   2.570 -22.198 -13.449
  556    HE2  LYS  72           HE2      LYS  72   0.831 -21.122 -14.844
  557    HE3  LYS  72           HE3      LYS  72   1.568 -21.804 -16.299
  558    HZ1  LYS  72           3HZ      LYS  72   0.422 -23.362 -14.077
  559    HZ2  LYS  72           1HZ      LYS  72  -0.264 -23.131 -15.555
  560    HZ3  LYS  72           2HZ      LYS  72   1.130 -23.995 -15.420
  561    H    SER  73           H        SER  73   7.040 -21.685 -13.639
  562    HA   SER  73           HA       SER  73   8.735 -20.704 -11.381
  563    HB2  SER  73           HB2      SER  73   8.189 -23.115 -11.193
  564    HB3  SER  73           HB3      SER  73   8.860 -23.390 -12.807
  565    HG   SER  73           HG       SER  73  10.383 -23.808 -11.127
  566    H    LEU  74           H        LEU  74  10.866 -20.253 -11.894
  567    HA   LEU  74           HA       LEU  74  11.101 -19.424 -14.753
  568    HB2  LEU  74           HB2      LEU  74  11.367 -17.817 -12.593
  569    HB3  LEU  74           HB3      LEU  74  12.969 -18.470 -12.590
  570    HG   LEU  74           HG       LEU  74  12.952 -16.409 -13.814
  571   HD11  LEU  74          1HD1      LEU  74  13.904 -16.995 -15.933
  572   HD12  LEU  74          2HD1      LEU  74  14.438 -18.176 -14.726
  573   HD13  LEU  74          3HD1      LEU  74  13.160 -18.604 -15.898
  574   HD21  LEU  74          3HD2      LEU  74  10.485 -16.609 -14.388
  575   HD22  LEU  74          1HD2      LEU  74  11.516 -15.980 -15.694
  576   HD23  LEU  74          2HD2      LEU  74  10.957 -17.673 -15.737
  577    H    ASP  75           H        ASP  75  13.335 -20.394 -12.171
  578    HA   ASP  75           HA       ASP  75  14.859 -21.975 -14.179
  579    HB2  ASP  75           HB2      ASP  75  15.863 -19.681 -13.162
  580    HB3  ASP  75           HB3      ASP  75  15.981 -20.584 -11.726
  581    H    GLY  76           H        GLY  76  12.705 -22.531 -12.150
  582    HA2  GLY  76           2HA      GLY  76  12.576 -24.866 -11.403
  583    HA3  GLY  76           3HA      GLY  76  14.172 -24.644 -10.639
  584    H    LYS  77           H        LYS  77  12.852 -21.717 -10.254
  585    HA   LYS  77           HA       LYS  77  11.677 -22.366  -7.604
  586    HB2  LYS  77           HB2      LYS  77  13.072 -19.816  -8.460
  587    HB3  LYS  77           HB3      LYS  77  12.504 -20.233  -6.834
  588    HG2  LYS  77           HG2      LYS  77  14.675 -21.643  -8.436
  589    HG3  LYS  77           HG3      LYS  77  14.931 -20.606  -7.029
  590    HD2  LYS  77           2HD      LYS  77  13.958 -22.184  -5.533
  591    HD3  LYS  77           3HD      LYS  77  13.278 -23.166  -6.848
  592    HE2  LYS  77           HE2      LYS  77  15.465 -23.754  -7.663
  593    HE3  LYS  77           HE3      LYS  77  16.249 -22.745  -6.427
  594    HZ1  LYS  77           3HZ      LYS  77  16.190 -25.050  -5.787
  595    HZ2  LYS  77           1HZ      LYS  77  15.261 -24.163  -4.755
  596    HZ3  LYS  77           2HZ      LYS  77  14.554 -25.098  -5.905
  597    H    ALA  78           H        ALA  78   9.680 -21.669  -7.152
  598    HA   ALA  78           HA       ALA  78   8.107 -20.917  -9.463
  599    HB1  ALA  78           1HB      ALA  78   7.293 -21.341  -6.576
  600    HB2  ALA  78           HB2      ALA  78   6.195 -21.194  -7.979
  601    HB3  ALA  78           HB3      ALA  78   7.315 -22.571  -7.865
  602    H    ILE  79           H        ILE  79   7.070 -19.050  -9.931
  603    HA   ILE  79           HA       ILE  79   7.869 -16.711  -8.263
  604    HB   ILE  79           HB       ILE  79   8.064 -15.422 -10.269
  605   HG12  ILE  79          HG21      ILE  79   7.274 -17.894 -11.865
  606   HG13  ILE  79          HG31      ILE  79   6.188 -16.533 -11.520
  607   HG21  ILE  79          1HG2      ILE  79   9.952 -16.516 -11.344
  608   HG22  ILE  79          HG22      ILE  79  10.011 -16.813  -9.591
  609   HG23  ILE  79          HG32      ILE  79   9.459 -18.096 -10.692
  610   HD11  ILE  79          3HD1      ILE  79   7.085 -16.112 -13.675
  611   HD12  ILE  79          1HD1      ILE  79   7.901 -15.000 -12.570
  612   HD13  ILE  79          2HD1      ILE  79   8.751 -16.461 -13.141
  613    H    LYS  80           H        LYS  80   6.679 -14.747  -8.772
  614    HA   LYS  80           HA       LYS  80   3.753 -15.120  -9.220
  615    HB2  LYS  80           HB2      LYS  80   4.470 -14.314  -6.916
  616    HB3  LYS  80           HB3      LYS  80   5.246 -12.935  -7.704
  617    HG2  LYS  80           HG2      LYS  80   2.966 -12.372  -8.731
  618    HG3  LYS  80           HG3      LYS  80   2.273 -13.583  -7.631
  619    HD2  LYS  80           2HD      LYS  80   3.266 -12.325  -5.704
  620    HD3  LYS  80           3HD      LYS  80   3.901 -11.121  -6.857
  621    HE2  LYS  80           HE2      LYS  80   1.570 -10.677  -7.623
  622    HE3  LYS  80           HE3      LYS  80   0.977 -11.788  -6.379
  623    HZ1  LYS  80           3HZ      LYS  80   2.530  -9.322  -5.899
  624    HZ2  LYS  80           1HZ      LYS  80   0.923  -9.507  -5.650
  625    HZ3  LYS  80           2HZ      LYS  80   2.007 -10.347  -4.730
  626    H    VAL  81           H        VAL  81   2.876 -13.829 -10.880
  627    HA   VAL  81           HA       VAL  81   4.646 -11.700 -11.964
  628    HB   VAL  81           HB       VAL  81   3.052 -13.636 -13.681
  629   HG11  VAL  81          1HG1      VAL  81   4.991 -11.387 -14.384
  630   HG12  VAL  81          HG21      VAL  81   4.163 -12.467 -15.534
  631   HG13  VAL  81          HG31      VAL  81   3.222 -11.310 -14.568
  632   HG21  VAL  81          HG32      VAL  81   5.305 -14.354 -14.471
  633   HG22  VAL  81          1HG2      VAL  81   6.050 -13.327 -13.227
  634   HG23  VAL  81          HG22      VAL  81   5.054 -14.729 -12.759
  635    H    GLU  82           H        GLU  82   3.662  -9.798 -12.114
  636    HA   GLU  82           HA       GLU  82   0.741  -9.573 -12.304
  637    HB2  GLU  82           HB2      GLU  82   1.278 -10.139  -9.896
  638    HB3  GLU  82           HB3      GLU  82   2.244  -8.663  -9.811
  639    HG2  GLU  82           HG2      GLU  82   0.245  -7.295 -10.226
  640    HG3  GLU  82           HG3      GLU  82  -0.722  -8.755 -10.496
  641    H    GLN  83           H        GLN  83   0.116  -7.191 -12.463
  642    HA   GLN  83           HA       GLN  83   2.101  -5.601 -13.799
  643    HB2  GLN  83           HB2      GLN  83  -0.209  -5.171 -14.267
  644    HB3  GLN  83           HB3      GLN  83  -0.609  -5.068 -12.545
  645    HG2  GLN  83           HG2      GLN  83  -0.656  -2.862 -13.475
  646    HG3  GLN  83           HG3      GLN  83   0.674  -2.986 -12.320
  647   HE21  GLN  83          HE22      GLN  83   2.126  -1.539 -13.011
  648   HE22  GLN  83          HE12      GLN  83   2.746  -1.422 -14.644
  649    H    ALA  84           H        ALA  84   3.522  -4.101 -12.991
  650    HA   ALA  84           HA       ALA  84   4.277  -4.533 -10.243
  651    HB1  ALA  84           1HB      ALA  84   6.142  -3.032 -10.804
  652    HB2  ALA  84           HB2      ALA  84   5.914  -4.268 -12.066
  653    HB3  ALA  84           HB3      ALA  84   5.343  -2.594 -12.326
  654    H    THR  85           H        THR  85   4.490  -3.032  -8.576
  655    HA   THR  85           HA       THR  85   3.047  -0.443  -8.926
  656    HB   THR  85           HB       THR  85   2.748  -0.407  -6.514
  657    HG1  THR  85           1HG      THR  85   3.124  -2.332  -5.348
  658   HG21  THR  85          1HG2      THR  85   1.637  -2.966  -7.774
  659   HG22  THR  85          HG22      THR  85   0.937  -2.088  -6.392
  660   HG23  THR  85          HG32      THR  85   0.962  -1.335  -8.002
  661    H    LYS  86           H        LYS  86   3.913   1.189  -7.268
  662    HA   LYS  86           HA       LYS  86   6.627   1.657  -8.106
  663    HB2  LYS  86           HB2      LYS  86   4.784   3.189  -6.228
  664    HB3  LYS  86           HB3      LYS  86   6.274   3.809  -6.976
  665    HG2  LYS  86           HG2      LYS  86   5.261   3.190  -9.237
  666    HG3  LYS  86           HG3      LYS  86   3.742   2.852  -8.392
  667    HD2  LYS  86           2HD      LYS  86   3.777   5.239  -7.548
  668    HD3  LYS  86           3HD      LYS  86   5.174   5.515  -8.628
  669    HE2  LYS  86           HE2      LYS  86   3.744   4.560 -10.512
  670    HE3  LYS  86           HE3      LYS  86   2.377   4.589  -9.387
  671    HZ1  LYS  86           3HZ      LYS  86   3.950   6.937 -10.219
  672    HZ2  LYS  86           1HZ      LYS  86   2.427   6.568 -10.728
  673    HZ3  LYS  86           2HZ      LYS  86   2.702   6.967  -9.156
  674    HA   PRO  87           HA       PRO  87   8.907  -0.011  -4.805
  675    HB2  PRO  87           HB2      PRO  87  11.026   1.700  -4.539
  676    HB3  PRO  87           HB3      PRO  87  10.797   0.631  -5.952
  677    HG2  PRO  87           HG2      PRO  87   9.993   3.549  -5.700
  678    HG3  PRO  87           HG3      PRO  87  10.936   2.773  -7.020
  679    HD2  PRO  87           2HD      PRO  87   8.271   3.179  -7.260
  680    HD3  PRO  87           3HD      PRO  87   9.004   1.650  -7.842
  681    H    SER  88           H        SER  88   9.512   0.257  -2.569
  682    HA   SER  88           HA       SER  88   7.515   1.849  -1.199
  683    HB2  SER  88           HB2      SER  88   8.035  -0.535  -0.690
  684    HB3  SER  88           HB3      SER  88   9.643  -0.039  -0.121
  685    HG   SER  88           HG       SER  88   8.108  -0.223   1.580
  686    H    PHE  89           H        PHE  89  10.805   2.407  -2.057
  687    HA   PHE  89           HA       PHE  89  11.196   4.251   0.217
  688    HB2  PHE  89           HB2      PHE  89  13.468   4.505  -0.593
  689    HB3  PHE  89           HB3      PHE  89  13.059   2.827  -0.216
  690    HD1  PHE  89           HD2      PHE  89  12.659   1.200  -2.106
  691    HD2  PHE  89           HD1      PHE  89  14.153   5.178  -2.766
  692    HE1  PHE  89           HE2      PHE  89  13.533   0.502  -4.295
  693    HE2  PHE  89           HE1      PHE  89  15.013   4.481  -4.994
  694    HZ   PHE  89           HZ       PHE  89  14.706   2.139  -5.757
  695    H    GLU  90           H        GLU  90   9.253   4.650  -2.084
  696    HA   GLU  90           HA       GLU  90  10.204   7.370  -2.808
  697    HB2  GLU  90           HB2      GLU  90  10.591   5.533  -4.603
  698    HB3  GLU  90           HB3      GLU  90   8.827   5.550  -4.798
  699    HG2  GLU  90           HG2      GLU  90   8.960   8.018  -5.243
  700    HG3  GLU  90           HG3      GLU  90  10.721   7.920  -5.024
  701    H    SER  91           H        SER  91   8.528   8.820  -3.470
  702    HA   SER  91           HA       SER  91   6.181   8.442  -1.769
  703    HB2  SER  91           HB2      SER  91   7.719  10.437  -1.769
  704    HB3  SER  91           HB3      SER  91   7.041  10.885  -3.348
  705    HG   SER  91           HG       SER  91   5.951  11.884  -1.568
  706    H    GLY  92           H        GLY  92   6.740   7.347  -4.732
  707    HA2  GLY  92           2HA      GLY  92   5.168   6.458  -6.186
  708    HA3  GLY  92           3HA      GLY  92   3.907   7.478  -5.472
  709    H    ARG  93           H        ARG  93   6.518   9.501  -6.132
  710    HA   ARG  93           HA       ARG  93   5.946   9.822  -8.991
  711    HB2  ARG  93           HB2      ARG  93   5.070  11.944  -8.940
  712    HB3  ARG  93           HB3      ARG  93   4.278  11.219  -7.544
  713    HG2  ARG  93           HG2      ARG  93   6.688  13.091  -7.542
  714    HG3  ARG  93           HG3      ARG  93   5.047  13.489  -7.045
  715    HD2  ARG  93           2HD      ARG  93   6.853  11.457  -5.674
  716    HD3  ARG  93           3HD      ARG  93   6.577  13.109  -5.123
  717    HE   ARG  93           HE       ARG  93   4.758  10.835  -4.849
  718   HH11  ARG  93          1HH1      ARG  93   4.990  14.366  -4.874
  719   HH12  ARG  93          2HH1      ARG  93   3.530  14.576  -3.939
  720   HH21  ARG  93          1HH2      ARG  93   2.884  11.139  -3.639
  721   HH22  ARG  93          2HH2      ARG  93   2.329  12.755  -3.253
  722    H    ARG  94           H        ARG  94   7.425  11.401 -10.031
  723    HA   ARG  94           HA       ARG  94   9.713  12.376  -8.536
  724    HB2  ARG  94           HB2      ARG  94  10.257   9.991  -8.742
  725    HB3  ARG  94           HB3      ARG  94  10.062  10.077 -10.504
  726    HG2  ARG  94           HG2      ARG  94  11.942  11.667 -10.653
  727    HG3  ARG  94           HG3      ARG  94  12.109  11.660  -8.883
  728    HD2  ARG  94           2HD      ARG  94  12.394   9.230 -10.694
  729    HD3  ARG  94           3HD      ARG  94  13.748  10.169 -10.052
  730    HE   ARG  94           HE       ARG  94  12.008   8.301  -8.568
  731   HH11  ARG  94          1HH1      ARG  94  14.543  10.765  -8.388
  732   HH12  ARG  94          2HH1      ARG  94  15.064  10.260  -6.796
  733   HH21  ARG  94          1HH2      ARG  94  12.697   7.680  -6.548
  734   HH22  ARG  94          2HH2      ARG  94  14.022   8.507  -5.743
  735    H    GLY  95           H        GLY  95  10.997  13.809  -9.785
  736    HA2  GLY  95           2HA      GLY  95   9.594  15.188 -11.877
  737    HA3  GLY  95           3HA      GLY  95  11.239  15.512 -11.306
  738    H5'    A  96           H5'        A  96   4.732 -16.523   1.401
  739   H5''    A  96          H5''        A  96   4.197 -15.865  -0.149
  740    H4'    A  96           H4'        A  96   3.694 -18.729   0.832
  741    H3'    A  96           H3'        A  96   5.957 -17.449  -0.595
  742    H2'    A  96           H2'        A  96   5.834 -18.702  -2.602
  743   HO2'    A  96          HO2'        A  96   5.458 -20.734  -1.500
  744    H1'    A  96           H1'        A  96   3.193 -18.648  -3.020
  745    H8     A  96           H8         A  96   2.607 -15.551  -1.657
  746    H61    A  96           H61        A  96   6.651 -12.674  -5.378
  747    H62    A  96           H62        A  96   5.318 -12.438  -4.259
  748    H2     A  96           H2         A  96   7.389 -17.033  -5.658
  749   HO5'    A  96          H5T         A  96   2.029 -16.436   0.529
  750    H5'    U  97           H5'        U  97   8.462 -18.232  -0.363
  751   H5''    U  97          H5''        U  97   9.444 -18.369   1.097
  752    H4'    U  97           H4'        U  97   9.615 -16.016   1.360
  753    H3'    U  97           H3'        U  97   7.192 -15.600   0.144
  754    H2'    U  97           H2'        U  97   7.610 -15.871  -2.116
  755   HO2'    U  97          HO2'        U  97   8.971 -13.469  -1.542
  756    H1'    U  97           H1'        U  97  10.448 -15.342  -2.330
  757    H3     U  97           H3         U  97  11.470 -19.001  -4.752
  758    H5     U  97           H5         U  97   7.580 -19.774  -3.370
  759    H6     U  97           H6         U  97   7.727 -17.757  -2.018
  760    H5'    C  98           H5'        C  98   6.890 -11.052   2.192
  761   H5''    C  98          H5''        C  98   5.319 -11.459   1.513
  762    H4'    C  98           H4'        C  98   7.956 -11.535  -0.023
  763    H3'    C  98           H3'        C  98   6.820  -9.216   0.778
  764    H2'    C  98           H2'        C  98   4.582  -9.883   0.305
  765   HO2'    C  98          HO2'        C  98   4.971  -7.852  -0.706
  766    H1'    C  98           H1'        C  98   5.343 -10.764  -2.468
  767    H41    C  98           H41        C  98  -0.574 -13.008  -1.768
  768    H42    C  98           H42        C  98  -0.125 -13.867  -0.305
  769    H5     C  98           H5         C  98   2.111 -13.741   0.670
  770    H6     C  98           H6         C  98   4.326 -12.750   0.411
  771    H5'    A  99           H5'        A  99   9.573  -6.208  -1.064
  772   H5''    A  99          H5''        A  99   8.043  -6.528  -1.903
  773    H4'    A  99           H4'        A  99  10.687  -6.103  -3.358
  774    H3'    A  99           H3'        A  99   9.465  -4.096  -1.877
  775    H2'    A  99           H2'        A  99   7.375  -4.248  -3.096
  776   HO2'    A  99          HO2'        A  99   8.803  -2.124  -3.601
  777    H1'    A  99           H1'        A  99   9.138  -4.528  -5.533
  778    H8     A  99           H8         A  99   7.372  -3.563  -7.081
  779    H61    A  99           H61        A  99   2.231  -7.048  -7.227
  780    H62    A  99           H62        A  99   3.092  -5.735  -8.001
  781    H2     A  99           H2         A  99   4.693  -8.332  -3.754
  782    H5'    A 100           H5'        A 100  13.409  -3.559  -3.629
  783   H5''    A 100          H5''        A 100  14.256  -2.033  -3.430
  784    H4'    A 100           H4'        A 100  14.897  -3.465  -5.488
  785    H3'    A 100           H3'        A 100  15.008  -0.777  -5.014
  786    H2'    A 100           H2'        A 100  12.851  -0.325  -5.946
  787   HO2'    A 100          HO2'        A 100  14.720  -0.070  -8.087
  788    H1'    A 100           H1'        A 100  13.613  -2.145  -8.238
  789    H8     A 100           H8         A 100  10.529  -1.905  -5.900
  790    H61    A 100           H61        A 100   7.479  -0.128 -11.032
  791    H62    A 100           H62        A 100   7.296  -0.581  -9.344
  792    H2     A 100           H2         A 100  11.767  -0.543 -12.038
  793    H5'    A 101           H5'        A 101  16.604   0.960  -7.040
  794   H5''    A 101          H5''        A 101  18.130   0.376  -7.720
  795    H4'    A 101           H4'        A 101  18.259   2.743  -7.241
  796    H3'    A 101           H3'        A 101  20.211   0.943  -6.590
  797   HO3'    A 101          H3T         A 101  21.461   2.854  -6.099
  798    H2'    A 101           H2'        A 101  19.556   0.521  -4.388
  799   HO2'    A 101          HO2'        A 101  21.686   1.363  -4.252
  800    H1'    A 101           H1'        A 101  18.983   3.423  -3.847
  801    H8     A 101           H8         A 101  18.049  -0.270  -3.353
  802    H61    A 101           H61        A 101  15.046   1.709   1.723
  803    H62    A 101           H62        A 101  15.539   0.293   0.811
  804    H2     A 101           H2         A 101  16.492   5.262  -0.510
  Start of MODEL    9
    1    H1   MET   1           H1       MET   1   1.120   1.849  -0.986
    2    H2   MET   1           H2       MET   1   2.709   2.264  -0.917
    3    H3   MET   1           H3       MET   1   2.278   0.733  -1.334
    4    HA   MET   1           HA       MET   1   1.685   3.146  -2.917
    5    HB2  MET   1           HB2      MET   1   3.768   0.976  -3.244
    6    HB3  MET   1           HB3      MET   1   3.259   2.032  -4.572
    7    HG2  MET   1           HG2      MET   1   4.256   3.160  -1.942
    8    HG3  MET   1           HG3      MET   1   5.342   2.683  -3.244
    9    HE1  MET   1           HE1      MET   1   1.795   4.776  -3.437
   10    HE2  MET   1           HE2      MET   1   2.720   5.214  -1.971
   11    HE3  MET   1           HE3      MET   1   2.546   6.370  -3.313
   12    H    VAL   2           H        VAL   2  -0.480   2.671  -3.109
   13    HA   VAL   2           HA       VAL   2  -1.301   0.226  -4.454
   14    HB   VAL   2           HB       VAL   2  -2.836   1.415  -2.931
   15   HG11  VAL   2          1HG1      VAL   2  -3.731   3.651  -3.531
   16   HG12  VAL   2          HG21      VAL   2  -1.979   3.706  -3.229
   17   HG13  VAL   2          HG31      VAL   2  -2.596   3.732  -4.895
   18   HG21  VAL   2          HG32      VAL   2  -3.856   1.851  -5.751
   19   HG22  VAL   2          1HG2      VAL   2  -3.794   0.248  -4.967
   20   HG23  VAL   2          HG22      VAL   2  -4.810   1.541  -4.287
   21    H    GLU   3           H        GLU   3   0.669   2.455  -5.391
   22    HA   GLU   3           HA       GLU   3  -0.568   3.513  -7.787
   23    HB2  GLU   3           HB2      GLU   3   2.269   3.639  -6.670
   24    HB3  GLU   3           HB3      GLU   3   1.668   4.639  -8.003
   25    HG2  GLU   3           HG2      GLU   3   0.462   4.615  -5.205
   26    HG3  GLU   3           HG3      GLU   3   1.685   5.772  -5.757
   27    H    ALA   4           H        ALA   4  -0.435   2.709  -9.788
   28    HA   ALA   4           HA       ALA   4   1.348   0.362 -10.235
   29    HB1  ALA   4           1HB      ALA   4  -1.345   1.082 -11.451
   30    HB2  ALA   4           HB2      ALA   4  -0.392  -0.378 -11.821
   31    HB3  ALA   4           HB3      ALA   4  -1.055  -0.124 -10.182
   32    H    ASP   5           H        ASP   5   3.115   1.159 -11.159
   33    HA   ASP   5           HA       ASP   5   3.020   3.535 -12.844
   34    HB2  ASP   5           HB2      ASP   5   4.721   3.250 -11.144
   35    HB3  ASP   5           HB3      ASP   5   5.271   1.746 -11.876
   36    H    ARG   6           H        ARG   6   2.918   3.604 -14.933
   37    HA   ARG   6           HA       ARG   6   2.783   3.060 -17.104
   38    HB2  ARG   6           HB2      ARG   6   5.154   3.470 -16.795
   39    HB3  ARG   6           HB3      ARG   6   5.438   1.774 -16.387
   40    HG2  ARG   6           HG2      ARG   6   6.086   2.244 -18.703
   41    HG3  ARG   6           HG3      ARG   6   4.742   1.090 -18.656
   42    HD2  ARG   6           2HD      ARG   6   3.151   2.930 -19.147
   43    HD3  ARG   6           3HD      ARG   6   4.498   4.080 -19.174
   44    HE   ARG   6           HE       ARG   6   5.031   1.949 -21.002
   45   HH11  ARG   6          1HH1      ARG   6   2.918   4.759 -20.625
   46   HH12  ARG   6          2HH1      ARG   6   2.737   5.003 -22.345
   47   HH21  ARG   6          1HH2      ARG   6   4.779   2.292 -23.246
   48   HH22  ARG   6          2HH2      ARG   6   3.774   3.599 -23.820
   49    HA   PRO   7           HA       PRO   7   0.721  -1.010 -17.153
   50    HB2  PRO   7           HB2      PRO   7   0.149   0.353 -19.796
   51    HB3  PRO   7           HB3      PRO   7  -0.947  -0.710 -18.847
   52    HG2  PRO   7           HG2      PRO   7  -1.244   1.926 -18.777
   53    HG3  PRO   7           HG3      PRO   7  -1.231   1.032 -17.205
   54    HD2  PRO   7           2HD      PRO   7   1.030   2.582 -18.509
   55    HD3  PRO   7           3HD      PRO   7   0.532   2.573 -16.784
   56    H    GLY   8           H        GLY   8   1.667  -2.884 -18.001
   57    HA2  GLY   8           2HA      GLY   8   2.776  -4.069 -19.773
   58    HA3  GLY   8           3HA      GLY   8   3.582  -2.553 -20.257
   59    H    LYS   9           H        LYS   9   3.760  -2.169 -17.039
   60    HA   LYS   9           HA       LYS   9   6.383  -3.521 -16.952
   61    HB2  LYS   9           HB2      LYS   9   6.297  -1.148 -16.290
   62    HB3  LYS   9           HB3      LYS   9   5.152  -1.561 -14.989
   63    HG2  LYS   9           HG2      LYS   9   6.812  -3.161 -14.046
   64    HG3  LYS   9           HG3      LYS   9   7.966  -2.713 -15.318
   65    HD2  LYS   9           2HD      LYS   9   6.779  -0.775 -13.291
   66    HD3  LYS   9           3HD      LYS   9   8.337  -1.610 -13.105
   67    HE2  LYS   9           HE2      LYS   9   9.172  -0.583 -15.171
   68    HE3  LYS   9           HE3      LYS   9   7.616   0.232 -15.429
   69    HZ1  LYS   9           3HZ      LYS   9   9.315   1.642 -14.405
   70    HZ2  LYS   9           1HZ      LYS   9   7.974   1.502 -13.480
   71    HZ3  LYS   9           2HZ      LYS   9   9.335   0.662 -13.081
   72    H    LEU  10           H        LEU  10   6.712  -5.332 -15.848
   73    HA   LEU  10           HA       LEU  10   4.426  -6.390 -14.241
   74    HB2  LEU  10           HB2      LEU  10   6.548  -7.713 -15.933
   75    HB3  LEU  10           HB3      LEU  10   5.459  -8.642 -14.954
   76    HG   LEU  10           HG       LEU  10   4.645  -6.830 -17.272
   77   HD11  LEU  10          1HD1      LEU  10   4.437  -9.864 -16.937
   78   HD12  LEU  10          2HD1      LEU  10   4.254  -8.929 -18.435
   79   HD13  LEU  10          3HD1      LEU  10   5.854  -9.096 -17.647
   80   HD21  LEU  10          3HD2      LEU  10   2.841  -6.862 -15.640
   81   HD22  LEU  10          1HD2      LEU  10   2.426  -7.905 -17.027
   82   HD23  LEU  10          2HD2      LEU  10   2.962  -8.638 -15.503
   83    H    PHE  11           H        PHE  11   4.858  -7.367 -12.304
   84    HA   PHE  11           HA       PHE  11   7.578  -7.028 -11.149
   85    HB2  PHE  11           HB2      PHE  11   5.880  -5.996  -9.802
   86    HB3  PHE  11           HB3      PHE  11   4.797  -7.389  -9.988
   87    HD1  PHE  11           HD1      PHE  11   8.143  -6.435  -8.585
   88    HD2  PHE  11           HD2      PHE  11   4.775  -9.106  -8.393
   89    HE1  PHE  11           HE1      PHE  11   9.060  -7.455  -6.521
   90    HE2  PHE  11           HE2      PHE  11   5.721 -10.140  -6.340
   91    HZ   PHE  11           HZ       PHE  11   7.875  -9.312  -5.418
   92    H    ILE  12           H        ILE  12   8.791  -8.820 -10.837
   93    HA   ILE  12           HA       ILE  12   7.463 -11.435 -11.357
   94    HB   ILE  12           HB       ILE  12  10.364 -10.835 -11.952
   95   HG12  ILE  12          HG21      ILE  12   9.233  -9.173 -13.283
   96   HG13  ILE  12          HG31      ILE  12   9.850 -10.476 -14.295
   97   HG21  ILE  12          1HG2      ILE  12   8.318 -12.851 -12.959
   98   HG22  ILE  12          HG22      ILE  12  10.010 -12.741 -13.503
   99   HG23  ILE  12          HG32      ILE  12   9.636 -13.167 -11.814
  100   HD11  ILE  12          3HD1      ILE  12   6.952  -9.995 -13.513
  101   HD12  ILE  12          1HD1      ILE  12   7.701  -9.848 -15.116
  102   HD13  ILE  12          2HD1      ILE  12   7.522 -11.449 -14.365
  103    H    GLY  13           H        GLY  13   7.108 -11.707  -9.026
  104    HA2  GLY  13           2HA      GLY  13   9.569 -11.691  -7.351
  105    HA3  GLY  13           3HA      GLY  13   7.926 -11.720  -6.761
  106    H    GLY  14           H        GLY  14  10.455 -13.513  -6.426
  107    HA2  GLY  14           2HA      GLY  14  10.118 -15.599  -5.279
  108    HA3  GLY  14           3HA      GLY  14   8.875 -16.042  -6.472
  109    H    LEU  15           H        LEU  15  11.479 -14.493  -8.005
  110    HA   LEU  15           HA       LEU  15  12.153 -16.811  -9.525
  111    HB2  LEU  15           HB2      LEU  15  13.709 -14.238  -9.119
  112    HB3  LEU  15           HB3      LEU  15  13.923 -15.411 -10.440
  113    HG   LEU  15           HG       LEU  15  11.193 -14.219 -10.130
  114   HD11  LEU  15          1HD1      LEU  15  11.949 -12.287 -11.521
  115   HD12  LEU  15          2HD1      LEU  15  12.659 -12.254  -9.890
  116   HD13  LEU  15          3HD1      LEU  15  13.637 -12.793 -11.270
  117   HD21  LEU  15          3HD2      LEU  15  11.173 -14.540 -12.508
  118   HD22  LEU  15          1HD2      LEU  15  12.939 -14.624 -12.582
  119   HD23  LEU  15          2HD2      LEU  15  12.023 -15.975 -11.880
  120    H    ASN  16           H        ASN  16  14.272 -17.826  -9.736
  121    HA   ASN  16           HA       ASN  16  15.364 -18.690  -7.252
  122    HB2  ASN  16           HB2      ASN  16  15.160 -19.947  -9.394
  123    HB3  ASN  16           HB3      ASN  16  16.462 -18.939 -10.059
  124   HD21  ASN  16          2HD2      ASN  16  17.310 -21.169 -10.397
  125   HD22  ASN  16          1HD2      ASN  16  18.235 -21.879  -9.121
  126    H    THR  17           H        THR  17  17.652 -18.418  -6.581
  127    HA   THR  17           HA       THR  17  18.584 -15.687  -6.758
  128    HB   THR  17           HB       THR  17  20.497 -16.537  -5.445
  129    HG1  THR  17           1HG      THR  17  20.728 -18.572  -6.397
  130   HG21  THR  17          1HG2      THR  17  17.879 -17.805  -4.552
  131   HG22  THR  17          HG22      THR  17  19.245 -17.346  -3.510
  132   HG23  THR  17          HG32      THR  17  18.293 -16.080  -4.335
  133    H    GLU  18           H        GLU  18  18.628 -18.155  -8.946
  134    HA   GLU  18           HA       GLU  18  21.345 -17.646 -10.007
  135    HB2  GLU  18           HB2      GLU  18  19.397 -19.829 -10.782
  136    HB3  GLU  18           HB3      GLU  18  21.160 -19.818 -10.989
  137    HG2  GLU  18           HG2      GLU  18  19.663 -19.920  -8.323
  138    HG3  GLU  18           HG3      GLU  18  20.369 -21.306  -9.103
  139    H    THR  19           H        THR  19  18.114 -16.728 -10.435
  140    HA   THR  19           HA       THR  19  18.066 -16.724 -13.346
  141    HB   THR  19           HB       THR  19  16.229 -15.346 -11.352
  142    HG1  THR  19           1HG      THR  19  14.957 -17.233 -11.738
  143   HG21  THR  19          1HG2      THR  19  15.872 -14.469 -13.596
  144   HG22  THR  19          HG22      THR  19  15.929 -16.113 -14.287
  145   HG23  THR  19          HG32      THR  19  14.571 -15.626 -13.262
  146    H    ASN  20           H        ASN  20  18.382 -14.996 -14.709
  147    HA   ASN  20           HA       ASN  20  19.225 -12.420 -13.480
  148    HB2  ASN  20           HB2      ASN  20  20.650 -13.354 -15.927
  149    HB3  ASN  20           HB3      ASN  20  21.208 -12.280 -14.642
  150   HD21  ASN  20          2HD2      ASN  20  20.935 -15.525 -15.835
  151   HD22  ASN  20          1HD2      ASN  20  21.851 -16.315 -14.567
  152    H    GLU  21           H        GLU  21  19.863 -11.128 -15.786
  153    HA   GLU  21           HA       GLU  21  17.239 -10.372 -16.748
  154    HB2  GLU  21           HB2      GLU  21  20.063  -9.609 -17.551
  155    HB3  GLU  21           HB3      GLU  21  18.602  -8.870 -18.247
  156    HG2  GLU  21           HG2      GLU  21  17.873  -8.095 -16.067
  157    HG3  GLU  21           HG3      GLU  21  19.139  -9.015 -15.261
  158    H    LYS  22           H        LYS  22  19.856 -12.464 -17.940
  159    HA   LYS  22           HA       LYS  22  18.939 -12.583 -20.643
  160    HB2  LYS  22           HB2      LYS  22  21.174 -13.325 -19.375
  161    HB3  LYS  22           HB3      LYS  22  20.356 -14.884 -19.294
  162    HG2  LYS  22           HG2      LYS  22  21.047 -13.280 -21.789
  163    HG3  LYS  22           HG3      LYS  22  21.859 -14.742 -21.217
  164    HD2  LYS  22           2HD      LYS  22  19.666 -15.980 -21.510
  165    HD3  LYS  22           3HD      LYS  22  19.033 -14.530 -22.329
  166    HE2  LYS  22           HE2      LYS  22  21.502 -16.093 -23.167
  167    HE3  LYS  22           HE3      LYS  22  19.903 -16.219 -23.915
  168    HZ1  LYS  22           3HZ      LYS  22  21.317 -14.723 -25.132
  169    HZ2  LYS  22           1HZ      LYS  22  20.063 -13.882 -24.487
  170    HZ3  LYS  22           2HZ      LYS  22  21.563 -13.784 -23.814
  171    H    ALA  23           H        ALA  23  17.918 -14.156 -17.649
  172    HA   ALA  23           HA       ALA  23  16.401 -16.284 -19.076
  173    HB1  ALA  23           1HB      ALA  23  17.692 -16.844 -17.055
  174    HB2  ALA  23           HB2      ALA  23  16.794 -15.608 -16.142
  175    HB3  ALA  23           HB3      ALA  23  15.945 -17.042 -16.774
  176    H    LEU  24           H        LEU  24  16.041 -13.070 -17.921
  177    HA   LEU  24           HA       LEU  24  13.146 -13.357 -17.486
  178    HB2  LEU  24           HB2      LEU  24  15.451 -11.701 -16.624
  179    HB3  LEU  24           HB3      LEU  24  14.052 -10.707 -16.942
  180    HG   LEU  24           HG       LEU  24  13.864 -13.302 -15.381
  181   HD11  LEU  24          1HD1      LEU  24  14.495 -10.565 -14.209
  182   HD12  LEU  24          2HD1      LEU  24  14.094 -12.041 -13.284
  183   HD13  LEU  24          3HD1      LEU  24  15.590 -11.978 -14.236
  184   HD21  LEU  24          3HD2      LEU  24  11.784 -12.110 -16.149
  185   HD22  LEU  24          1HD2      LEU  24  11.902 -12.215 -14.367
  186   HD23  LEU  24          2HD2      LEU  24  12.277 -10.692 -15.214
  187    H    GLU  25           H        GLU  25  15.517 -11.956 -19.719
  188    HA   GLU  25           HA       GLU  25  13.436 -10.559 -21.222
  189    HB2  GLU  25           HB2      GLU  25  16.343 -11.307 -21.860
  190    HB3  GLU  25           HB3      GLU  25  15.298 -10.388 -22.961
  191    HG2  GLU  25           HG2      GLU  25  14.915  -8.723 -21.202
  192    HG3  GLU  25           HG3      GLU  25  16.071  -9.562 -20.147
  193    H    ALA  26           H        ALA  26  15.050 -13.658 -21.183
  194    HA   ALA  26           HA       ALA  26  14.252 -14.477 -23.860
  195    HB1  ALA  26           1HB      ALA  26  15.329 -15.967 -21.444
  196    HB2  ALA  26           HB2      ALA  26  15.228 -16.644 -23.084
  197    HB3  ALA  26           HB3      ALA  26  16.307 -15.256 -22.765
  198    H    VAL  27           H        VAL  27  12.974 -14.776 -20.563
  199    HA   VAL  27           HA       VAL  27  11.168 -16.941 -21.325
  200    HB   VAL  27           HB       VAL  27  12.535 -16.715 -19.314
  201   HG11  VAL  27          1HG1      VAL  27  10.219 -14.985 -18.398
  202   HG12  VAL  27          HG21      VAL  27  11.636 -15.462 -17.422
  203   HG13  VAL  27          HG31      VAL  27  11.857 -14.367 -18.812
  204   HG21  VAL  27          HG32      VAL  27   9.567 -17.164 -18.864
  205   HG22  VAL  27          1HG2      VAL  27  10.660 -18.334 -19.672
  206   HG23  VAL  27          HG22      VAL  27  10.938 -17.903 -17.968
  207    H    PHE  28           H        PHE  28  11.053 -13.480 -20.474
  208    HA   PHE  28           HA       PHE  28   8.112 -13.476 -20.764
  209    HB2  PHE  28           HB2      PHE  28  10.064 -11.328 -19.911
  210    HB3  PHE  28           HB3      PHE  28   8.343 -11.044 -20.194
  211    HD1  PHE  28           HD2      PHE  28   6.615 -12.038 -18.789
  212    HD2  PHE  28           HD1      PHE  28  10.782 -12.580 -17.935
  213    HE1  PHE  28           HE2      PHE  28   6.037 -12.899 -16.542
  214    HE2  PHE  28           HE1      PHE  28  10.217 -13.452 -15.683
  215    HZ   PHE  28           HZ       PHE  28   7.841 -13.614 -14.984
  216    H    GLY  29           H        GLY  29  10.803 -13.141 -22.810
  217    HA2  GLY  29           2HA      GLY  29   9.578 -11.229 -24.653
  218    HA3  GLY  29           3HA      GLY  29  10.999 -12.246 -24.966
  219    H    LYS  30           H        LYS  30   8.854 -14.365 -23.750
  220    HA   LYS  30           HA       LYS  30   8.223 -15.523 -26.328
  221    HB2  LYS  30           HB2      LYS  30   7.419 -16.286 -23.476
  222    HB3  LYS  30           HB3      LYS  30   7.334 -17.341 -24.907
  223    HG2  LYS  30           HG2      LYS  30   9.760 -17.203 -25.176
  224    HG3  LYS  30           HG3      LYS  30   9.891 -16.086 -23.809
  225    HD2  LYS  30           2HD      LYS  30  10.525 -18.387 -23.157
  226    HD3  LYS  30           3HD      LYS  30   9.170 -17.754 -22.225
  227    HE2  LYS  30           HE2      LYS  30   8.731 -20.059 -22.806
  228    HE3  LYS  30           HE3      LYS  30   7.581 -19.000 -23.632
  229    HZ1  LYS  30           3HZ      LYS  30   8.929 -19.208 -25.621
  230    HZ2  LYS  30           1HZ      LYS  30  10.001 -20.182 -24.838
  231    HZ3  LYS  30           2HZ      LYS  30   8.454 -20.688 -25.099
  232    H    TYR  31           H        TYR  31   6.781 -13.240 -24.336
  233    HA   TYR  31           HA       TYR  31   4.008 -13.888 -25.265
  234    HB2  TYR  31           HB2      TYR  31   5.001 -12.324 -22.878
  235    HB3  TYR  31           HB3      TYR  31   3.310 -12.687 -23.229
  236    HD1  TYR  31           HD2      TYR  31   2.735 -15.265 -23.414
  237    HD2  TYR  31           HD1      TYR  31   6.267 -13.683 -21.547
  238    HE1  TYR  31           HE2      TYR  31   3.030 -17.401 -22.184
  239    HE2  TYR  31           HE1      TYR  31   6.548 -15.800 -20.270
  240    HH   TYR  31           HH       TYR  31   5.786 -17.938 -19.953
  241    H    GLY  32           H        GLY  32   6.574 -11.563 -25.665
  242    HA2  GLY  32           2HA      GLY  32   5.135  -9.859 -27.357
  243    HA3  GLY  32           3HA      GLY  32   4.901  -9.219 -25.716
  244    H    ARG  33           H        ARG  33   6.090  -7.554 -27.483
  245    HA   ARG  33           HA       ARG  33   8.942  -8.009 -27.520
  246    HB2  ARG  33           HB2      ARG  33   7.332  -6.847 -29.264
  247    HB3  ARG  33           HB3      ARG  33   7.626  -5.396 -28.258
  248    HG2  ARG  33           HG2      ARG  33  10.066  -5.723 -28.556
  249    HG3  ARG  33           HG3      ARG  33   9.726  -7.248 -29.423
  250    HD2  ARG  33           2HD      ARG  33   8.518  -5.969 -31.165
  251    HD3  ARG  33           3HD      ARG  33   8.891  -4.456 -30.326
  252    HE   ARG  33           HE       ARG  33  10.790  -6.226 -31.786
  253   HH11  ARG  33          1HH1      ARG  33  10.241  -3.206 -29.998
  254   HH12  ARG  33          2HH1      ARG  33  11.767  -2.518 -30.491
  255   HH21  ARG  33          1HH2      ARG  33  12.760  -5.287 -32.399
  256   HH22  ARG  33          2HH2      ARG  33  13.182  -3.679 -31.849
  257    H    ILE  34           H        ILE  34  10.138  -7.697 -25.897
  258    HA   ILE  34           HA       ILE  34   9.432  -6.033 -23.620
  259    HB   ILE  34           HB       ILE  34  11.978  -7.494 -24.412
  260   HG12  ILE  34          HG21      ILE  34   9.659  -8.097 -22.528
  261   HG13  ILE  34          HG31      ILE  34  10.086  -8.967 -24.007
  262   HG21  ILE  34          1HG2      ILE  34  12.752  -7.133 -22.142
  263   HG22  ILE  34          HG22      ILE  34  12.461  -5.572 -22.903
  264   HG23  ILE  34          HG32      ILE  34  11.273  -6.216 -21.740
  265   HD11  ILE  34          3HD1      ILE  34  12.257  -9.627 -22.961
  266   HD12  ILE  34          1HD1      ILE  34  11.716  -8.877 -21.433
  267   HD13  ILE  34          2HD1      ILE  34  10.829 -10.259 -22.099
  268    H    VAL  35           H        VAL  35  10.091  -4.018 -23.091
  269    HA   VAL  35           HA       VAL  35  11.824  -2.604 -25.061
  270    HB   VAL  35           HB       VAL  35  10.423  -0.771 -23.349
  271   HG11  VAL  35          1HG1      VAL  35  10.132  -1.416 -26.311
  272   HG12  VAL  35          HG21      VAL  35   9.619   0.079 -25.507
  273   HG13  VAL  35          HG31      VAL  35  11.351  -0.328 -25.601
  274   HG21  VAL  35          HG32      VAL  35   8.567  -2.689 -24.821
  275   HG22  VAL  35          1HG2      VAL  35   8.657  -2.445 -23.056
  276   HG23  VAL  35          HG22      VAL  35   8.106  -1.133 -24.114
  277    H    GLU  36           H        GLU  36  11.462  -3.703 -21.797
  278    HA   GLU  36           HA       GLU  36  14.168  -2.875 -21.154
  279    HB2  GLU  36           HB2      GLU  36  12.890  -0.790 -20.672
  280    HB3  GLU  36           HB3      GLU  36  11.825  -1.701 -19.584
  281    HG2  GLU  36           HG2      GLU  36  13.697  -2.211 -18.106
  282    HG3  GLU  36           HG3      GLU  36  14.829  -1.476 -19.255
  283    H    VAL  37           H        VAL  37  14.995  -4.105 -19.409
  284    HA   VAL  37           HA       VAL  37  13.037  -5.646 -17.817
  285    HB   VAL  37           HB       VAL  37  15.272  -6.820 -19.450
  286   HG11  VAL  37          1HG1      VAL  37  14.335  -7.963 -16.791
  287   HG12  VAL  37          HG21      VAL  37  15.343  -8.794 -17.997
  288   HG13  VAL  37          HG31      VAL  37  15.975  -7.367 -17.156
  289   HG21  VAL  37          HG32      VAL  37  12.866  -7.099 -20.063
  290   HG22  VAL  37          1HG2      VAL  37  13.594  -8.659 -19.596
  291   HG23  VAL  37          HG22      VAL  37  12.547  -7.795 -18.456
  292    H    LEU  38           H        LEU  38  13.508  -5.932 -15.756
  293    HA   LEU  38           HA       LEU  38  16.047  -4.762 -14.642
  294    HB2  LEU  38           HB2      LEU  38  13.181  -4.593 -13.972
  295    HB3  LEU  38           HB3      LEU  38  14.226  -4.787 -12.585
  296    HG   LEU  38           HG       LEU  38  14.546  -2.558 -14.654
  297   HD11  LEU  38          1HD1      LEU  38  13.461  -2.534 -11.802
  298   HD12  LEU  38          2HD1      LEU  38  13.732  -1.108 -12.821
  299   HD13  LEU  38          3HD1      LEU  38  12.500  -2.305 -13.282
  300   HD21  LEU  38          3HD2      LEU  38  16.054  -1.567 -12.963
  301   HD22  LEU  38          1HD2      LEU  38  15.894  -3.030 -11.969
  302   HD23  LEU  38          2HD2      LEU  38  16.688  -3.116 -13.562
  303    H    LEU  39           H        LEU  39  16.971  -5.909 -12.933
  304    HA   LEU  39           HA       LEU  39  15.611  -8.300 -11.999
  305    HB2  LEU  39           HB2      LEU  39  16.840  -9.109 -13.949
  306    HB3  LEU  39           HB3      LEU  39  18.315  -8.313 -13.417
  307    HG   LEU  39           HG       LEU  39  18.056 -10.850 -13.177
  308   HD11  LEU  39          1HD1      LEU  39  18.945  -9.287 -10.728
  309   HD12  LEU  39          2HD1      LEU  39  19.467 -10.920 -11.202
  310   HD13  LEU  39          3HD1      LEU  39  19.896  -9.530 -12.222
  311   HD21  LEU  39          3HD2      LEU  39  16.583 -10.079 -10.631
  312   HD22  LEU  39          1HD2      LEU  39  15.846 -10.862 -12.059
  313   HD23  LEU  39          2HD2      LEU  39  17.097 -11.705 -11.123
  314    H    MET  40           H        MET  40  15.820  -8.206  -9.800
  315    HA   MET  40           HA       MET  40  17.659  -6.101  -8.861
  316    HB2  MET  40           HB2      MET  40  15.503  -7.493  -7.245
  317    HB3  MET  40           HB3      MET  40  16.310  -5.968  -6.911
  318    HG2  MET  40           HG2      MET  40  14.064  -6.596  -8.744
  319    HG3  MET  40           HG3      MET  40  14.345  -5.167  -7.761
  320    HE1  MET  40           HE3      MET  40  15.946  -2.985  -8.768
  321    HE2  MET  40           HE1      MET  40  17.201  -4.229  -8.697
  322    HE3  MET  40           HE2      MET  40  16.960  -3.288 -10.199
  323    H    LYS  41           H        LYS  41  19.229  -6.355  -7.324
  324    HA   LYS  41           HA       LYS  41  19.566  -8.968  -6.052
  325    HB2  LYS  41           HB2      LYS  41  22.158  -8.521  -6.882
  326    HB3  LYS  41           HB3      LYS  41  21.031  -9.724  -7.537
  327    HG2  LYS  41           HG2      LYS  41  20.356  -8.247  -9.312
  328    HG3  LYS  41           HG3      LYS  41  21.320  -6.905  -8.640
  329    HD2  LYS  41           2HD      LYS  41  23.392  -8.219  -9.016
  330    HD3  LYS  41           3HD      LYS  41  22.417  -9.576  -9.622
  331    HE2  LYS  41           HE2      LYS  41  23.285  -8.330 -11.525
  332    HE3  LYS  41           HE3      LYS  41  21.535  -8.088 -11.427
  333    HZ1  LYS  41           3HZ      LYS  41  23.574  -6.209 -10.446
  334    HZ2  LYS  41           1HZ      LYS  41  22.708  -6.047 -11.833
  335    HZ3  LYS  41           2HZ      LYS  41  21.943  -5.979 -10.377
  336    H    ASP  42           H        ASP  42  20.932  -8.981  -4.292
  337    HA   ASP  42           HA       ASP  42  20.894  -6.704  -2.641
  338    HB2  ASP  42           HB2      ASP  42  21.059  -9.202  -2.100
  339    HB3  ASP  42           HB3      ASP  42  22.794  -9.039  -2.408
  340    H    ARG  43           H        ARG  43  22.650  -5.444  -1.757
  341    HA   ARG  43           HA       ARG  43  24.543  -4.657  -3.870
  342    HB2  ARG  43           HB2      ARG  43  23.045  -3.051  -2.657
  343    HB3  ARG  43           HB3      ARG  43  23.948  -3.382  -1.172
  344    HG2  ARG  43           HG2      ARG  43  26.024  -2.553  -2.246
  345    HG3  ARG  43           HG3      ARG  43  25.132  -2.266  -3.757
  346    HD2  ARG  43           2HD      ARG  43  24.549  -0.962  -1.075
  347    HD3  ARG  43           3HD      ARG  43  25.451  -0.199  -2.394
  348    HE   ARG  43           HE       ARG  43  22.550  -0.585  -2.214
  349   HH11  ARG  43          1HH1      ARG  43  25.274   0.059  -4.363
  350   HH12  ARG  43          2HH1      ARG  43  24.280   0.794  -5.598
  351   HH21  ARG  43          1HH2      ARG  43  21.275   0.390  -3.826
  352   HH22  ARG  43          2HH2      ARG  43  22.013   0.970  -5.299
  353    H    GLU  44           H        GLU  44  24.570  -6.649  -1.073
  354    HA   GLU  44           HA       GLU  44  27.502  -6.247  -0.703
  355    HB2  GLU  44           HB2      GLU  44  25.415  -7.446   1.152
  356    HB3  GLU  44           HB3      GLU  44  27.137  -7.267   1.513
  357    HG2  GLU  44           HG2      GLU  44  25.180  -4.999   0.971
  358    HG3  GLU  44           HG3      GLU  44  25.812  -5.468   2.554
  359    H    THR  45           H        THR  45  25.146  -8.465  -1.931
  360    HA   THR  45           HA       THR  45  27.278 -10.566  -2.032
  361    HB   THR  45           HB       THR  45  25.606 -12.290  -1.863
  362    HG1  THR  45           1HG      THR  45  23.429 -11.696  -1.502
  363   HG21  THR  45          1HG2      THR  45  24.825 -11.969   0.403
  364   HG22  THR  45          HG22      THR  45  26.463 -11.266   0.246
  365   HG23  THR  45          HG32      THR  45  25.023 -10.200   0.259
  366    H    ASN  46           H        ASN  46  25.118  -8.519  -3.749
  367    HA   ASN  46           HA       ASN  46  24.558  -8.373  -5.943
  368    HB2  ASN  46           HB2      ASN  46  27.067 -10.048  -6.157
  369    HB3  ASN  46           HB3      ASN  46  26.226  -9.385  -7.573
  370   HD21  ASN  46          2HD2      ASN  46  28.724  -8.597  -7.450
  371   HD22  ASN  46          1HD2      ASN  46  28.884  -6.967  -6.830
  372    H    LYS  47           H        LYS  47  23.822 -10.924  -4.199
  373    HA   LYS  47           HA       LYS  47  22.986 -12.812  -6.280
  374    HB2  LYS  47           HB2      LYS  47  22.505 -12.574  -3.286
  375    HB3  LYS  47           HB3      LYS  47  21.766 -13.844  -4.271
  376    HG2  LYS  47           HG2      LYS  47  24.726 -13.362  -4.415
  377    HG3  LYS  47           HG3      LYS  47  24.051 -14.314  -3.059
  378    HD2  LYS  47           2HD      LYS  47  22.994 -15.852  -4.684
  379    HD3  LYS  47           3HD      LYS  47  23.711 -14.938  -6.026
  380    HE2  LYS  47           HE2      LYS  47  25.296 -16.218  -3.758
  381    HE3  LYS  47           HE3      LYS  47  25.030 -16.982  -5.342
  382    HZ1  LYS  47           3HZ      LYS  47  26.407 -14.419  -4.894
  383    HZ2  LYS  47           1HZ      LYS  47  27.136 -15.848  -5.243
  384    HZ3  LYS  47           2HZ      LYS  47  26.168 -15.135  -6.358
  385    H    SER  48           H        SER  48  20.929 -13.125  -6.994
  386    HA   SER  48           HA       SER  48  19.315 -10.859  -7.360
  387    HB2  SER  48           HB2      SER  48  18.482 -13.777  -7.474
  388    HB3  SER  48           HB3      SER  48  17.625 -12.408  -8.219
  389    HG   SER  48           HG       SER  48  19.022 -13.427  -9.714
  390    H    ARG  49           H        ARG  49  17.648  -9.937  -6.281
  391    HA   ARG  49           HA       ARG  49  17.249 -10.456  -3.477
  392    HB2  ARG  49           HB2      ARG  49  15.583  -8.952  -5.533
  393    HB3  ARG  49           HB3      ARG  49  15.332  -8.858  -3.781
  394    HG2  ARG  49           HG2      ARG  49  17.929  -8.045  -5.132
  395    HG3  ARG  49           HG3      ARG  49  16.576  -6.932  -4.946
  396    HD2  ARG  49           2HD      ARG  49  18.082  -8.299  -2.708
  397    HD3  ARG  49           3HD      ARG  49  18.191  -6.584  -3.186
  398    HE   ARG  49           HE       ARG  49  16.204  -7.834  -1.499
  399   HH11  ARG  49          1HH1      ARG  49  16.655  -5.158  -3.800
  400   HH12  ARG  49          2HH1      ARG  49  15.353  -4.227  -3.109
  401   HH21  ARG  49          1HH2      ARG  49  14.533  -6.569  -0.642
  402   HH22  ARG  49          2HH2      ARG  49  14.117  -5.043  -1.374
  403    H    GLY  50           H        GLY  50  16.138 -12.046  -6.261
  404    HA2  GLY  50           2HA      GLY  50  14.722 -13.891  -6.383
  405    HA3  GLY  50           3HA      GLY  50  14.034 -13.500  -4.791
  406    H    PHE  51           H        PHE  51  14.120 -10.590  -6.499
  407    HA   PHE  51           HA       PHE  51  11.640 -11.177  -7.998
  408    HB2  PHE  51           HB2      PHE  51  10.450  -9.344  -7.151
  409    HB3  PHE  51           HB3      PHE  51  11.010 -10.276  -5.768
  410    HD1  PHE  51           HD2      PHE  51  13.016  -9.410  -4.438
  411    HD2  PHE  51           HD1      PHE  51  10.990  -7.043  -7.409
  412    HE1  PHE  51           HE2      PHE  51  13.987  -7.349  -3.471
  413    HE2  PHE  51           HE1      PHE  51  11.915  -4.985  -6.395
  414    HZ   PHE  51           HZ       PHE  51  13.459  -5.129  -4.484
  415    H    ALA  52           H        ALA  52  11.122  -9.543  -9.620
  416    HA   ALA  52           HA       ALA  52  13.311  -7.773 -10.472
  417    HB1  ALA  52           1HB      ALA  52  13.555  -8.960 -12.639
  418    HB2  ALA  52           HB2      ALA  52  13.971 -10.036 -11.283
  419    HB3  ALA  52           HB3      ALA  52  12.405 -10.191 -12.112
  420    H    PHE  53           H        PHE  53  12.614  -7.013 -12.885
  421    HA   PHE  53           HA       PHE  53   9.681  -6.744 -13.039
  422    HB2  PHE  53           HB2      PHE  53  11.572  -4.347 -13.048
  423    HB3  PHE  53           HB3      PHE  53   9.851  -4.290 -13.336
  424    HD1  PHE  53           HD1      PHE  53  12.478  -5.061 -10.848
  425    HD2  PHE  53           HD2      PHE  53   8.338  -4.128 -11.485
  426    HE1  PHE  53           HE1      PHE  53  12.171  -4.817  -8.405
  427    HE2  PHE  53           HE2      PHE  53   8.012  -3.890  -9.033
  428    HZ   PHE  53           HZ       PHE  53   9.924  -4.272  -7.482
  429    H    VAL  54           H        VAL  54   8.986  -5.897 -15.182
  430    HA   VAL  54           HA       VAL  54  11.029  -5.748 -17.278
  431    HB   VAL  54           HB       VAL  54  10.691  -8.182 -17.158
  432   HG11  VAL  54          1HG1      VAL  54   8.709  -9.281 -17.491
  433   HG12  VAL  54          HG21      VAL  54   8.672  -8.260 -16.032
  434   HG13  VAL  54          HG31      VAL  54   7.794  -7.729 -17.519
  435   HG21  VAL  54          HG32      VAL  54  10.018  -8.595 -19.466
  436   HG22  VAL  54          1HG2      VAL  54   9.028  -7.121 -19.496
  437   HG23  VAL  54          HG22      VAL  54  10.796  -6.998 -19.469
  438    H    THR  55           H        THR  55  10.340  -4.511 -18.993
  439    HA   THR  55           HA       THR  55   7.504  -3.611 -18.870
  440    HB   THR  55           HB       THR  55   9.876  -2.130 -20.053
  441    HG1  THR  55           1HG      THR  55   9.628  -0.841 -18.216
  442   HG21  THR  55          1HG2      THR  55   8.211  -0.242 -20.046
  443   HG22  THR  55          HG22      THR  55   7.760  -1.562 -21.141
  444   HG23  THR  55          HG32      THR  55   6.951  -1.408 -19.573
  445    H    PHE  56           H        PHE  56   6.225  -4.181 -20.454
  446    HA   PHE  56           HA       PHE  56   7.353  -5.234 -22.986
  447    HB2  PHE  56           HB2      PHE  56   4.592  -5.270 -21.738
  448    HB3  PHE  56           HB3      PHE  56   4.964  -5.843 -23.363
  449    HD1  PHE  56           HD1      PHE  56   6.514  -6.462 -19.935
  450    HD2  PHE  56           HD2      PHE  56   4.912  -8.072 -23.594
  451    HE1  PHE  56           HE1      PHE  56   7.032  -8.738 -19.164
  452    HE2  PHE  56           HE2      PHE  56   5.330 -10.357 -22.775
  453    HZ   PHE  56           HZ       PHE  56   6.380 -10.708 -20.548
  454    H    GLU  57           H        GLU  57   6.293  -4.571 -25.022
  455    HA   GLU  57           HA       GLU  57   6.089  -1.719 -25.251
  456    HB2  GLU  57           HB2      GLU  57   5.888  -4.145 -27.039
  457    HB3  GLU  57           HB3      GLU  57   5.298  -2.586 -27.615
  458    HG2  GLU  57           HG2      GLU  57   7.555  -1.597 -26.894
  459    HG3  GLU  57           HG3      GLU  57   8.113  -3.268 -26.697
  460    H    SER  58           H        SER  58   3.687  -4.201 -24.611
  461    HA   SER  58           HA       SER  58   1.549  -2.116 -24.844
  462    HB2  SER  58           HB2      SER  58   1.298  -3.623 -26.726
  463    HB3  SER  58           HB3      SER  58   1.523  -5.041 -25.696
  464    HG   SER  58           HG       SER  58  -0.682  -4.558 -26.195
  465    HA   PRO  59           HA       PRO  59   0.604  -3.452 -20.737
  466    HB2  PRO  59           HB2      PRO  59  -1.830  -2.389 -20.393
  467    HB3  PRO  59           HB3      PRO  59  -0.426  -1.298 -20.735
  468    HG2  PRO  59           HG2      PRO  59  -2.365  -2.509 -22.737
  469    HG3  PRO  59           HG3      PRO  59  -2.094  -0.764 -22.468
  470    HD2  PRO  59           2HD      PRO  59  -0.702  -2.085 -24.381
  471    HD3  PRO  59           3HD      PRO  59   0.165  -0.930 -23.319
  472    H    ALA  60           H        ALA  60  -0.577  -4.732 -23.593
  473    HA   ALA  60           HA       ALA  60  -2.379  -6.607 -22.150
  474    HB1  ALA  60           1HB      ALA  60  -3.702  -6.769 -24.209
  475    HB2  ALA  60           HB2      ALA  60  -3.639  -5.099 -23.605
  476    HB3  ALA  60           HB3      ALA  60  -2.636  -5.578 -24.995
  477    H    ASP  61           H        ASP  61   0.475  -6.303 -24.154
  478    HA   ASP  61           HA       ASP  61   0.376  -9.158 -24.824
  479    HB2  ASP  61           HB2      ASP  61   2.356  -8.799 -26.039
  480    HB3  ASP  61           HB3      ASP  61   1.337  -7.343 -26.290
  481    H    ALA  62           H        ALA  62   1.462  -7.006 -22.411
  482    HA   ALA  62           HA       ALA  62   3.224  -8.782 -20.962
  483    HB1  ALA  62           1HB      ALA  62   1.593  -6.351 -20.087
  484    HB2  ALA  62           HB2      ALA  62   2.821  -7.160 -19.092
  485    HB3  ALA  62           HB3      ALA  62   3.293  -6.353 -20.609
  486    H    LYS  63           H        LYS  63  -0.279  -8.306 -21.136
  487    HA   LYS  63           HA       LYS  63  -0.928  -9.540 -18.615
  488    HB2  LYS  63           HB2      LYS  63  -2.510  -9.208 -21.192
  489    HB3  LYS  63           HB3      LYS  63  -3.203  -9.740 -19.648
  490    HG2  LYS  63           HG2      LYS  63  -2.490  -7.631 -18.573
  491    HG3  LYS  63           HG3      LYS  63  -1.753  -7.111 -20.102
  492    HD2  LYS  63           2HD      LYS  63  -3.923  -6.006 -19.809
  493    HD3  LYS  63           3HD      LYS  63  -4.013  -7.120 -21.171
  494    HE2  LYS  63           HE2      LYS  63  -5.013  -8.861 -19.696
  495    HE3  LYS  63           HE3      LYS  63  -4.950  -7.740 -18.337
  496    HZ1  LYS  63           3HZ      LYS  63  -6.478  -7.314 -20.819
  497    HZ2  LYS  63           1HZ      LYS  63  -7.112  -7.741 -19.360
  498    HZ3  LYS  63           2HZ      LYS  63  -6.409  -6.273 -19.552
  499    H    ASP  64           H        ASP  64  -0.312 -10.739 -21.897
  500    HA   ASP  64           HA       ASP  64  -1.462 -13.339 -21.441
  501    HB2  ASP  64           HB2      ASP  64  -1.022 -12.131 -23.640
  502    HB3  ASP  64           HB3      ASP  64   0.690 -12.479 -23.413
  503    H    ALA  65           H        ALA  65   1.648 -11.825 -20.882
  504    HA   ALA  65           HA       ALA  65   3.024 -14.314 -20.207
  505    HB1  ALA  65           1HB      ALA  65   4.170 -12.170 -20.976
  506    HB2  ALA  65           HB2      ALA  65   3.750 -11.468 -19.404
  507    HB3  ALA  65           HB3      ALA  65   4.815 -12.892 -19.479
  508    H    ALA  66           H        ALA  66   1.500 -11.604 -18.411
  509    HA   ALA  66           HA       ALA  66   2.142 -12.686 -15.843
  510    HB1  ALA  66           1HB      ALA  66  -0.030 -10.694 -16.676
  511    HB2  ALA  66           HB2      ALA  66   0.673 -10.858 -15.050
  512    HB3  ALA  66           HB3      ALA  66   1.662 -10.262 -16.406
  513    H    ARG  67           H        ARG  67  -0.132 -13.627 -18.169
  514    HA   ARG  67           HA       ARG  67  -1.842 -15.020 -16.186
  515    HB2  ARG  67           HB2      ARG  67  -2.080 -14.434 -19.149
  516    HB3  ARG  67           HB3      ARG  67  -3.201 -15.505 -18.292
  517    HG2  ARG  67           HG2      ARG  67  -3.918 -13.772 -16.804
  518    HG3  ARG  67           HG3      ARG  67  -2.656 -12.661 -17.349
  519    HD2  ARG  67           2HD      ARG  67  -4.842 -12.060 -18.295
  520    HD3  ARG  67           3HD      ARG  67  -3.705 -12.479 -19.561
  521    HE   ARG  67           HE       ARG  67  -4.962 -14.378 -20.091
  522   HH11  ARG  67          1HH1      ARG  67  -6.169 -12.924 -17.096
  523   HH12  ARG  67          2HH1      ARG  67  -7.615 -13.905 -17.072
  524   HH21  ARG  67          1HH2      ARG  67  -6.863 -15.643 -20.028
  525   HH22  ARG  67          2HH2      ARG  67  -7.998 -15.440 -18.716
  526    H    ASP  68           H        ASP  68   1.130 -15.753 -17.372
  527    HA   ASP  68           HA       ASP  68   0.429 -18.606 -17.899
  528    HB2  ASP  68           HB2      ASP  68   1.890 -16.511 -19.455
  529    HB3  ASP  68           HB3      ASP  68   2.787 -17.961 -19.201
  530    H    MET  69           H        MET  69   2.925 -16.161 -17.274
  531    HA   MET  69           HA       MET  69   4.817 -17.955 -16.110
  532    HB2  MET  69           HB2      MET  69   4.455 -14.957 -16.557
  533    HB3  MET  69           HB3      MET  69   5.849 -15.599 -15.737
  534    HG2  MET  69           HG2      MET  69   4.977 -16.247 -18.568
  535    HG3  MET  69           HG3      MET  69   6.351 -15.250 -18.088
  536    HE1  MET  69           HE3      MET  69   8.444 -18.176 -16.161
  537    HE2  MET  69           HE1      MET  69   8.255 -16.409 -16.296
  538    HE3  MET  69           HE2      MET  69   7.024 -17.380 -15.459
  539    H    ASN  70           H        ASN  70   2.102 -16.106 -14.927
  540    HA   ASN  70           HA       ASN  70   3.091 -15.852 -12.207
  541    HB2  ASN  70           HB2      ASN  70   1.410 -14.324 -13.182
  542    HB3  ASN  70           HB3      ASN  70   0.281 -15.673 -13.366
  543   HD21  ASN  70          2HD2      ASN  70  -1.016 -14.034 -12.035
  544   HD22  ASN  70          1HD2      ASN  70  -0.900 -14.174 -10.293
  545    H    GLY  71           H        GLY  71   3.517 -17.634 -11.058
  546    HA2  GLY  71           2HA      GLY  71   2.651 -19.374  -9.667
  547    HA3  GLY  71           3HA      GLY  71   1.448 -19.767 -10.904
  548    H    LYS  72           H        LYS  72   4.079 -19.320 -12.803
  549    HA   LYS  72           HA       LYS  72   4.854 -22.170 -12.707
  550    HB2  LYS  72           HB2      LYS  72   5.377 -22.069 -14.779
  551    HB3  LYS  72           HB3      LYS  72   4.194 -20.763 -14.754
  552    HG2  LYS  72           HG2      LYS  72   5.877 -19.106 -15.042
  553    HG3  LYS  72           HG3      LYS  72   7.191 -20.177 -14.541
  554    HD2  LYS  72           2HD      LYS  72   7.264 -20.092 -16.939
  555    HD3  LYS  72           3HD      LYS  72   6.728 -21.700 -16.413
  556    HE2  LYS  72           HE2      LYS  72   4.395 -21.144 -16.858
  557    HE3  LYS  72           HE3      LYS  72   4.837 -19.462 -17.189
  558    HZ1  LYS  72           3HZ      LYS  72   6.086 -20.257 -19.098
  559    HZ2  LYS  72           1HZ      LYS  72   5.657 -21.811 -18.776
  560    HZ3  LYS  72           2HZ      LYS  72   4.510 -20.721 -19.210
  561    H    SER  73           H        SER  73   7.378 -22.170 -13.564
  562    HA   SER  73           HA       SER  73   8.907 -20.839 -11.337
  563    HB2  SER  73           HB2      SER  73   8.411 -23.224 -10.848
  564    HB3  SER  73           HB3      SER  73   9.110 -23.688 -12.408
  565    HG   SER  73           HG       SER  73  10.595 -23.901 -10.688
  566    H    LEU  74           H        LEU  74  10.988 -20.435 -11.545
  567    HA   LEU  74           HA       LEU  74  12.052 -20.450 -14.315
  568    HB2  LEU  74           HB2      LEU  74  11.348 -18.065 -12.772
  569    HB3  LEU  74           HB3      LEU  74  13.056 -18.221 -12.784
  570    HG   LEU  74           HG       LEU  74  12.468 -18.875 -15.443
  571   HD11  LEU  74          1HD1      LEU  74  10.874 -16.439 -14.565
  572   HD12  LEU  74          2HD1      LEU  74  10.987 -17.063 -16.204
  573   HD13  LEU  74          3HD1      LEU  74  10.095 -18.022 -14.957
  574   HD21  LEU  74          3HD2      LEU  74  12.875 -16.059 -14.455
  575   HD22  LEU  74          1HD2      LEU  74  14.208 -17.233 -14.804
  576   HD23  LEU  74          2HD2      LEU  74  13.137 -16.657 -16.115
  577    H    ASP  75           H        ASP  75  13.972 -21.333 -14.409
  578    HA   ASP  75           HA       ASP  75  15.905 -22.331 -13.837
  579    HB2  ASP  75           HB2      ASP  75  16.110 -19.769 -12.864
  580    HB3  ASP  75           HB3      ASP  75  16.032 -20.589 -11.384
  581    H    GLY  76           H        GLY  76  13.453 -22.184 -11.365
  582    HA2  GLY  76           2HA      GLY  76  13.450 -24.803 -10.784
  583    HA3  GLY  76           3HA      GLY  76  14.769 -24.211  -9.751
  584    H    LYS  77           H        LYS  77  12.938 -21.528  -9.798
  585    HA   LYS  77           HA       LYS  77  11.424 -22.384  -7.382
  586    HB2  LYS  77           HB2      LYS  77  12.737 -19.694  -7.875
  587    HB3  LYS  77           HB3      LYS  77  11.948 -20.240  -6.389
  588    HG2  LYS  77           HG2      LYS  77  14.467 -21.438  -7.624
  589    HG3  LYS  77           HG3      LYS  77  14.415 -20.357  -6.219
  590    HD2  LYS  77           2HD      LYS  77  13.303 -22.002  -4.875
  591    HD3  LYS  77           3HD      LYS  77  13.006 -23.057  -6.271
  592    HE2  LYS  77           HE2      LYS  77  15.405 -23.369  -6.607
  593    HE3  LYS  77           HE3      LYS  77  15.764 -22.283  -5.252
  594    HZ1  LYS  77           3HZ      LYS  77  14.643 -23.826  -3.799
  595    HZ2  LYS  77           1HZ      LYS  77  14.293 -24.830  -5.053
  596    HZ3  LYS  77           2HZ      LYS  77  15.857 -24.585  -4.596
  597    H    ALA  78           H        ALA  78   9.353 -21.721  -7.156
  598    HA   ALA  78           HA       ALA  78   7.963 -20.980  -9.551
  599    HB1  ALA  78           1HB      ALA  78   6.985 -21.185  -6.678
  600    HB2  ALA  78           HB2      ALA  78   5.959 -21.071  -8.127
  601    HB3  ALA  78           HB3      ALA  78   7.006 -22.491  -7.883
  602    H    ILE  79           H        ILE  79   7.020 -19.042 -10.173
  603    HA   ILE  79           HA       ILE  79   7.706 -16.708  -8.470
  604    HB   ILE  79           HB       ILE  79   8.245 -15.431 -10.385
  605   HG12  ILE  79          HG21      ILE  79   7.639 -17.887 -12.102
  606   HG13  ILE  79          HG31      ILE  79   6.646 -16.423 -12.025
  607   HG21  ILE  79          1HG2      ILE  79  10.291 -16.556 -11.029
  608   HG22  ILE  79          HG22      ILE  79   9.929 -17.019  -9.354
  609   HG23  ILE  79          HG32      ILE  79   9.593 -18.153 -10.683
  610   HD11  ILE  79          3HD1      ILE  79   9.525 -16.576 -13.057
  611   HD12  ILE  79          1HD1      ILE  79   8.038 -16.322 -13.998
  612   HD13  ILE  79          2HD1      ILE  79   8.584 -15.088 -12.863
  613    H    LYS  80           H        LYS  80   6.555 -14.742  -8.992
  614    HA   LYS  80           HA       LYS  80   3.689 -15.160  -9.711
  615    HB2  LYS  80           HB2      LYS  80   4.276 -14.486  -7.313
  616    HB3  LYS  80           HB3      LYS  80   4.956 -13.000  -7.976
  617    HG2  LYS  80           HG2      LYS  80   2.669 -12.618  -9.121
  618    HG3  LYS  80           HG3      LYS  80   2.046 -13.897  -8.069
  619    HD2  LYS  80           2HD      LYS  80   2.868 -12.564  -6.090
  620    HD3  LYS  80           3HD      LYS  80   3.364 -11.283  -7.234
  621    HE2  LYS  80           HE2      LYS  80   0.989 -11.194  -8.064
  622    HE3  LYS  80           HE3      LYS  80   0.545 -12.337  -6.791
  623    HZ1  LYS  80           3HZ      LYS  80   1.693  -9.657  -6.391
  624    HZ2  LYS  80           1HZ      LYS  80   0.134 -10.103  -6.104
  625    HZ3  LYS  80           2HZ      LYS  80   1.362 -10.712  -5.189
  626    H    VAL  81           H        VAL  81   2.789 -13.648 -11.169
  627    HA   VAL  81           HA       VAL  81   4.562 -11.456 -12.075
  628    HB   VAL  81           HB       VAL  81   3.110 -13.337 -13.973
  629   HG11  VAL  81          1HG1      VAL  81   4.959 -10.956 -14.451
  630   HG12  VAL  81          HG21      VAL  81   4.241 -12.006 -15.701
  631   HG13  VAL  81          HG31      VAL  81   3.200 -10.960 -14.715
  632   HG21  VAL  81          HG32      VAL  81   6.061 -12.927 -13.330
  633   HG22  VAL  81          1HG2      VAL  81   5.112 -14.414 -13.073
  634   HG23  VAL  81          HG22      VAL  81   5.449 -13.851 -14.722
  635    H    GLU  82           H        GLU  82   3.555  -9.585 -12.221
  636    HA   GLU  82           HA       GLU  82   0.678  -9.346 -12.664
  637    HB2  GLU  82           HB2      GLU  82   0.851 -10.046 -10.260
  638    HB3  GLU  82           HB3      GLU  82   1.919  -8.687  -9.948
  639    HG2  GLU  82           HG2      GLU  82  -0.401  -8.237  -9.234
  640    HG3  GLU  82           HG3      GLU  82   0.121  -7.102 -10.476
  641    H    GLN  83           H        GLN  83   0.100  -6.913 -12.733
  642    HA   GLN  83           HA       GLN  83   2.218  -5.376 -13.875
  643    HB2  GLN  83           HB2      GLN  83  -0.011  -4.747 -14.438
  644    HB3  GLN  83           HB3      GLN  83  -0.519  -4.747 -12.745
  645    HG2  GLN  83           HG2      GLN  83  -0.435  -2.498 -13.473
  646    HG3  GLN  83           HG3      GLN  83   0.857  -2.747 -12.301
  647   HE21  GLN  83          HE22      GLN  83   2.402  -1.358 -12.796
  648   HE22  GLN  83          HE12      GLN  83   3.072  -1.068 -14.376
  649    H    ALA  84           H        ALA  84   3.690  -3.977 -12.957
  650    HA   ALA  84           HA       ALA  84   4.266  -4.532 -10.170
  651    HB1  ALA  84           1HB      ALA  84   6.023  -4.426 -11.910
  652    HB2  ALA  84           HB2      ALA  84   5.650  -2.702 -12.163
  653    HB3  ALA  84           HB3      ALA  84   6.307  -3.250 -10.604
  654    H    THR  85           H        THR  85   4.673  -2.990  -8.527
  655    HA   THR  85           HA       THR  85   3.278  -0.379  -8.871
  656    HB   THR  85           HB       THR  85   2.994  -0.370  -6.430
  657    HG1  THR  85           1HG      THR  85   3.318  -2.327  -5.326
  658   HG21  THR  85          1HG2      THR  85   1.151  -2.007  -6.340
  659   HG22  THR  85          HG22      THR  85   1.165  -1.192  -7.918
  660   HG23  THR  85          HG32      THR  85   1.801  -2.843  -7.770
  661    H    LYS  86           H        LYS  86   4.174   1.276  -7.314
  662    HA   LYS  86           HA       LYS  86   6.913   1.721  -8.001
  663    HB2  LYS  86           HB2      LYS  86   4.990   3.077  -6.070
  664    HB3  LYS  86           HB3      LYS  86   6.600   3.710  -6.465
  665    HG2  LYS  86           HG2      LYS  86   5.981   3.670  -8.896
  666    HG3  LYS  86           HG3      LYS  86   4.350   3.138  -8.455
  667    HD2  LYS  86           2HD      LYS  86   4.050   5.234  -7.131
  668    HD3  LYS  86           3HD      LYS  86   5.658   5.772  -7.676
  669    HE2  LYS  86           HE2      LYS  86   4.903   5.540 -10.041
  670    HE3  LYS  86           HE3      LYS  86   3.302   5.060  -9.473
  671    HZ1  LYS  86           3HZ      LYS  86   3.369   7.394 -10.006
  672    HZ2  LYS  86           1HZ      LYS  86   3.103   7.207  -8.400
  673    HZ3  LYS  86           2HZ      LYS  86   4.594   7.651  -8.939
  674    HA   PRO  87           HA       PRO  87   9.210  -0.306  -4.929
  675    HB2  PRO  87           HB2      PRO  87  11.236   1.470  -4.319
  676    HB3  PRO  87           HB3      PRO  87  11.139   0.575  -5.851
  677    HG2  PRO  87           HG2      PRO  87  10.154   3.389  -5.298
  678    HG3  PRO  87           HG3      PRO  87  11.177   2.816  -6.666
  679    HD2  PRO  87           2HD      PRO  87   8.526   3.141  -6.985
  680    HD3  PRO  87           3HD      PRO  87   9.341   1.700  -7.675
  681    H    SER  88           H        SER  88   9.712  -0.427  -2.660
  682    HA   SER  88           HA       SER  88   7.736   0.971  -1.076
  683    HB2  SER  88           HB2      SER  88   9.913  -0.994  -0.274
  684    HB3  SER  88           HB3      SER  88   8.541  -0.481   0.739
  685    HG   SER  88           HG       SER  88   8.105  -2.439  -0.344
  686    H    PHE  89           H        PHE  89  10.712   1.980  -2.144
  687    HA   PHE  89           HA       PHE  89  11.301   3.490   0.334
  688    HB2  PHE  89           HB2      PHE  89  13.364   4.157  -0.826
  689    HB3  PHE  89           HB3      PHE  89  13.208   2.421  -0.541
  690    HD1  PHE  89           HD2      PHE  89  12.181   4.792  -3.305
  691    HD2  PHE  89           HD1      PHE  89  14.102   1.094  -2.220
  692    HE1  PHE  89           HE2      PHE  89  12.855   4.430  -5.665
  693    HE2  PHE  89           HE1      PHE  89  14.935   0.845  -4.509
  694    HZ   PHE  89           HZ       PHE  89  14.253   2.473  -6.268
  695    H    GLU  90           H        GLU  90   9.071   3.878  -1.889
  696    HA   GLU  90           HA       GLU  90   9.505   6.809  -2.086
  697    HB2  GLU  90           HB2      GLU  90   9.991   5.392  -4.205
  698    HB3  GLU  90           HB3      GLU  90   8.233   5.173  -4.300
  699    HG2  GLU  90           HG2      GLU  90   7.962   7.650  -4.335
  700    HG3  GLU  90           HG3      GLU  90   9.719   7.831  -4.173
  701    H    SER  91           H        SER  91   7.429   7.983  -2.610
  702    HA   SER  91           HA       SER  91   5.058   6.682  -1.415
  703    HB2  SER  91           HB2      SER  91   6.449   7.681   0.413
  704    HB3  SER  91           HB3      SER  91   6.277   9.266  -0.369
  705    HG   SER  91           HG       SER  91   4.689   8.882   1.264
  706    H    GLY  92           H        GLY  92   3.139   8.148  -1.533
  707    HA2  GLY  92           2HA      GLY  92   2.941   9.253  -4.218
  708    HA3  GLY  92           3HA      GLY  92   1.641   9.074  -3.027
  709    H    ARG  93           H        ARG  93   4.140  10.591  -1.420
  710    HA   ARG  93           HA       ARG  93   3.399  13.332  -2.295
  711    HB2  ARG  93           HB2      ARG  93   3.176  12.176   0.510
  712    HB3  ARG  93           HB3      ARG  93   3.280  13.912   0.204
  713    HG2  ARG  93           HG2      ARG  93   1.114  12.085  -0.910
  714    HG3  ARG  93           HG3      ARG  93   0.949  13.191   0.469
  715    HD2  ARG  93           2HD      ARG  93   1.567  15.102  -1.038
  716    HD3  ARG  93           3HD      ARG  93   1.569  13.994  -2.412
  717    HE   ARG  93           HE       ARG  93  -0.761  15.041  -0.964
  718   HH11  ARG  93          1HH1      ARG  93   0.423  12.576  -3.225
  719   HH12  ARG  93          2HH1      ARG  93  -1.170  12.259  -3.871
  720   HH21  ARG  93          1HH2      ARG  93  -2.803  14.604  -1.845
  721   HH22  ARG  93          2HH2      ARG  93  -2.981  13.405  -3.108
  722    H    ARG  94           H        ARG  94   4.736  14.973  -1.115
  723    HA   ARG  94           HA       ARG  94   7.545  14.087  -0.769
  724    HB2  ARG  94           HB2      ARG  94   7.112  14.584  -3.167
  725    HB3  ARG  94           HB3      ARG  94   6.543  16.196  -2.726
  726    HG2  ARG  94           HG2      ARG  94   8.778  16.757  -1.821
  727    HG3  ARG  94           HG3      ARG  94   9.349  15.116  -2.196
  728    HD2  ARG  94           2HD      ARG  94   8.315  17.137  -4.225
  729    HD3  ARG  94           3HD      ARG  94  10.027  16.806  -3.895
  730    HE   ARG  94           HE       ARG  94   8.917  14.326  -4.503
  731   HH11  ARG  94          1HH1      ARG  94   9.229  17.448  -6.125
  732   HH12  ARG  94          2HH1      ARG  94   9.270  16.747  -7.727
  733   HH21  ARG  94          1HH2      ARG  94   8.991  13.434  -6.607
  734   HH22  ARG  94          2HH2      ARG  94   9.132  14.485  -7.997
  735    H    GLY  95           H        GLY  95   8.848  15.612   0.362
  736    HA2  GLY  95           2HA      GLY  95   7.942  18.176   1.232
  737    HA3  GLY  95           3HA      GLY  95   7.619  16.977   2.494
  738    H5'    A  96           H5'        A  96   1.054 -15.770  -3.631
  739   H5''    A  96          H5''        A  96   2.557 -16.234  -2.829
  740    H4'    A  96           H4'        A  96   0.062 -17.999  -3.101
  741    H3'    A  96           H3'        A  96   0.828 -15.921  -1.174
  742    H2'    A  96           H2'        A  96   1.314 -17.194   0.711
  743   HO2'    A  96          HO2'        A  96  -0.700 -18.409   0.518
  744    H1'    A  96           H1'        A  96   2.427 -19.418  -0.328
  745    H8     A  96           H8         A  96   4.210 -17.746  -2.746
  746    H61    A  96           H61        A  96   7.335 -14.388   1.435
  747    H62    A  96           H62        A  96   7.307 -14.923  -0.237
  748    H2     A  96           H2         A  96   3.760 -16.078   3.427
  749   HO5'    A  96          H5T         A  96   2.621 -18.026  -4.356
  750    H5'    U  97           H5'        U  97  -0.662 -14.749   0.446
  751   H5''    U  97          H5''        U  97  -2.178 -13.858   0.214
  752    H4'    U  97           H4'        U  97  -0.967 -12.001  -0.819
  753    H3'    U  97           H3'        U  97   1.175 -13.763  -1.131
  754    H2'    U  97           H2'        U  97   2.481 -13.540   0.766
  755   HO2'    U  97          HO2'        U  97   3.252 -11.574  -0.261
  756    H1'    U  97           H1'        U  97   1.209 -11.628   2.363
  757    H3     U  97           H3         U  97  -0.115 -14.302   5.700
  758    H5     U  97           H5         U  97   0.890 -16.972   2.624
  759    H6     U  97           H6         U  97   1.152 -15.056   1.125
  760    H5'    C  98           H5'        C  98   4.681 -10.079  -2.722
  761   H5''    C  98          H5''        C  98   5.014 -11.589  -3.587
  762    H4'    C  98           H4'        C  98   5.965 -10.851  -0.785
  763    H3'    C  98           H3'        C  98   7.109  -9.903  -3.053
  764    H2'    C  98           H2'        C  98   7.003 -11.960  -4.260
  765   HO2'    C  98          HO2'        C  98   9.220 -11.158  -4.222
  766    H1'    C  98           H1'        C  98   8.222 -13.499  -1.990
  767    H41    C  98           H41        C  98   6.093 -17.966  -5.991
  768    H42    C  98           H42        C  98   4.485 -17.257  -6.027
  769    H5     C  98           H5         C  98   3.912 -15.229  -4.770
  770    H6     C  98           H6         C  98   4.798 -13.507  -3.303
  771    H5'    A  99           H5'        A  99   9.597  -6.487  -0.868
  772   H5''    A  99          H5''        A  99   7.997  -6.451  -1.639
  773    H4'    A  99           H4'        A  99  10.653  -6.432  -3.171
  774    H3'    A  99           H3'        A  99   9.604  -4.295  -1.699
  775    H2'    A  99           H2'        A  99   7.544  -4.259  -2.954
  776   HO2'    A  99          HO2'        A  99   8.459  -2.187  -3.154
  777    H1'    A  99           H1'        A  99   9.297  -4.758  -5.369
  778    H8     A  99           H8         A  99   7.620  -3.621  -6.935
  779    H61    A  99           H61        A  99   2.119  -6.509  -6.925
  780    H62    A  99           H62        A  99   3.114  -5.332  -7.764
  781    H2     A  99           H2         A  99   4.499  -8.032  -3.507
  782    H5'    A 100           H5'        A 100  13.234  -1.277  -4.189
  783   H5''    A 100          H5''        A 100  12.041  -2.375  -4.931
  784    H4'    A 100           H4'        A 100  14.688  -3.464  -5.360
  785    H3'    A 100           H3'        A 100  15.177  -0.901  -5.151
  786    H2'    A 100           H2'        A 100  13.078  -0.254  -6.093
  787   HO2'    A 100          HO2'        A 100  15.072  -0.037  -8.133
  788    H1'    A 100           H1'        A 100  13.716  -1.922  -8.538
  789    H8     A 100           H8         A 100  10.680  -1.799  -6.099
  790    H61    A 100           H61        A 100   7.522   0.024 -11.128
  791    H62    A 100           H62        A 100   7.389  -0.453  -9.441
  792    H2     A 100           H2         A 100  11.803  -0.340 -12.234
  793    H5'    A 101           H5'        A 101  16.807   0.159  -5.302
  794   H5''    A 101          H5''        A 101  18.492  -0.152  -5.831
  795    H4'    A 101           H4'        A 101  18.922  -0.700  -3.392
  796    H3'    A 101           H3'        A 101  16.218   0.001  -3.055
  797   HO3'    A 101          H3T         A 101  16.907  -0.045  -0.795
  798    H2'    A 101           H2'        A 101  16.198   2.276  -2.607
  799   HO2'    A 101          HO2'        A 101  17.601   3.144  -1.052
  800    H1'    A 101           H1'        A 101  18.763   3.184  -3.068
  801    H8     A 101           H8         A 101  17.538   1.584  -6.292
  802    H61    A 101           H61        A 101  14.597   6.964  -7.200
  803    H62    A 101           H62        A 101  15.172   5.495  -7.973
  804    H2     A 101           H2         A 101  15.802   6.767  -2.936
  Start of MODEL   10
    1    H1   MET   1           H1       MET   1   0.060   2.060  -0.272
    2    H2   MET   1           H2       MET   1  -0.850   3.149  -1.103
    3    H3   MET   1           H3       MET   1   0.603   3.600  -0.473
    4    HA   MET   1           HA       MET   1   0.781   3.288  -2.842
    5    HB2  MET   1           HB2      MET   1   2.228   1.358  -1.015
    6    HB3  MET   1           HB3      MET   1   2.601   1.457  -2.748
    7    HG2  MET   1           HG2      MET   1   2.499   4.014  -1.189
    8    HG3  MET   1           HG3      MET   1   3.877   2.932  -0.930
    9    HE1  MET   1           HE1      MET   1   2.832   4.853  -5.015
   10    HE2  MET   1           HE2      MET   1   1.931   3.461  -4.375
   11    HE3  MET   1           HE3      MET   1   1.854   5.033  -3.541
   12    H    VAL   2           H        VAL   2  -1.363   2.722  -3.503
   13    HA   VAL   2           HA       VAL   2  -1.572  -0.135  -4.256
   14    HB   VAL   2           HB       VAL   2  -3.520   0.695  -3.070
   15   HG11  VAL   2          1HG1      VAL   2  -3.600   2.929  -5.143
   16   HG12  VAL   2          HG21      VAL   2  -4.846   2.623  -3.915
   17   HG13  VAL   2          HG31      VAL   2  -3.224   3.126  -3.415
   18   HG21  VAL   2          HG32      VAL   2  -4.264   0.790  -5.999
   19   HG22  VAL   2          1HG2      VAL   2  -3.866  -0.724  -5.140
   20   HG23  VAL   2          HG22      VAL   2  -5.270   0.260  -4.634
   21    H    GLU   3           H        GLU   3   0.053   2.281  -5.259
   22    HA   GLU   3           HA       GLU   3  -1.111   2.938  -7.828
   23    HB2  GLU   3           HB2      GLU   3   1.627   3.567  -6.646
   24    HB3  GLU   3           HB3      GLU   3   0.876   4.399  -8.018
   25    HG2  GLU   3           HG2      GLU   3  -0.201   4.332  -5.168
   26    HG3  GLU   3           HG3      GLU   3   0.685   5.674  -5.901
   27    H    ALA   4           H        ALA   4  -0.773   1.989  -9.708
   28    HA   ALA   4           HA       ALA   4   1.477   0.050  -9.936
   29    HB1  ALA   4           1HB      ALA   4   0.066  -1.287 -11.361
   30    HB2  ALA   4           HB2      ALA   4  -0.772  -0.975  -9.824
   31    HB3  ALA   4           HB3      ALA   4  -1.239  -0.069 -11.283
   32    H    ASP   5           H        ASP   5   3.013   0.990 -11.013
   33    HA   ASP   5           HA       ASP   5   2.528   3.295 -12.714
   34    HB2  ASP   5           HB2      ASP   5   4.379   3.345 -11.193
   35    HB3  ASP   5           HB3      ASP   5   4.993   1.797 -11.780
   36    H    ARG   6           H        ARG   6   2.150   3.300 -14.737
   37    HA   ARG   6           HA       ARG   6   1.933   2.831 -16.908
   38    HB2  ARG   6           HB2      ARG   6   4.820   2.230 -16.347
   39    HB3  ARG   6           HB3      ARG   6   4.170   2.212 -17.994
   40    HG2  ARG   6           HG2      ARG   6   3.466   4.490 -17.874
   41    HG3  ARG   6           HG3      ARG   6   3.767   4.578 -16.128
   42    HD2  ARG   6           2HD      ARG   6   5.958   4.034 -18.163
   43    HD3  ARG   6           3HD      ARG   6   5.529   5.660 -17.583
   44    HE   ARG   6           HE       ARG   6   5.907   4.143 -15.283
   45   HH11  ARG   6          1HH1      ARG   6   7.889   5.096 -18.054
   46   HH12  ARG   6          2HH1      ARG   6   9.379   5.052 -17.143
   47   HH21  ARG   6          1HH2      ARG   6   7.828   4.096 -14.135
   48   HH22  ARG   6          2HH2      ARG   6   9.348   4.505 -14.908
   49    HA   PRO   7           HA       PRO   7   0.602  -1.421 -17.477
   50    HB2  PRO   7           HB2      PRO   7   0.291  -0.137 -20.194
   51    HB3  PRO   7           HB3      PRO   7  -0.833  -1.286 -19.387
   52    HG2  PRO   7           HG2      PRO   7  -1.389   1.327 -19.415
   53    HG3  PRO   7           HG3      PRO   7  -1.544   0.434 -17.860
   54    HD2  PRO   7           2HD      PRO   7   0.730   2.202 -18.801
   55    HD3  PRO   7           3HD      PRO   7  -0.035   2.130 -17.184
   56    H    GLY   8           H        GLY   8   1.565  -3.235 -18.540
   57    HA2  GLY   8           2HA      GLY   8   2.977  -4.288 -20.093
   58    HA3  GLY   8           3HA      GLY   8   3.731  -2.720 -20.479
   59    H    LYS   9           H        LYS   9   3.833  -2.158 -17.422
   60    HA   LYS   9           HA       LYS   9   6.389  -3.527 -17.021
   61    HB2  LYS   9           HB2      LYS   9   6.191  -1.141 -16.445
   62    HB3  LYS   9           HB3      LYS   9   4.962  -1.553 -15.221
   63    HG2  LYS   9           HG2      LYS   9   6.594  -3.085 -14.125
   64    HG3  LYS   9           HG3      LYS   9   7.820  -2.631 -15.321
   65    HD2  LYS   9           2HD      LYS   9   6.471  -0.685 -13.409
   66    HD3  LYS   9           3HD      LYS   9   8.033  -1.481 -13.121
   67    HE2  LYS   9           HE2      LYS   9   8.929  -0.472 -15.206
   68    HE3  LYS   9           HE3      LYS   9   7.378   0.331 -15.496
   69    HZ1  LYS   9           3HZ      LYS   9   9.032   1.746 -14.427
   70    HZ2  LYS   9           1HZ      LYS   9   7.673   1.580 -13.518
   71    HZ3  LYS   9           2HZ      LYS   9   9.045   0.765 -13.109
   72    H    LEU  10           H        LEU  10   6.677  -5.293 -15.812
   73    HA   LEU  10           HA       LEU  10   4.375  -6.308 -14.200
   74    HB2  LEU  10           HB2      LEU  10   6.494  -7.699 -15.852
   75    HB3  LEU  10           HB3      LEU  10   5.436  -8.584 -14.811
   76    HG   LEU  10           HG       LEU  10   4.589  -6.929 -17.230
   77   HD11  LEU  10          1HD1      LEU  10   4.411  -9.926 -16.646
   78   HD12  LEU  10          2HD1      LEU  10   4.163  -9.122 -18.210
   79   HD13  LEU  10          3HD1      LEU  10   5.792  -9.194 -17.471
   80   HD21  LEU  10          3HD2      LEU  10   2.357  -8.009 -16.865
   81   HD22  LEU  10          1HD2      LEU  10   2.923  -8.573 -15.285
   82   HD23  LEU  10          2HD2      LEU  10   2.794  -6.816 -15.615
   83    H    PHE  11           H        PHE  11   4.869  -7.370 -12.287
   84    HA   PHE  11           HA       PHE  11   7.613  -7.002 -11.189
   85    HB2  PHE  11           HB2      PHE  11   5.964  -5.939  -9.798
   86    HB3  PHE  11           HB3      PHE  11   4.881  -7.335  -9.913
   87    HD1  PHE  11           HD1      PHE  11   8.282  -6.350  -8.690
   88    HD2  PHE  11           HD2      PHE  11   4.952  -9.039  -8.285
   89    HE1  PHE  11           HE1      PHE  11   9.303  -7.319  -6.633
   90    HE2  PHE  11           HE2      PHE  11   5.983 -10.012  -6.252
   91    HZ   PHE  11           HZ       PHE  11   8.167  -9.145  -5.435
   92    H    ILE  12           H        ILE  12   8.798  -8.787 -10.754
   93    HA   ILE  12           HA       ILE  12   7.498 -11.422 -11.289
   94    HB   ILE  12           HB       ILE  12  10.376 -10.759 -11.936
   95   HG12  ILE  12          HG21      ILE  12   9.163  -9.145 -13.275
   96   HG13  ILE  12          HG31      ILE  12   9.829 -10.433 -14.273
   97   HG21  ILE  12          1HG2      ILE  12   8.370 -12.817 -12.923
   98   HG22  ILE  12          HG22      ILE  12  10.060 -12.693 -13.461
   99   HG23  ILE  12          HG32      ILE  12   9.683 -13.112 -11.766
  100   HD11  ILE  12          3HD1      ILE  12   6.922 -10.049 -13.493
  101   HD12  ILE  12          1HD1      ILE  12   7.663  -9.911 -15.106
  102   HD13  ILE  12          2HD1      ILE  12   7.533 -11.497 -14.322
  103    H    GLY  13           H        GLY  13   7.185 -11.625  -8.924
  104    HA2  GLY  13           2HA      GLY  13   9.687 -11.656  -7.323
  105    HA3  GLY  13           3HA      GLY  13   8.047 -11.701  -6.690
  106    H    GLY  14           H        GLY  14  10.461 -13.500  -6.212
  107    HA2  GLY  14           2HA      GLY  14  10.162 -15.643  -5.241
  108    HA3  GLY  14           3HA      GLY  14   8.854 -15.994  -6.385
  109    H    LEU  15           H        LEU  15  11.529 -14.468  -7.861
  110    HA   LEU  15           HA       LEU  15  12.105 -16.683  -9.571
  111    HB2  LEU  15           HB2      LEU  15  13.639 -14.132  -8.948
  112    HB3  LEU  15           HB3      LEU  15  13.976 -15.252 -10.300
  113    HG   LEU  15           HG       LEU  15  11.249 -13.974 -10.046
  114   HD11  LEU  15          1HD1      LEU  15  12.102 -12.245 -11.616
  115   HD12  LEU  15          2HD1      LEU  15  12.895 -12.141 -10.019
  116   HD13  LEU  15          3HD1      LEU  15  13.755 -12.867 -11.395
  117   HD21  LEU  15          3HD2      LEU  15  12.978 -14.884 -12.388
  118   HD22  LEU  15          1HD2      LEU  15  11.772 -15.929 -11.599
  119   HD23  LEU  15          2HD2      LEU  15  11.259 -14.452 -12.458
  120    H    ASN  16           H        ASN  16  14.260 -17.652  -9.895
  121    HA   ASN  16           HA       ASN  16  15.394 -18.706  -7.489
  122    HB2  ASN  16           HB2      ASN  16  15.135 -19.854  -9.670
  123    HB3  ASN  16           HB3      ASN  16  16.369 -18.764 -10.357
  124   HD21  ASN  16          2HD2      ASN  16  17.538 -20.661 -10.918
  125   HD22  ASN  16          1HD2      ASN  16  18.338 -21.637  -9.736
  126    H    THR  17           H        THR  17  17.681 -18.436  -6.862
  127    HA   THR  17           HA       THR  17  18.498 -15.647  -6.899
  128    HB   THR  17           HB       THR  17  20.358 -16.472  -5.498
  129    HG1  THR  17           1HG      THR  17  20.660 -18.507  -6.418
  130   HG21  THR  17          1HG2      THR  17  18.125 -16.008  -4.495
  131   HG22  THR  17          HG22      THR  17  17.671 -17.712  -4.770
  132   HG23  THR  17          HG32      THR  17  18.988 -17.307  -3.638
  133    H    GLU  18           H        GLU  18  18.699 -17.952  -9.203
  134    HA   GLU  18           HA       GLU  18  21.516 -17.430  -9.995
  135    HB2  GLU  18           HB2      GLU  18  19.709 -19.645 -10.973
  136    HB3  GLU  18           HB3      GLU  18  21.481 -19.601 -10.955
  137    HG2  GLU  18           HG2      GLU  18  19.673 -19.754  -8.493
  138    HG3  GLU  18           HG3      GLU  18  20.470 -21.119  -9.217
  139    H    THR  19           H        THR  19  18.359 -16.507 -10.678
  140    HA   THR  19           HA       THR  19  18.486 -16.529 -13.587
  141    HB   THR  19           HB       THR  19  16.569 -15.141 -11.672
  142    HG1  THR  19           1HG      THR  19  15.288 -16.979 -12.098
  143   HG21  THR  19          1HG2      THR  19  16.421 -14.257 -13.977
  144   HG22  THR  19          HG22      THR  19  16.300 -15.919 -14.607
  145   HG23  THR  19          HG32      THR  19  15.001 -15.248 -13.594
  146    H    ASN  20           H        ASN  20  18.798 -14.768 -14.945
  147    HA   ASN  20           HA       ASN  20  19.503 -12.175 -13.660
  148    HB2  ASN  20           HB2      ASN  20  20.924 -12.884 -16.157
  149    HB3  ASN  20           HB3      ASN  20  21.454 -11.899 -14.795
  150   HD21  ASN  20          2HD2      ASN  20  21.398 -15.012 -16.292
  151   HD22  ASN  20          1HD2      ASN  20  22.355 -15.864 -15.100
  152    H    GLU  21           H        GLU  21  19.993 -10.777 -15.949
  153    HA   GLU  21           HA       GLU  21  17.290 -10.161 -16.760
  154    HB2  GLU  21           HB2      GLU  21  20.023  -9.175 -17.653
  155    HB3  GLU  21           HB3      GLU  21  18.489  -8.482 -18.230
  156    HG2  GLU  21           HG2      GLU  21  17.841  -7.872 -15.979
  157    HG3  GLU  21           HG3      GLU  21  19.202  -8.752 -15.295
  158    H    LYS  22           H        LYS  22  20.008 -11.946 -18.214
  159    HA   LYS  22           HA       LYS  22  19.015 -11.931 -20.884
  160    HB2  LYS  22           HB2      LYS  22  21.324 -12.625 -19.749
  161    HB3  LYS  22           HB3      LYS  22  20.604 -14.230 -19.723
  162    HG2  LYS  22           HG2      LYS  22  21.139 -12.462 -22.146
  163    HG3  LYS  22           HG3      LYS  22  21.994 -13.940 -21.682
  164    HD2  LYS  22           2HD      LYS  22  19.824 -15.208 -22.001
  165    HD3  LYS  22           3HD      LYS  22  19.135 -13.716 -22.691
  166    HE2  LYS  22           HE2      LYS  22  20.933 -13.648 -24.375
  167    HE3  LYS  22           HE3      LYS  22  21.620 -15.143 -23.707
  168    HZ1  LYS  22           3HZ      LYS  22  18.937 -14.877 -24.893
  169    HZ2  LYS  22           1HZ      LYS  22  20.237 -15.589 -25.607
  170    HZ3  LYS  22           2HZ      LYS  22  19.569 -16.257 -24.267
  171    H    ALA  23           H        ALA  23  18.223 -13.882 -18.018
  172    HA   ALA  23           HA       ALA  23  16.862 -15.923 -19.652
  173    HB1  ALA  23           1HB      ALA  23  17.159 -15.550 -16.642
  174    HB2  ALA  23           HB2      ALA  23  16.450 -16.968 -17.441
  175    HB3  ALA  23           HB3      ALA  23  18.172 -16.586 -17.673
  176    H    LEU  24           H        LEU  24  16.242 -12.954 -18.031
  177    HA   LEU  24           HA       LEU  24  13.404 -13.406 -17.535
  178    HB2  LEU  24           HB2      LEU  24  15.656 -11.643 -16.788
  179    HB3  LEU  24           HB3      LEU  24  14.228 -10.691 -17.072
  180    HG   LEU  24           HG       LEU  24  14.289 -13.208 -15.367
  181   HD11  LEU  24          1HD1      LEU  24  14.612 -10.312 -14.466
  182   HD12  LEU  24          2HD1      LEU  24  14.411 -11.718 -13.391
  183   HD13  LEU  24          3HD1      LEU  24  15.862 -11.585 -14.413
  184   HD21  LEU  24          3HD2      LEU  24  12.066 -12.384 -16.158
  185   HD22  LEU  24          1HD2      LEU  24  12.222 -12.283 -14.384
  186   HD23  LEU  24          2HD2      LEU  24  12.389 -10.814 -15.386
  187    H    GLU  25           H        GLU  25  15.563 -11.850 -19.856
  188    HA   GLU  25           HA       GLU  25  13.344 -10.544 -21.226
  189    HB2  GLU  25           HB2      GLU  25  16.268 -11.082 -21.976
  190    HB3  GLU  25           HB3      GLU  25  15.129 -10.221 -23.044
  191    HG2  GLU  25           HG2      GLU  25  14.663  -8.637 -21.230
  192    HG3  GLU  25           HG3      GLU  25  15.931  -9.394 -20.244
  193    H    ALA  26           H        ALA  26  15.034 -13.556 -21.244
  194    HA   ALA  26           HA       ALA  26  14.235 -14.397 -23.923
  195    HB1  ALA  26           1HB      ALA  26  16.365 -15.059 -22.918
  196    HB2  ALA  26           HB2      ALA  26  15.500 -15.835 -21.567
  197    HB3  ALA  26           HB3      ALA  26  15.361 -16.500 -23.224
  198    H    VAL  27           H        VAL  27  12.885 -14.544 -20.708
  199    HA   VAL  27           HA       VAL  27  11.141 -16.822 -21.442
  200    HB   VAL  27           HB       VAL  27  12.620 -16.723 -19.444
  201   HG11  VAL  27          1HG1      VAL  27  10.478 -14.946 -18.291
  202   HG12  VAL  27          HG21      VAL  27  11.985 -15.509 -17.508
  203   HG13  VAL  27          HG31      VAL  27  12.078 -14.357 -18.862
  204   HG21  VAL  27          HG32      VAL  27   9.638 -17.064 -18.940
  205   HG22  VAL  27          1HG2      VAL  27  10.744 -18.321 -19.572
  206   HG23  VAL  27          HG22      VAL  27  10.953 -17.704 -17.911
  207    H    PHE  28           H        PHE  28  11.059 -13.432 -20.400
  208    HA   PHE  28           HA       PHE  28   8.107 -13.427 -20.650
  209    HB2  PHE  28           HB2      PHE  28  10.058 -11.289 -19.768
  210    HB3  PHE  28           HB3      PHE  28   8.324 -11.033 -19.988
  211    HD1  PHE  28           HD2      PHE  28   6.658 -12.166 -18.569
  212    HD2  PHE  28           HD1      PHE  28  10.877 -12.538 -17.867
  213    HE1  PHE  28           HE2      PHE  28   6.205 -13.080 -16.306
  214    HE2  PHE  28           HE1      PHE  28  10.433 -13.470 -15.620
  215    HZ   PHE  28           HZ       PHE  28   8.093 -13.737 -14.828
  216    H    GLY  29           H        GLY  29  10.827 -12.969 -22.656
  217    HA2  GLY  29           2HA      GLY  29   9.585 -11.059 -24.478
  218    HA3  GLY  29           3HA      GLY  29  11.025 -12.046 -24.805
  219    H    LYS  30           H        LYS  30   8.849 -14.192 -23.653
  220    HA   LYS  30           HA       LYS  30   8.258 -15.299 -26.271
  221    HB2  LYS  30           HB2      LYS  30   7.496 -16.159 -23.434
  222    HB3  LYS  30           HB3      LYS  30   7.388 -17.168 -24.891
  223    HG2  LYS  30           HG2      LYS  30   9.810 -17.022 -25.197
  224    HG3  LYS  30           HG3      LYS  30   9.970 -15.933 -23.822
  225    HD2  LYS  30           2HD      LYS  30  10.619 -18.240 -23.212
  226    HD3  LYS  30           3HD      LYS  30   9.287 -17.619 -22.243
  227    HE2  LYS  30           HE2      LYS  30   8.842 -19.914 -22.835
  228    HE3  LYS  30           HE3      LYS  30   7.663 -18.858 -23.622
  229    HZ1  LYS  30           3HZ      LYS  30  10.061 -20.011 -24.902
  230    HZ2  LYS  30           1HZ      LYS  30   8.515 -20.522 -25.128
  231    HZ3  LYS  30           2HZ      LYS  30   8.971 -19.029 -25.645
  232    H    TYR  31           H        TYR  31   6.783 -13.115 -24.191
  233    HA   TYR  31           HA       TYR  31   4.046 -13.758 -25.195
  234    HB2  TYR  31           HB2      TYR  31   4.980 -12.223 -22.756
  235    HB3  TYR  31           HB3      TYR  31   3.296 -12.551 -23.164
  236    HD1  TYR  31           HD2      TYR  31   2.691 -15.128 -23.342
  237    HD2  TYR  31           HD1      TYR  31   6.223 -13.603 -21.432
  238    HE1  TYR  31           HE2      TYR  31   2.959 -17.280 -22.138
  239    HE2  TYR  31           HE1      TYR  31   6.483 -15.744 -20.185
  240    HH   TYR  31           HH       TYR  31   5.697 -17.881 -19.909
  241    H    GLY  32           H        GLY  32   6.595 -11.348 -25.291
  242    HA2  GLY  32           2HA      GLY  32   5.233  -9.744 -27.216
  243    HA3  GLY  32           3HA      GLY  32   5.107  -8.983 -25.607
  244    H    ARG  33           H        ARG  33   6.344  -7.686 -27.689
  245    HA   ARG  33           HA       ARG  33   9.178  -8.125 -27.587
  246    HB2  ARG  33           HB2      ARG  33   7.620  -7.003 -29.399
  247    HB3  ARG  33           HB3      ARG  33   7.889  -5.527 -28.442
  248    HG2  ARG  33           HG2      ARG  33  10.348  -5.880 -28.652
  249    HG3  ARG  33           HG3      ARG  33  10.015  -7.393 -29.535
  250    HD2  ARG  33           2HD      ARG  33   8.802  -6.073 -31.273
  251    HD3  ARG  33           3HD      ARG  33   9.217  -4.583 -30.416
  252    HE   ARG  33           HE       ARG  33  11.023  -6.318 -31.996
  253   HH11  ARG  33          1HH1      ARG  33  10.727  -3.509 -29.840
  254   HH12  ARG  33          2HH1      ARG  33  12.294  -2.885 -30.276
  255   HH21  ARG  33          1HH2      ARG  33  13.054  -5.454 -32.533
  256   HH22  ARG  33          2HH2      ARG  33  13.606  -3.976 -31.788
  257    H    ILE  34           H        ILE  34  10.363  -7.704 -25.929
  258    HA   ILE  34           HA       ILE  34   9.514  -6.002 -23.727
  259    HB   ILE  34           HB       ILE  34  12.111  -7.447 -24.358
  260   HG12  ILE  34          HG21      ILE  34   9.709  -8.015 -22.567
  261   HG13  ILE  34          HG31      ILE  34  10.197  -8.909 -24.009
  262   HG21  ILE  34          1HG2      ILE  34  12.530  -5.490 -22.885
  263   HG22  ILE  34          HG22      ILE  34  11.275  -6.088 -21.766
  264   HG23  ILE  34          HG32      ILE  34  12.768  -7.019 -22.050
  265   HD11  ILE  34          3HD1      ILE  34  10.856 -10.157 -22.033
  266   HD12  ILE  34          1HD1      ILE  34  12.317  -9.557 -22.867
  267   HD13  ILE  34          2HD1      ILE  34  11.733  -8.762 -21.386
  268    H    VAL  35           H        VAL  35  10.157  -3.996 -23.154
  269    HA   VAL  35           HA       VAL  35  11.902  -2.533 -25.079
  270    HB   VAL  35           HB       VAL  35  10.522  -0.717 -23.352
  271   HG11  VAL  35          1HG1      VAL  35   9.673   0.127 -25.488
  272   HG12  VAL  35          HG21      VAL  35  11.406  -0.274 -25.596
  273   HG13  VAL  35          HG31      VAL  35  10.190  -1.373 -26.298
  274   HG21  VAL  35          HG32      VAL  35   8.763  -2.385 -22.997
  275   HG22  VAL  35          1HG2      VAL  35   8.181  -1.083 -24.058
  276   HG23  VAL  35          HG22      VAL  35   8.626  -2.642 -24.754
  277    H    GLU  36           H        GLU  36  11.459  -3.597 -21.782
  278    HA   GLU  36           HA       GLU  36  14.177  -2.805 -21.122
  279    HB2  GLU  36           HB2      GLU  36  12.955  -0.704 -20.682
  280    HB3  GLU  36           HB3      GLU  36  11.800  -1.576 -19.651
  281    HG2  GLU  36           HG2      GLU  36  13.547  -2.116 -18.051
  282    HG3  GLU  36           HG3      GLU  36  14.784  -1.437 -19.129
  283    H    VAL  37           H        VAL  37  14.964  -3.981 -19.317
  284    HA   VAL  37           HA       VAL  37  12.983  -5.536 -17.778
  285    HB   VAL  37           HB       VAL  37  15.180  -6.699 -19.446
  286   HG11  VAL  37          1HG1      VAL  37  15.996  -7.231 -17.181
  287   HG12  VAL  37          HG21      VAL  37  14.380  -7.860 -16.749
  288   HG13  VAL  37          HG31      VAL  37  15.357  -8.671 -17.994
  289   HG21  VAL  37          HG32      VAL  37  12.512  -7.691 -18.328
  290   HG22  VAL  37          1HG2      VAL  37  12.771  -7.030 -19.962
  291   HG23  VAL  37          HG22      VAL  37  13.517  -8.577 -19.481
  292    H    LEU  38           H        LEU  38  13.440  -5.838 -15.704
  293    HA   LEU  38           HA       LEU  38  15.965  -4.646 -14.573
  294    HB2  LEU  38           HB2      LEU  38  13.104  -4.608 -13.890
  295    HB3  LEU  38           HB3      LEU  38  14.163  -4.795 -12.510
  296    HG   LEU  38           HG       LEU  38  14.272  -2.480 -14.504
  297   HD11  LEU  38          1HD1      LEU  38  12.359  -2.377 -12.971
  298   HD12  LEU  38          2HD1      LEU  38  13.429  -2.650 -11.574
  299   HD13  LEU  38          3HD1      LEU  38  13.575  -1.158 -12.527
  300   HD21  LEU  38          3HD2      LEU  38  15.880  -3.007 -11.974
  301   HD22  LEU  38          1HD2      LEU  38  16.530  -2.926 -13.636
  302   HD23  LEU  38          2HD2      LEU  38  15.846  -1.474 -12.872
  303    H    LEU  39           H        LEU  39  16.940  -5.809 -12.915
  304    HA   LEU  39           HA       LEU  39  15.677  -8.265 -12.023
  305    HB2  LEU  39           HB2      LEU  39  16.936  -8.990 -13.991
  306    HB3  LEU  39           HB3      LEU  39  18.387  -8.149 -13.433
  307    HG   LEU  39           HG       LEU  39  18.206 -10.701 -13.249
  308   HD11  LEU  39          1HD1      LEU  39  19.053  -9.153 -10.768
  309   HD12  LEU  39          2HD1      LEU  39  19.611 -10.762 -11.269
  310   HD13  LEU  39          3HD1      LEU  39  20.013  -9.341 -12.259
  311   HD21  LEU  39          3HD2      LEU  39  16.000 -10.784 -12.123
  312   HD22  LEU  39          1HD2      LEU  39  17.281 -11.629 -11.230
  313   HD23  LEU  39          2HD2      LEU  39  16.732 -10.031 -10.679
  314    H    MET  40           H        MET  40  15.865  -8.154  -9.835
  315    HA   MET  40           HA       MET  40  17.692  -6.050  -8.865
  316    HB2  MET  40           HB2      MET  40  15.581  -7.477  -7.232
  317    HB3  MET  40           HB3      MET  40  16.325  -5.908  -6.935
  318    HG2  MET  40           HG2      MET  40  14.119  -6.688  -8.773
  319    HG3  MET  40           HG3      MET  40  14.270  -5.271  -7.750
  320    HE1  MET  40           HE3      MET  40  15.801  -3.011  -8.601
  321    HE2  MET  40           HE1      MET  40  17.147  -4.168  -8.696
  322    HE3  MET  40           HE2      MET  40  16.760  -3.121 -10.095
  323    H    LYS  41           H        LYS  41  19.374  -6.365  -7.485
  324    HA   LYS  41           HA       LYS  41  19.639  -8.971  -6.187
  325    HB2  LYS  41           HB2      LYS  41  22.224  -8.694  -7.005
  326    HB3  LYS  41           HB3      LYS  41  21.023  -9.762  -7.749
  327    HG2  LYS  41           HG2      LYS  41  20.524  -8.176  -9.464
  328    HG3  LYS  41           HG3      LYS  41  21.541  -6.922  -8.699
  329    HD2  LYS  41           2HD      LYS  41  23.536  -8.335  -9.056
  330    HD3  LYS  41           3HD      LYS  41  22.515  -9.601  -9.787
  331    HE2  LYS  41           HE2      LYS  41  21.814  -8.026 -11.553
  332    HE3  LYS  41           HE3      LYS  41  22.823  -6.758 -10.833
  333    HZ1  LYS  41           3HZ      LYS  41  23.936  -7.859 -12.650
  334    HZ2  LYS  41           1HZ      LYS  41  24.738  -8.142 -11.247
  335    HZ3  LYS  41           2HZ      LYS  41  23.797  -9.321 -11.908
  336    H    ASP  42           H        ASP  42  21.086  -9.044  -4.472
  337    HA   ASP  42           HA       ASP  42  21.039  -6.706  -2.860
  338    HB2  ASP  42           HB2      ASP  42  21.063  -9.280  -2.312
  339    HB3  ASP  42           HB3      ASP  42  22.821  -9.069  -2.339
  340    H    ARG  43           H        ARG  43  22.986  -5.856  -1.692
  341    HA   ARG  43           HA       ARG  43  25.128  -5.290  -3.674
  342    HB2  ARG  43           HB2      ARG  43  25.427  -3.179  -2.505
  343    HB3  ARG  43           HB3      ARG  43  23.751  -3.380  -3.052
  344    HG2  ARG  43           HG2      ARG  43  23.153  -4.177  -0.728
  345    HG3  ARG  43           HG3      ARG  43  24.799  -3.741  -0.209
  346    HD2  ARG  43           2HD      ARG  43  22.786  -1.869  -1.504
  347    HD3  ARG  43           3HD      ARG  43  23.119  -1.955   0.237
  348    HE   ARG  43           HE       ARG  43  25.603  -1.500  -0.790
  349   HH11  ARG  43          1HH1      ARG  43  22.488   0.112  -1.300
  350   HH12  ARG  43          2HH1      ARG  43  23.215   1.668  -1.605
  351   HH21  ARG  43          1HH2      ARG  43  26.517   0.539  -1.216
  352   HH22  ARG  43          2HH2      ARG  43  25.487   1.908  -1.577
  353    H    GLU  44           H        GLU  44  24.561  -7.151  -0.993
  354    HA   GLU  44           HA       GLU  44  27.422  -7.016  -0.126
  355    HB2  GLU  44           HB2      GLU  44  24.958  -8.061   1.310
  356    HB3  GLU  44           HB3      GLU  44  26.616  -8.137   1.932
  357    HG2  GLU  44           HG2      GLU  44  26.758  -5.650   1.812
  358    HG3  GLU  44           HG3      GLU  44  25.065  -5.598   1.287
  359    H    THR  45           H        THR  45  25.120  -8.895  -1.873
  360    HA   THR  45           HA       THR  45  27.063 -11.165  -1.887
  361    HB   THR  45           HB       THR  45  25.167 -12.720  -2.139
  362    HG1  THR  45           1HG      THR  45  23.076 -11.882  -1.702
  363   HG21  THR  45          1HG2      THR  45  24.786 -10.960   0.295
  364   HG22  THR  45          HG22      THR  45  24.340 -12.687   0.116
  365   HG23  THR  45          HG32      THR  45  26.061 -12.204   0.118
  366    H    ASN  46           H        ASN  46  25.188  -8.845  -3.648
  367    HA   ASN  46           HA       ASN  46  24.784  -8.572  -5.860
  368    HB2  ASN  46           HB2      ASN  46  27.219 -10.363  -6.002
  369    HB3  ASN  46           HB3      ASN  46  26.505  -9.575  -7.427
  370   HD21  ASN  46          2HD2      ASN  46  29.019  -8.924  -7.112
  371   HD22  ASN  46          1HD2      ASN  46  29.230  -7.348  -6.370
  372    H    LYS  47           H        LYS  47  23.844 -11.160  -4.290
  373    HA   LYS  47           HA       LYS  47  22.997 -12.869  -6.533
  374    HB2  LYS  47           HB2      LYS  47  22.630 -12.870  -3.522
  375    HB3  LYS  47           HB3      LYS  47  21.642 -13.910  -4.542
  376    HG2  LYS  47           HG2      LYS  47  24.664 -13.897  -4.743
  377    HG3  LYS  47           HG3      LYS  47  23.786 -14.938  -3.586
  378    HD2  LYS  47           2HD      LYS  47  22.480 -15.865  -5.531
  379    HD3  LYS  47           3HD      LYS  47  23.546 -14.945  -6.622
  380    HE2  LYS  47           HE2      LYS  47  25.515 -16.097  -5.641
  381    HE3  LYS  47           HE3      LYS  47  24.438 -17.012  -4.576
  382    HZ1  LYS  47           3HZ      LYS  47  25.020 -18.286  -6.520
  383    HZ2  LYS  47           1HZ      LYS  47  23.409 -17.946  -6.573
  384    HZ3  LYS  47           2HZ      LYS  47  24.447 -17.116  -7.523
  385    H    SER  48           H        SER  48  20.870 -13.141  -7.184
  386    HA   SER  48           HA       SER  48  19.320 -10.821  -7.432
  387    HB2  SER  48           HB2      SER  48  18.375 -13.701  -7.555
  388    HB3  SER  48           HB3      SER  48  17.554 -12.291  -8.260
  389    HG   SER  48           HG       SER  48  18.876 -13.386  -9.788
  390    H    ARG  49           H        ARG  49  17.663  -9.910  -6.331
  391    HA   ARG  49           HA       ARG  49  17.378 -10.384  -3.506
  392    HB2  ARG  49           HB2      ARG  49  15.686  -8.870  -5.522
  393    HB3  ARG  49           HB3      ARG  49  15.496  -8.744  -3.760
  394    HG2  ARG  49           HG2      ARG  49  18.123  -8.090  -5.114
  395    HG3  ARG  49           HG3      ARG  49  16.816  -6.902  -5.048
  396    HD2  ARG  49           2HD      ARG  49  18.011  -8.243  -2.609
  397    HD3  ARG  49           3HD      ARG  49  18.467  -6.636  -3.259
  398    HE   ARG  49           HE       ARG  49  15.719  -6.515  -2.934
  399   HH11  ARG  49          1HH1      ARG  49  18.473  -7.174  -0.799
  400   HH12  ARG  49          2HH1      ARG  49  17.678  -6.534   0.613
  401   HH21  ARG  49          1HH2      ARG  49  14.705  -5.694  -1.066
  402   HH22  ARG  49          2HH2      ARG  49  15.564  -5.683   0.460
  403    H    GLY  50           H        GLY  50  16.217 -12.063  -6.180
  404    HA2  GLY  50           2HA      GLY  50  14.789 -13.903  -6.200
  405    HA3  GLY  50           3HA      GLY  50  14.098 -13.415  -4.636
  406    H    PHE  51           H        PHE  51  14.198 -10.597  -6.494
  407    HA   PHE  51           HA       PHE  51  11.753 -11.250  -8.024
  408    HB2  PHE  51           HB2      PHE  51  10.560  -9.361  -7.201
  409    HB3  PHE  51           HB3      PHE  51  11.009 -10.390  -5.845
  410    HD1  PHE  51           HD2      PHE  51  12.852  -9.678  -4.292
  411    HD2  PHE  51           HD1      PHE  51  11.336  -7.120  -7.393
  412    HE1  PHE  51           HE2      PHE  51  13.814  -7.703  -3.133
  413    HE2  PHE  51           HE1      PHE  51  12.275  -5.153  -6.230
  414    HZ   PHE  51           HZ       PHE  51  13.544  -5.435  -4.117
  415    H    ALA  52           H        ALA  52  11.194  -9.580  -9.611
  416    HA   ALA  52           HA       ALA  52  13.346  -7.769 -10.464
  417    HB1  ALA  52           1HB      ALA  52  12.459 -10.174 -12.114
  418    HB2  ALA  52           HB2      ALA  52  13.582  -8.911 -12.641
  419    HB3  ALA  52           HB3      ALA  52  14.038 -10.001 -11.312
  420    H    PHE  53           H        PHE  53  12.592  -7.010 -12.887
  421    HA   PHE  53           HA       PHE  53   9.653  -6.799 -13.024
  422    HB2  PHE  53           HB2      PHE  53  11.497  -4.368 -13.026
  423    HB3  PHE  53           HB3      PHE  53   9.789  -4.347 -13.370
  424    HD1  PHE  53           HD2      PHE  53  12.305  -5.162 -10.754
  425    HD2  PHE  53           HD1      PHE  53   8.258  -4.037 -11.610
  426    HE1  PHE  53           HE2      PHE  53  11.898  -4.810  -8.328
  427    HE2  PHE  53           HE1      PHE  53   7.842  -3.671  -9.187
  428    HZ   PHE  53           HZ       PHE  53   9.658  -4.072  -7.544
  429    H    VAL  54           H        VAL  54   8.967  -5.918 -15.173
  430    HA   VAL  54           HA       VAL  54  11.010  -5.788 -17.276
  431    HB   VAL  54           HB       VAL  54  10.622  -8.211 -17.149
  432   HG11  VAL  54          1HG1      VAL  54   7.730  -7.682 -17.452
  433   HG12  VAL  54          HG21      VAL  54   8.607  -9.259 -17.480
  434   HG13  VAL  54          HG31      VAL  54   8.638  -8.266 -16.001
  435   HG21  VAL  54          HG32      VAL  54   8.952  -7.143 -19.481
  436   HG22  VAL  54          1HG2      VAL  54  10.719  -7.029 -19.466
  437   HG23  VAL  54          HG22      VAL  54   9.927  -8.625 -19.439
  438    H    THR  55           H        THR  55  10.304  -4.633 -19.059
  439    HA   THR  55           HA       THR  55   7.487  -3.653 -18.921
  440    HB   THR  55           HB       THR  55   9.879  -2.188 -20.073
  441    HG1  THR  55           1HG      THR  55   9.632  -0.918 -18.213
  442   HG21  THR  55          1HG2      THR  55   6.979  -1.405 -19.528
  443   HG22  THR  55          HG22      THR  55   8.255  -0.280 -20.048
  444   HG23  THR  55          HG32      THR  55   7.736  -1.592 -21.123
  445    H    PHE  56           H        PHE  56   6.234  -4.344 -20.477
  446    HA   PHE  56           HA       PHE  56   7.328  -5.427 -22.988
  447    HB2  PHE  56           HB2      PHE  56   4.595  -5.320 -21.683
  448    HB3  PHE  56           HB3      PHE  56   4.856  -5.926 -23.317
  449    HD1  PHE  56           HD1      PHE  56   6.338  -6.497 -19.855
  450    HD2  PHE  56           HD2      PHE  56   5.040  -8.144 -23.617
  451    HE1  PHE  56           HE1      PHE  56   6.883  -8.767 -19.051
  452    HE2  PHE  56           HE2      PHE  56   5.526 -10.407 -22.787
  453    HZ   PHE  56           HZ       PHE  56   6.393 -10.744 -20.487
  454    H    GLU  57           H        GLU  57   6.571  -4.737 -25.099
  455    HA   GLU  57           HA       GLU  57   6.133  -1.904 -25.364
  456    HB2  GLU  57           HB2      GLU  57   6.273  -4.315 -27.198
  457    HB3  GLU  57           HB3      GLU  57   5.660  -2.763 -27.776
  458    HG2  GLU  57           HG2      GLU  57   7.777  -1.681 -26.883
  459    HG3  GLU  57           HG3      GLU  57   8.409  -3.323 -26.617
  460    H    SER  58           H        SER  58   4.008  -4.741 -25.047
  461    HA   SER  58           HA       SER  58   1.706  -2.873 -25.473
  462    HB2  SER  58           HB2      SER  58   1.692  -4.519 -27.235
  463    HB3  SER  58           HB3      SER  58   1.983  -5.832 -26.071
  464    HG   SER  58           HG       SER  58  -0.242  -5.596 -26.681
  465    HA   PRO  59           HA       PRO  59   0.949  -3.652 -21.245
  466    HB2  PRO  59           HB2      PRO  59  -1.588  -2.736 -20.992
  467    HB3  PRO  59           HB3      PRO  59  -0.253  -1.612 -21.444
  468    HG2  PRO  59           HG2      PRO  59  -2.149  -3.086 -23.291
  469    HG3  PRO  59           HG3      PRO  59  -1.870  -1.315 -23.223
  470    HD2  PRO  59           2HD      PRO  59  -0.498  -2.851 -24.992
  471    HD3  PRO  59           3HD      PRO  59   0.364  -1.567 -24.085
  472    H    ALA  60           H        ALA  60  -0.510  -5.333 -23.853
  473    HA   ALA  60           HA       ALA  60  -2.023  -7.073 -21.978
  474    HB1  ALA  60           1HB      ALA  60  -3.425  -7.654 -23.910
  475    HB2  ALA  60           HB2      ALA  60  -3.446  -5.910 -23.573
  476    HB3  ALA  60           HB3      ALA  60  -2.481  -6.541 -24.935
  477    H    ASP  61           H        ASP  61   0.680  -6.887 -24.187
  478    HA   ASP  61           HA       ASP  61   0.978  -9.760 -24.483
  479    HB2  ASP  61           HB2      ASP  61   2.941  -7.419 -24.559
  480    HB3  ASP  61           HB3      ASP  61   3.411  -9.056 -24.806
  481    H    ALA  62           H        ALA  62   1.629  -7.281 -22.062
  482    HA   ALA  62           HA       ALA  62   3.195  -8.986 -20.324
  483    HB1  ALA  62           1HB      ALA  62   1.702  -6.376 -19.857
  484    HB2  ALA  62           HB2      ALA  62   2.820  -7.140 -18.711
  485    HB3  ALA  62           HB3      ALA  62   3.425  -6.559 -20.289
  486    H    LYS  63           H        LYS  63  -0.272  -8.251 -20.800
  487    HA   LYS  63           HA       LYS  63  -1.167  -9.518 -18.354
  488    HB2  LYS  63           HB2      LYS  63  -2.516  -8.997 -21.033
  489    HB3  LYS  63           HB3      LYS  63  -3.346  -9.696 -19.637
  490    HG2  LYS  63           HG2      LYS  63  -2.940  -7.711 -18.292
  491    HG3  LYS  63           HG3      LYS  63  -1.925  -7.012 -19.570
  492    HD2  LYS  63           2HD      LYS  63  -4.171  -5.994 -19.584
  493    HD3  LYS  63           3HD      LYS  63  -3.876  -6.881 -21.077
  494    HE2  LYS  63           HE2      LYS  63  -5.115  -8.843 -20.157
  495    HE3  LYS  63           HE3      LYS  63  -5.418  -7.942 -18.667
  496    HZ1  LYS  63           3HZ      LYS  63  -6.631  -6.321 -19.972
  497    HZ2  LYS  63           1HZ      LYS  63  -6.359  -7.170 -21.351
  498    HZ3  LYS  63           2HZ      LYS  63  -7.278  -7.822 -20.158
  499    H    ASP  64           H        ASP  64  -0.447 -10.607 -21.676
  500    HA   ASP  64           HA       ASP  64  -1.579 -13.219 -21.302
  501    HB2  ASP  64           HB2      ASP  64  -1.095 -11.959 -23.472
  502    HB3  ASP  64           HB3      ASP  64   0.617 -12.329 -23.219
  503    H    ALA  65           H        ALA  65   1.586 -11.758 -20.734
  504    HA   ALA  65           HA       ALA  65   2.888 -14.269 -20.064
  505    HB1  ALA  65           1HB      ALA  65   4.682 -12.878 -19.253
  506    HB2  ALA  65           HB2      ALA  65   4.092 -12.174 -20.777
  507    HB3  ALA  65           HB3      ALA  65   3.637 -11.436 -19.228
  508    H    ALA  66           H        ALA  66   1.363 -11.582 -18.207
  509    HA   ALA  66           HA       ALA  66   1.953 -12.728 -15.660
  510    HB1  ALA  66           1HB      ALA  66   0.466 -10.936 -14.836
  511    HB2  ALA  66           HB2      ALA  66   1.516 -10.301 -16.128
  512    HB3  ALA  66           HB3      ALA  66  -0.174 -10.691 -16.481
  513    H    ARG  67           H        ARG  67  -0.294 -13.603 -18.041
  514    HA   ARG  67           HA       ARG  67  -2.046 -15.045 -16.120
  515    HB2  ARG  67           HB2      ARG  67  -2.239 -14.374 -19.068
  516    HB3  ARG  67           HB3      ARG  67  -3.364 -15.481 -18.257
  517    HG2  ARG  67           HG2      ARG  67  -4.118 -13.788 -16.737
  518    HG3  ARG  67           HG3      ARG  67  -2.853 -12.655 -17.236
  519    HD2  ARG  67           2HD      ARG  67  -5.004 -12.037 -18.199
  520    HD3  ARG  67           3HD      ARG  67  -3.855 -12.442 -19.465
  521    HE   ARG  67           HE       ARG  67  -6.182 -14.085 -18.574
  522   HH11  ARG  67          1HH1      ARG  67  -3.579 -13.530 -20.893
  523   HH12  ARG  67          2HH1      ARG  67  -4.206 -14.681 -22.052
  524   HH21  ARG  67          1HH2      ARG  67  -6.975 -15.574 -20.092
  525   HH22  ARG  67          2HH2      ARG  67  -6.125 -15.836 -21.596
  526    H    ASP  68           H        ASP  68   0.932 -15.756 -17.344
  527    HA   ASP  68           HA       ASP  68   0.213 -18.592 -17.944
  528    HB2  ASP  68           HB2      ASP  68   1.699 -16.472 -19.429
  529    HB3  ASP  68           HB3      ASP  68   2.578 -17.940 -19.217
  530    H    MET  69           H        MET  69   2.709 -16.207 -17.266
  531    HA   MET  69           HA       MET  69   4.597 -18.054 -16.122
  532    HB2  MET  69           HB2      MET  69   4.315 -15.064 -16.637
  533    HB3  MET  69           HB3      MET  69   5.624 -15.661 -15.672
  534    HG2  MET  69           HG2      MET  69   4.989 -16.448 -18.533
  535    HG3  MET  69           HG3      MET  69   6.298 -15.385 -18.005
  536    HE1  MET  69           HE3      MET  69   6.919 -17.373 -15.252
  537    HE2  MET  69           HE1      MET  69   8.444 -18.044 -15.867
  538    HE3  MET  69           HE2      MET  69   8.078 -16.315 -16.091
  539    H    ASN  70           H        ASN  70   1.909 -16.207 -14.872
  540    HA   ASN  70           HA       ASN  70   3.027 -15.845 -12.227
  541    HB2  ASN  70           HB2      ASN  70   1.210 -14.427 -13.156
  542    HB3  ASN  70           HB3      ASN  70   0.141 -15.826 -13.190
  543   HD21  ASN  70          2HD2      ASN  70  -1.207 -14.344 -11.819
  544   HD22  ASN  70          1HD2      ASN  70  -0.912 -14.337 -10.092
  545    H    GLY  71           H        GLY  71   3.434 -17.423 -10.830
  546    HA2  GLY  71           2HA      GLY  71   2.811 -19.174  -9.400
  547    HA3  GLY  71           3HA      GLY  71   1.522 -19.645 -10.521
  548    H    LYS  72           H        LYS  72   4.002 -19.278 -12.650
  549    HA   LYS  72           HA       LYS  72   4.795 -22.114 -12.451
  550    HB2  LYS  72           HB2      LYS  72   5.216 -22.119 -14.560
  551    HB3  LYS  72           HB3      LYS  72   4.013 -20.823 -14.543
  552    HG2  LYS  72           HG2      LYS  72   5.667 -19.170 -14.984
  553    HG3  LYS  72           HG3      LYS  72   7.006 -20.199 -14.463
  554    HD2  LYS  72           2HD      LYS  72   7.017 -20.221 -16.863
  555    HD3  LYS  72           3HD      LYS  72   6.499 -21.813 -16.256
  556    HE2  LYS  72           HE2      LYS  72   4.165 -21.295 -16.688
  557    HE3  LYS  72           HE3      LYS  72   4.579 -19.614 -17.066
  558    HZ1  LYS  72           3HZ      LYS  72   5.411 -21.977 -18.627
  559    HZ2  LYS  72           1HZ      LYS  72   4.232 -20.925 -19.056
  560    HZ3  LYS  72           2HZ      LYS  72   5.795 -20.417 -18.981
  561    H    SER  73           H        SER  73   7.135 -22.404 -13.295
  562    HA   SER  73           HA       SER  73   8.867 -20.972 -11.307
  563    HB2  SER  73           HB2      SER  73   8.581 -23.396 -10.939
  564    HB3  SER  73           HB3      SER  73   9.072 -23.717 -12.612
  565    HG   SER  73           HG       SER  73  10.797 -23.968 -11.154
  566    H    LEU  74           H        LEU  74  10.875 -20.257 -11.809
  567    HA   LEU  74           HA       LEU  74  11.077 -19.530 -14.684
  568    HB2  LEU  74           HB2      LEU  74  11.292 -17.870 -12.549
  569    HB3  LEU  74           HB3      LEU  74  12.921 -18.462 -12.550
  570    HG   LEU  74           HG       LEU  74  12.802 -16.407 -13.789
  571   HD11  LEU  74          1HD1      LEU  74  13.137 -18.615 -15.843
  572   HD12  LEU  74          2HD1      LEU  74  13.812 -16.975 -15.891
  573   HD13  LEU  74          3HD1      LEU  74  14.386 -18.119 -14.662
  574   HD21  LEU  74          3HD2      LEU  74  11.370 -16.102 -15.710
  575   HD22  LEU  74          1HD2      LEU  74  10.887 -17.813 -15.699
  576   HD23  LEU  74          2HD2      LEU  74  10.364 -16.729 -14.385
  577    H    ASP  75           H        ASP  75  13.355 -20.379 -12.104
  578    HA   ASP  75           HA       ASP  75  14.943 -21.925 -14.093
  579    HB2  ASP  75           HB2      ASP  75  15.816 -19.539 -13.120
  580    HB3  ASP  75           HB3      ASP  75  16.028 -20.446 -11.688
  581    H    GLY  76           H        GLY  76  12.931 -22.259 -11.670
  582    HA2  GLY  76           2HA      GLY  76  13.109 -24.756 -10.984
  583    HA3  GLY  76           3HA      GLY  76  14.556 -24.176 -10.111
  584    H    LYS  77           H        LYS  77  12.836 -21.515  -9.961
  585    HA   LYS  77           HA       LYS  77  11.430 -22.272  -7.452
  586    HB2  LYS  77           HB2      LYS  77  12.757 -19.627  -8.135
  587    HB3  LYS  77           HB3      LYS  77  11.997 -20.071  -6.600
  588    HG2  LYS  77           HG2      LYS  77  14.458 -21.366  -7.869
  589    HG3  LYS  77           HG3      LYS  77  14.462 -20.270  -6.477
  590    HD2  LYS  77           2HD      LYS  77  13.394 -21.876  -5.068
  591    HD3  LYS  77           3HD      LYS  77  12.985 -22.931  -6.433
  592    HE2  LYS  77           HE2      LYS  77  15.332 -23.339  -6.914
  593    HE3  LYS  77           HE3      LYS  77  15.822 -22.268  -5.585
  594    HZ1  LYS  77           3HZ      LYS  77  15.849 -24.567  -4.919
  595    HZ2  LYS  77           1HZ      LYS  77  14.701 -23.753  -4.067
  596    HZ3  LYS  77           2HZ      LYS  77  14.260 -24.751  -5.298
  597    H    ALA  78           H        ALA  78   9.349 -21.697  -7.218
  598    HA   ALA  78           HA       ALA  78   7.934 -20.898  -9.612
  599    HB1  ALA  78           1HB      ALA  78   7.057 -22.590  -8.088
  600    HB2  ALA  78           HB2      ALA  78   6.948 -21.381  -6.784
  601    HB3  ALA  78           HB3      ALA  78   5.936 -21.221  -8.245
  602    H    ILE  79           H        ILE  79   6.964 -18.983 -10.112
  603    HA   ILE  79           HA       ILE  79   7.762 -16.732  -8.368
  604    HB   ILE  79           HB       ILE  79   8.021 -15.384 -10.288
  605   HG12  ILE  79          HG21      ILE  79   7.036 -17.694 -12.018
  606   HG13  ILE  79          HG31      ILE  79   6.068 -16.276 -11.578
  607   HG21  ILE  79          1HG2      ILE  79   9.227 -18.115 -10.911
  608   HG22  ILE  79          HG22      ILE  79   9.837 -16.531 -11.430
  609   HG23  ILE  79          HG32      ILE  79   9.859 -16.971  -9.704
  610   HD11  ILE  79          3HD1      ILE  79   7.826 -14.815 -12.605
  611   HD12  ILE  79          1HD1      ILE  79   8.639 -16.286 -13.192
  612   HD13  ILE  79          2HD1      ILE  79   7.001 -15.880 -13.758
  613    H    LYS  80           H        LYS  80   6.587 -14.699  -8.887
  614    HA   LYS  80           HA       LYS  80   3.653 -15.030  -9.270
  615    HB2  LYS  80           HB2      LYS  80   4.384 -14.302  -6.952
  616    HB3  LYS  80           HB3      LYS  80   5.183 -12.913  -7.699
  617    HG2  LYS  80           HG2      LYS  80   2.907 -12.308  -8.733
  618    HG3  LYS  80           HG3      LYS  80   2.200 -13.518  -7.645
  619    HD2  LYS  80           2HD      LYS  80   3.116 -12.272  -5.704
  620    HD3  LYS  80           3HD      LYS  80   3.865 -11.102  -6.828
  621    HE2  LYS  80           HE2      LYS  80   1.637 -10.558  -7.740
  622    HE3  LYS  80           HE3      LYS  80   0.885 -11.636  -6.554
  623    HZ1  LYS  80           3HZ      LYS  80   0.894  -9.326  -5.864
  624    HZ2  LYS  80           1HZ      LYS  80   1.766 -10.251  -4.814
  625    HZ3  LYS  80           2HZ      LYS  80   2.528  -9.272  -5.897
  626    H    VAL  81           H        VAL  81   2.759 -13.618 -10.825
  627    HA   VAL  81           HA       VAL  81   4.545 -11.489 -11.874
  628    HB   VAL  81           HB       VAL  81   2.940 -13.370 -13.643
  629   HG11  VAL  81          1HG1      VAL  81   4.819 -11.055 -14.264
  630   HG12  VAL  81          HG21      VAL  81   4.058 -12.129 -15.460
  631   HG13  VAL  81          HG31      VAL  81   3.048 -11.048 -14.480
  632   HG21  VAL  81          HG32      VAL  81   5.940 -13.032 -13.214
  633   HG22  VAL  81          1HG2      VAL  81   4.976 -14.475 -12.804
  634   HG23  VAL  81          HG22      VAL  81   5.196 -13.999 -14.500
  635    H    GLU  82           H        GLU  82   3.573  -9.576 -12.065
  636    HA   GLU  82           HA       GLU  82   0.664  -9.319 -12.186
  637    HB2  GLU  82           HB2      GLU  82   1.202  -9.880  -9.780
  638    HB3  GLU  82           HB3      GLU  82   2.207  -8.428  -9.704
  639    HG2  GLU  82           HG2      GLU  82   0.268  -7.003 -10.079
  640    HG3  GLU  82           HG3      GLU  82  -0.737  -8.414 -10.454
  641    H    GLN  83           H        GLN  83   0.076  -6.914 -12.312
  642    HA   GLN  83           HA       GLN  83   2.101  -5.463 -13.767
  643    HB2  GLN  83           HB2      GLN  83  -0.532  -5.367 -13.820
  644    HB3  GLN  83           HB3      GLN  83  -0.350  -4.145 -12.558
  645    HG2  GLN  83           HG2      GLN  83   1.157  -4.007 -15.210
  646    HG3  GLN  83           HG3      GLN  83  -0.501  -3.429 -15.063
  647   HE21  GLN  83          HE22      GLN  83   2.873  -2.820 -14.176
  648   HE22  GLN  83          HE12      GLN  83   2.609  -1.198 -13.578
  649    H    ALA  84           H        ALA  84   3.722  -4.224 -12.943
  650    HA   ALA  84           HA       ALA  84   4.309  -4.516 -10.186
  651    HB1  ALA  84           1HB      ALA  84   6.258  -3.093 -10.710
  652    HB2  ALA  84           HB2      ALA  84   6.009  -4.342 -11.958
  653    HB3  ALA  84           HB3      ALA  84   5.517  -2.654 -12.261
  654    H    THR  85           H        THR  85   4.503  -3.073  -8.490
  655    HA   THR  85           HA       THR  85   3.016  -0.509  -8.785
  656    HB   THR  85           HB       THR  85   2.886  -0.538  -6.315
  657    HG1  THR  85           1HG      THR  85   4.622  -1.903  -5.872
  658   HG21  THR  85          1HG2      THR  85   1.158  -2.281  -6.145
  659   HG22  THR  85          HG22      THR  85   1.026  -1.452  -7.711
  660   HG23  THR  85          HG32      THR  85   1.768  -3.061  -7.625
  661    H    LYS  86           H        LYS  86   3.856   1.220  -7.283
  662    HA   LYS  86           HA       LYS  86   6.576   1.805  -7.991
  663    HB2  LYS  86           HB2      LYS  86   4.596   3.096  -6.068
  664    HB3  LYS  86           HB3      LYS  86   6.168   3.799  -6.508
  665    HG2  LYS  86           HG2      LYS  86   5.485   3.698  -8.923
  666    HG3  LYS  86           HG3      LYS  86   3.889   3.104  -8.414
  667    HD2  LYS  86           2HD      LYS  86   3.556   5.195  -7.097
  668    HD3  LYS  86           3HD      LYS  86   5.132   5.784  -7.689
  669    HE2  LYS  86           HE2      LYS  86   4.294   5.509 -10.032
  670    HE3  LYS  86           HE3      LYS  86   2.715   5.036  -9.391
  671    HZ1  LYS  86           3HZ      LYS  86   4.038   7.631  -8.935
  672    HZ2  LYS  86           1HZ      LYS  86   2.785   7.364  -9.961
  673    HZ3  LYS  86           2HZ      LYS  86   2.565   7.192  -8.341
  674    HA   PRO  87           HA       PRO  87   8.806  -0.104  -4.762
  675    HB2  PRO  87           HB2      PRO  87  10.908   1.603  -4.303
  676    HB3  PRO  87           HB3      PRO  87  10.732   0.665  -5.810
  677    HG2  PRO  87           HG2      PRO  87   9.868   3.534  -5.330
  678    HG3  PRO  87           HG3      PRO  87  10.861   2.887  -6.678
  679    HD2  PRO  87           2HD      PRO  87   8.197   3.273  -6.967
  680    HD3  PRO  87           3HD      PRO  87   8.973   1.816  -7.659
  681    H    SER  88           H        SER  88   9.082  -0.120  -2.492
  682    HA   SER  88           HA       SER  88   7.208   1.651  -1.139
  683    HB2  SER  88           HB2      SER  88   8.844  -0.728  -0.163
  684    HB3  SER  88           HB3      SER  88   7.574   0.096   0.768
  685    HG   SER  88           HG       SER  88   6.811  -1.758  -0.360
  686    H    PHE  89           H        PHE  89  10.385   2.065  -1.919
  687    HA   PHE  89           HA       PHE  89  10.778   3.793   0.475
  688    HB2  PHE  89           HB2      PHE  89  13.107   3.500   0.338
  689    HB3  PHE  89           HB3      PHE  89  12.398   1.882   0.252
  690    HD1  PHE  89           HD2      PHE  89  12.295   0.691  -1.957
  691    HD2  PHE  89           HD1      PHE  89  14.414   4.390  -1.421
  692    HE1  PHE  89           HE2      PHE  89  13.512   0.307  -4.086
  693    HE2  PHE  89           HE1      PHE  89  15.633   4.008  -3.549
  694    HZ   PHE  89           HZ       PHE  89  15.131   1.990  -4.911
  695    H    GLU  90           H        GLU  90   9.536   3.970  -2.364
  696    HA   GLU  90           HA       GLU  90   9.318   5.325  -4.102
  697    HB2  GLU  90           HB2      GLU  90   9.111   7.633  -3.649
  698    HB3  GLU  90           HB3      GLU  90   8.556   6.722  -2.233
  699    HG2  GLU  90           HG2      GLU  90  10.557   7.273  -1.002
  700    HG3  GLU  90           HG3      GLU  90  11.353   7.899  -2.457
  701    H    SER  91           H        SER  91  10.276   7.310  -5.397
  702    HA   SER  91           HA       SER  91  13.196   7.067  -5.664
  703    HB2  SER  91           HB2      SER  91  12.181   5.159  -6.936
  704    HB3  SER  91           HB3      SER  91  11.296   6.336  -7.926
  705    HG   SER  91           HG       SER  91  13.287   5.704  -8.874
  706    H    GLY  92           H        GLY  92  14.044   8.597  -7.305
  707    HA2  GLY  92           2HA      GLY  92  14.094  10.604  -8.422
  708    HA3  GLY  92           3HA      GLY  92  12.321  10.668  -8.365
  709    H    ARG  93           H        ARG  93  13.362  10.132  -5.253
  710    HA   ARG  93           HA       ARG  93  13.433  11.320  -3.348
  711    HB2  ARG  93           HB2      ARG  93  15.558  12.054  -4.456
  712    HB3  ARG  93           HB3      ARG  93  14.715  13.505  -5.019
  713    HG2  ARG  93           HG2      ARG  93  14.232  14.114  -2.634
  714    HG3  ARG  93           HG3      ARG  93  15.155  12.686  -2.116
  715    HD2  ARG  93           2HD      ARG  93  17.145  13.582  -3.312
  716    HD3  ARG  93           3HD      ARG  93  16.201  14.999  -3.803
  717    HE   ARG  93           HE       ARG  93  17.312  14.413  -1.139
  718   HH11  ARG  93          1HH1      ARG  93  15.066  16.391  -3.021
  719   HH12  ARG  93          2HH1      ARG  93  15.009  17.667  -1.824
  720   HH21  ARG  93          1HH2      ARG  93  17.207  16.087   0.407
  721   HH22  ARG  93          2HH2      ARG  93  16.212  17.492   0.106
  722    H    ARG  94           H        ARG  94  11.573  12.581  -5.945
  723    HA   ARG  94           HA       ARG  94   9.839  14.003  -4.042
  724    HB2  ARG  94           HB2      ARG  94  11.576  15.648  -4.771
  725    HB3  ARG  94           HB3      ARG  94  11.087  15.388  -6.452
  726    HG2  ARG  94           HG2      ARG  94   8.825  16.240  -5.948
  727    HG3  ARG  94           HG3      ARG  94   9.256  16.404  -4.228
  728    HD2  ARG  94           2HD      ARG  94   9.409  18.573  -5.329
  729    HD3  ARG  94           3HD      ARG  94  11.029  18.028  -4.855
  730    HE   ARG  94           HE       ARG  94  10.430  17.224  -7.555
  731   HH11  ARG  94          1HH1      ARG  94  11.308  20.050  -5.619
  732   HH12  ARG  94          2HH1      ARG  94  12.081  20.871  -6.956
  733   HH21  ARG  94          1HH2      ARG  94  11.462  18.311  -9.274
  734   HH22  ARG  94          2HH2      ARG  94  12.164  19.891  -9.018
  735    H    GLY  95           H        GLY  95   7.722  14.360  -4.873
  736    HA2  GLY  95           2HA      GLY  95   6.894  13.826  -7.532
  737    HA3  GLY  95           3HA      GLY  95   6.721  12.337  -6.582
  738    H5'    A  96           H5'        A  96   6.763  -8.708   3.016
  739   H5''    A  96          H5''        A  96   6.723  -6.940   3.006
  740    H4'    A  96           H4'        A  96   7.454  -8.730   5.390
  741    H3'    A  96           H3'        A  96   4.905  -7.624   4.369
  742    H2'    A  96           H2'        A  96   4.365  -6.202   6.150
  743   HO2'    A  96          HO2'        A  96   4.907  -7.830   7.779
  744    H1'    A  96           H1'        A  96   6.771  -5.158   6.742
  745    H8     A  96           H8         A  96   7.750  -5.131   3.389
  746    H61    A  96           H61        A  96   3.156  -1.253   1.857
  747    H62    A  96           H62        A  96   4.684  -1.936   1.336
  748    H2     A  96           H2         A  96   2.236  -2.975   5.837
  749   HO5'    A  96          H5T         A  96   8.706  -7.857   2.207
  750    H5'    U  97           H5'        U  97   2.495  -8.534   5.131
  751   H5''    U  97          H5''        U  97   1.807 -10.143   4.898
  752    H4'    U  97           H4'        U  97   1.468  -9.690   2.510
  753    H3'    U  97           H3'        U  97   3.265  -7.586   2.771
  754    H2'    U  97           H2'        U  97   2.021  -5.736   3.384
  755   HO2'    U  97          HO2'        U  97   1.515  -5.510   1.158
  756    H1'    U  97           H1'        U  97  -0.652  -6.579   3.425
  757    H3     U  97           H3         U  97  -1.320  -6.175   7.861
  758    H5     U  97           H5         U  97   2.847  -5.946   7.434
  759    H6     U  97           H6         U  97   2.585  -6.575   5.093
  760    H5'    C  98           H5'        C  98   4.733  -8.852   1.645
  761   H5''    C  98          H5''        C  98   5.756  -7.543   1.022
  762    H4'    C  98           H4'        C  98   7.106  -9.477   1.001
  763    H3'    C  98           H3'        C  98   6.746  -8.130  -1.358
  764    H2'    C  98           H2'        C  98   4.877  -9.412  -2.103
  765   HO2'    C  98          HO2'        C  98   6.583  -9.555  -3.691
  766    H1'    C  98           H1'        C  98   6.158 -12.010  -1.356
  767    H41    C  98           H41        C  98   0.045 -13.496  -2.405
  768    H42    C  98           H42        C  98  -0.484 -12.366  -1.173
  769    H5     C  98           H5         C  98   1.073 -10.912   0.048
  770    H6     C  98           H6         C  98   3.414 -10.281   0.272
  771    H5'    A  99           H5'        A  99   9.527  -6.013  -1.009
  772   H5''    A  99          H5''        A  99   8.066  -6.585  -1.841
  773    H4'    A  99           H4'        A  99  10.613  -6.067  -3.397
  774    H3'    A  99           H3'        A  99   9.485  -4.021  -1.905
  775    H2'    A  99           H2'        A  99   7.331  -4.164  -3.052
  776   HO2'    A  99          HO2'        A  99   8.316  -2.022  -3.395
  777    H1'    A  99           H1'        A  99   9.066  -4.576  -5.499
  778    H8     A  99           H8         A  99   7.344  -3.563  -7.079
  779    H61    A  99           H61        A  99   2.091  -6.881  -7.190
  780    H62    A  99           H62        A  99   3.001  -5.619  -7.997
  781    H2     A  99           H2         A  99   4.453  -8.140  -3.655
  782    H5'    A 100           H5'        A 100  12.661  -3.948  -4.764
  783   H5''    A 100          H5''        A 100  14.003  -3.190  -3.871
  784    H4'    A 100           H4'        A 100  14.737  -3.469  -6.125
  785    H3'    A 100           H3'        A 100  14.804  -1.017  -5.014
  786    H2'    A 100           H2'        A 100  12.522  -0.591  -5.778
  787   HO2'    A 100          HO2'        A 100  14.331   0.723  -7.524
  788    H1'    A 100           H1'        A 100  13.489  -1.470  -8.495
  789    H8     A 100           H8         A 100  10.346  -1.606  -6.166
  790    H61    A 100           H61        A 100   7.259   0.027 -11.314
  791    H62    A 100           H62        A 100   7.107  -0.391  -9.615
  792    H2     A 100           H2         A 100  11.591  -0.339 -12.316
  793    H5'    A 101           H5'        A 101  17.946  -0.999  -5.243
  794   H5''    A 101          H5''        A 101  16.883  -0.356  -3.974
  795    H4'    A 101           H4'        A 101  18.864   1.502  -5.243
  796    H3'    A 101           H3'        A 101  20.024  -0.796  -4.501
  797   HO3'    A 101          H3T         A 101  21.711   0.486  -3.554
  798    H2'    A 101           H2'        A 101  18.845  -1.165  -2.500
  799   HO2'    A 101          HO2'        A 101  20.231  -0.664  -0.759
  800    H1'    A 101           H1'        A 101  19.136   1.623  -1.469
  801    H8     A 101           H8         A 101  16.853  -1.428  -2.121
  802    H61    A 101           H61        A 101  13.491   0.827   2.581
  803    H62    A 101           H62        A 101  13.720  -0.548   1.510
  804    H2     A 101           H2         A 101  16.531   3.864   1.485
  Start of MODEL   11
    1    H1   MET   1           H1       MET   1   1.177   3.712   0.805
    2    H2   MET   1           H2       MET   1  -0.328   3.073   0.976
    3    H3   MET   1           H3       MET   1  -0.065   4.660   1.317
    4    HA   MET   1           HA       MET   1  -1.190   4.429  -0.789
    5    HB2  MET   1           HB2      MET   1   0.403   6.316  -0.395
    6    HB3  MET   1           HB3      MET   1   1.693   5.338  -1.120
    7    HG2  MET   1           HG2      MET   1   0.718   6.868  -2.765
    8    HG3  MET   1           HG3      MET   1   0.400   5.190  -3.216
    9    HE1  MET   1           HE1      MET   1  -1.087   7.628  -4.548
   10    HE2  MET   1           HE2      MET   1  -1.440   5.927  -4.955
   11    HE3  MET   1           HE3      MET   1  -2.765   7.047  -4.573
   12    H    VAL   2           H        VAL   2  -1.755   2.551  -1.727
   13    HA   VAL   2           HA       VAL   2   0.370   0.958  -3.032
   14    HB   VAL   2           HB       VAL   2  -1.195  -0.319  -1.754
   15   HG11  VAL   2          1HG1      VAL   2  -3.439   0.814  -3.475
   16   HG12  VAL   2          HG21      VAL   2  -3.579  -0.424  -2.206
   17   HG13  VAL   2          HG31      VAL   2  -3.136   1.238  -1.770
   18   HG21  VAL   2          HG32      VAL   2  -1.985  -1.850  -3.493
   19   HG22  VAL   2          1HG2      VAL   2  -1.791  -0.578  -4.726
   20   HG23  VAL   2          HG22      VAL   2  -0.367  -1.238  -3.891
   21    H    GLU   3           H        GLU   3   0.998   1.652  -4.931
   22    HA   GLU   3           HA       GLU   3  -1.050   2.748  -6.784
   23    HB2  GLU   3           HB2      GLU   3   0.669   4.417  -7.519
   24    HB3  GLU   3           HB3      GLU   3   0.034   4.664  -5.886
   25    HG2  GLU   3           HG2      GLU   3   2.054   3.497  -4.961
   26    HG3  GLU   3           HG3      GLU   3   2.725   3.503  -6.605
   27    H    ALA   4           H        ALA   4  -0.931   2.280  -8.849
   28    HA   ALA   4           HA       ALA   4   1.060   0.222  -9.652
   29    HB1  ALA   4           1HB      ALA   4  -1.267  -0.563  -9.545
   30    HB2  ALA   4           HB2      ALA   4  -1.763   0.754 -10.636
   31    HB3  ALA   4           HB3      ALA   4  -0.668  -0.522 -11.221
   32    H    ASP   5           H        ASP   5   2.590   1.071 -10.736
   33    HA   ASP   5           HA       ASP   5   2.533   3.477 -12.290
   34    HB2  ASP   5           HB2      ASP   5   4.559   2.477 -11.330
   35    HB3  ASP   5           HB3      ASP   5   4.380   1.063 -12.368
   36    H    ARG   6           H        ARG   6   3.120   3.332 -14.779
   37    HA   ARG   6           HA       ARG   6   0.643   2.652 -15.931
   38    HB2  ARG   6           HB2      ARG   6   3.285   3.196 -17.329
   39    HB3  ARG   6           HB3      ARG   6   1.681   3.324 -18.062
   40    HG2  ARG   6           HG2      ARG   6   2.772   5.052 -15.792
   41    HG3  ARG   6           HG3      ARG   6   2.546   5.528 -17.473
   42    HD2  ARG   6           2HD      ARG   6   0.701   6.447 -16.329
   43    HD3  ARG   6           3HD      ARG   6   0.062   5.029 -17.173
   44    HE   ARG   6           HE       ARG   6   0.900   4.354 -14.496
   45   HH11  ARG   6          1HH1      ARG   6  -1.663   6.009 -16.268
   46   HH12  ARG   6          2HH1      ARG   6  -2.888   5.656 -15.070
   47   HH21  ARG   6          1HH2      ARG   6  -0.719   3.904 -12.930
   48   HH22  ARG   6          2HH2      ARG   6  -2.344   4.486 -13.176
   49    HA   PRO   7           HA       PRO   7   0.478  -1.487 -17.199
   50    HB2  PRO   7           HB2      PRO   7   0.051  -0.295 -19.944
   51    HB3  PRO   7           HB3      PRO   7  -0.852  -1.657 -19.193
   52    HG2  PRO   7           HG2      PRO   7  -1.922   0.782 -19.223
   53    HG3  PRO   7           HG3      PRO   7  -1.921  -0.112 -17.659
   54    HD2  PRO   7           2HD      PRO   7  -0.025   2.065 -18.578
   55    HD3  PRO   7           3HD      PRO   7  -0.803   1.841 -16.978
   56    H    GLY   8           H        GLY   8   1.634  -3.182 -18.270
   57    HA2  GLY   8           2HA      GLY   8   3.019  -4.010 -19.999
   58    HA3  GLY   8           3HA      GLY   8   3.732  -2.391 -20.212
   59    H    LYS   9           H        LYS   9   3.685  -2.371 -17.011
   60    HA   LYS   9           HA       LYS   9   6.372  -3.612 -16.895
   61    HB2  LYS   9           HB2      LYS   9   6.234  -1.241 -16.277
   62    HB3  LYS   9           HB3      LYS   9   5.088  -1.646 -14.973
   63    HG2  LYS   9           HG2      LYS   9   6.780  -3.210 -14.001
   64    HG3  LYS   9           HG3      LYS   9   7.924  -2.763 -15.277
   65    HD2  LYS   9           2HD      LYS   9   6.707  -0.821 -13.282
   66    HD3  LYS   9           3HD      LYS   9   8.292  -1.602 -13.106
   67    HE2  LYS   9           HE2      LYS   9   9.088  -0.564 -15.171
   68    HE3  LYS   9           HE3      LYS   9   7.494   0.143 -15.479
   69    HZ1  LYS   9           3HZ      LYS   9   9.132   0.772 -13.124
   70    HZ2  LYS   9           1HZ      LYS   9   9.051   1.697 -14.483
   71    HZ3  LYS   9           2HZ      LYS   9   7.711   1.480 -13.566
   72    H    LEU  10           H        LEU  10   6.730  -5.417 -15.769
   73    HA   LEU  10           HA       LEU  10   4.447  -6.468 -14.147
   74    HB2  LEU  10           HB2      LEU  10   6.555  -7.837 -15.824
   75    HB3  LEU  10           HB3      LEU  10   5.473  -8.729 -14.812
   76    HG   LEU  10           HG       LEU  10   4.666  -7.002 -17.197
   77   HD11  LEU  10          1HD1      LEU  10   4.413 -10.005 -16.667
   78   HD12  LEU  10          2HD1      LEU  10   4.178  -9.165 -18.217
   79   HD13  LEU  10          3HD1      LEU  10   5.804  -9.298 -17.491
   80   HD21  LEU  10          3HD2      LEU  10   2.961  -8.619 -15.269
   81   HD22  LEU  10          1HD2      LEU  10   2.872  -6.863 -15.589
   82   HD23  LEU  10          2HD2      LEU  10   2.413  -8.023 -16.854
   83    H    PHE  11           H        PHE  11   4.932  -7.693 -12.313
   84    HA   PHE  11           HA       PHE  11   7.638  -7.275 -11.128
   85    HB2  PHE  11           HB2      PHE  11   5.870  -6.264  -9.801
   86    HB3  PHE  11           HB3      PHE  11   4.898  -7.737  -9.893
   87    HD1  PHE  11           HD2      PHE  11   8.108  -6.364  -8.609
   88    HD2  PHE  11           HD1      PHE  11   5.187  -9.505  -8.328
   89    HE1  PHE  11           HE2      PHE  11   9.218  -7.219  -6.554
   90    HE2  PHE  11           HE1      PHE  11   6.323 -10.379  -6.298
   91    HZ   PHE  11           HZ       PHE  11   8.364  -9.233  -5.433
   92    H    ILE  12           H        ILE  12   8.847  -9.058 -10.763
   93    HA   ILE  12           HA       ILE  12   7.578 -11.697 -11.333
   94    HB   ILE  12           HB       ILE  12  10.457 -11.015 -11.962
   95   HG12  ILE  12          HG21      ILE  12   9.279  -9.382 -13.292
   96   HG13  ILE  12          HG31      ILE  12   9.920 -10.664 -14.302
   97   HG21  ILE  12          1HG2      ILE  12   8.471 -13.057 -13.007
   98   HG22  ILE  12          HG22      ILE  12  10.181 -12.908 -13.500
   99   HG23  ILE  12          HG32      ILE  12   9.764 -13.363 -11.830
  100   HD11  ILE  12          3HD1      ILE  12   7.014 -10.269 -13.512
  101   HD12  ILE  12          1HD1      ILE  12   7.756 -10.088 -15.116
  102   HD13  ILE  12          2HD1      ILE  12   7.619 -11.694 -14.377
  103    H    GLY  13           H        GLY  13   7.276 -11.774  -8.899
  104    HA2  GLY  13           2HA      GLY  13   9.803 -11.846  -7.356
  105    HA3  GLY  13           3HA      GLY  13   8.176 -11.871  -6.696
  106    H    GLY  14           H        GLY  14  10.607 -13.690  -6.279
  107    HA2  GLY  14           2HA      GLY  14  10.188 -15.797  -5.206
  108    HA3  GLY  14           3HA      GLY  14   8.978 -16.182  -6.437
  109    H    LEU  15           H        LEU  15  11.775 -14.677  -7.716
  110    HA   LEU  15           HA       LEU  15  12.359 -16.925  -9.377
  111    HB2  LEU  15           HB2      LEU  15  14.013 -14.437  -8.804
  112    HB3  LEU  15           HB3      LEU  15  14.214 -15.571 -10.172
  113    HG   LEU  15           HG       LEU  15  11.587 -14.131  -9.786
  114   HD11  LEU  15          1HD1      LEU  15  12.436 -12.462 -11.410
  115   HD12  LEU  15          2HD1      LEU  15  13.353 -12.399  -9.888
  116   HD13  LEU  15          3HD1      LEU  15  14.061 -13.193 -11.309
  117   HD21  LEU  15          3HD2      LEU  15  11.462 -14.620 -12.202
  118   HD22  LEU  15          1HD2      LEU  15  13.120 -15.259 -12.172
  119   HD23  LEU  15          2HD2      LEU  15  11.830 -16.116 -11.300
  120    H    ASN  16           H        ASN  16  14.636 -17.768  -9.697
  121    HA   ASN  16           HA       ASN  16  15.187 -19.306  -7.336
  122    HB2  ASN  16           HB2      ASN  16  14.936 -20.141  -9.653
  123    HB3  ASN  16           HB3      ASN  16  16.391 -19.244 -10.118
  124   HD21  ASN  16          2HD2      ASN  16  17.264 -21.222 -10.866
  125   HD22  ASN  16          1HD2      ASN  16  17.872 -22.420  -9.782
  126    H    THR  17           H        THR  17  16.312 -16.324  -8.096
  127    HA   THR  17           HA       THR  17  18.081 -15.112  -7.763
  128    HB   THR  17           HB       THR  17  19.528 -15.396  -5.951
  129    HG1  THR  17           1HG      THR  17  19.233 -18.178  -6.319
  130   HG21  THR  17          1HG2      THR  17  18.284 -16.372  -4.136
  131   HG22  THR  17          HG22      THR  17  17.102 -15.608  -5.238
  132   HG23  THR  17          HG32      THR  17  17.345 -17.386  -5.246
  133    H    GLU  18           H        GLU  18  18.376 -18.125  -9.226
  134    HA   GLU  18           HA       GLU  18  21.125 -17.726 -10.202
  135    HB2  GLU  18           HB2      GLU  18  19.088 -19.852 -10.949
  136    HB3  GLU  18           HB3      GLU  18  20.846 -19.934 -11.166
  137    HG2  GLU  18           HG2      GLU  18  19.321 -19.866  -8.525
  138    HG3  GLU  18           HG3      GLU  18  20.062 -21.282  -9.202
  139    H    THR  19           H        THR  19  17.990 -16.719 -10.906
  140    HA   THR  19           HA       THR  19  18.139 -16.623 -13.804
  141    HB   THR  19           HB       THR  19  16.332 -15.098 -11.885
  142    HG1  THR  19           1HG      THR  19  16.056 -17.694 -12.977
  143   HG21  THR  19          1HG2      THR  19  16.213 -14.364 -14.238
  144   HG22  THR  19          HG22      THR  19  15.942 -16.050 -14.750
  145   HG23  THR  19          HG32      THR  19  14.729 -15.207 -13.754
  146    H    ASN  20           H        ASN  20  18.602 -14.838 -15.080
  147    HA   ASN  20           HA       ASN  20  19.365 -12.319 -13.720
  148    HB2  ASN  20           HB2      ASN  20  21.065 -12.787 -16.010
  149    HB3  ASN  20           HB3      ASN  20  21.497 -12.318 -14.371
  150   HD21  ASN  20          2HD2      ASN  20  21.027 -14.980 -16.635
  151   HD22  ASN  20          1HD2      ASN  20  21.822 -16.208 -15.671
  152    H    GLU  21           H        GLU  21  20.107 -10.908 -15.905
  153    HA   GLU  21           HA       GLU  21  17.512 -10.027 -16.694
  154    HB2  GLU  21           HB2      GLU  21  20.199  -9.244 -17.912
  155    HB3  GLU  21           HB3      GLU  21  18.696  -8.314 -17.894
  156    HG2  GLU  21           HG2      GLU  21  19.851  -7.331 -16.121
  157    HG3  GLU  21           HG3      GLU  21  18.840  -8.533 -15.312
  158    H    LYS  22           H        LYS  22  20.064 -11.908 -18.320
  159    HA   LYS  22           HA       LYS  22  18.984 -11.746 -20.944
  160    HB2  LYS  22           HB2      LYS  22  21.308 -12.501 -19.899
  161    HB3  LYS  22           HB3      LYS  22  20.587 -14.105 -19.924
  162    HG2  LYS  22           HG2      LYS  22  21.013 -12.230 -22.291
  163    HG3  LYS  22           HG3      LYS  22  21.975 -13.662 -21.907
  164    HD2  LYS  22           2HD      LYS  22  19.050 -13.607 -22.705
  165    HD3  LYS  22           3HD      LYS  22  20.397 -14.115 -23.726
  166    HE2  LYS  22           HE2      LYS  22  19.566 -15.487 -21.133
  167    HE3  LYS  22           HE3      LYS  22  19.153 -16.047 -22.757
  168    HZ1  LYS  22           3HZ      LYS  22  21.491 -16.283 -23.223
  169    HZ2  LYS  22           1HZ      LYS  22  21.892 -15.788 -21.710
  170    HZ3  LYS  22           2HZ      LYS  22  21.062 -17.191 -21.921
  171    H    ALA  23           H        ALA  23  18.224 -13.785 -18.147
  172    HA   ALA  23           HA       ALA  23  16.888 -15.799 -19.838
  173    HB1  ALA  23           1HB      ALA  23  18.264 -16.513 -17.920
  174    HB2  ALA  23           HB2      ALA  23  17.228 -15.572 -16.814
  175    HB3  ALA  23           HB3      ALA  23  16.558 -16.966 -17.682
  176    H    LEU  24           H        LEU  24  16.241 -12.927 -18.081
  177    HA   LEU  24           HA       LEU  24  13.408 -13.438 -17.594
  178    HB2  LEU  24           HB2      LEU  24  15.610 -11.590 -16.848
  179    HB3  LEU  24           HB3      LEU  24  14.083 -10.751 -17.063
  180    HG   LEU  24           HG       LEU  24  14.289 -13.319 -15.461
  181   HD11  LEU  24          1HD1      LEU  24  14.737 -10.496 -14.399
  182   HD12  LEU  24          2HD1      LEU  24  14.540 -11.969 -13.409
  183   HD13  LEU  24          3HD1      LEU  24  15.947 -11.798 -14.482
  184   HD21  LEU  24          3HD2      LEU  24  12.063 -12.374 -16.116
  185   HD22  LEU  24          1HD2      LEU  24  12.284 -12.423 -14.344
  186   HD23  LEU  24          2HD2      LEU  24  12.450 -10.888 -15.228
  187    H    GLU  25           H        GLU  25  15.544 -11.830 -19.894
  188    HA   GLU  25           HA       GLU  25  13.309 -10.548 -21.261
  189    HB2  GLU  25           HB2      GLU  25  16.236 -11.044 -22.027
  190    HB3  GLU  25           HB3      GLU  25  15.078 -10.187 -23.078
  191    HG2  GLU  25           HG2      GLU  25  14.606  -8.633 -21.243
  192    HG3  GLU  25           HG3      GLU  25  15.884  -9.382 -20.270
  193    H    ALA  26           H        ALA  26  14.991 -13.544 -21.267
  194    HA   ALA  26           HA       ALA  26  14.219 -14.397 -23.960
  195    HB1  ALA  26           1HB      ALA  26  15.365 -16.487 -23.245
  196    HB2  ALA  26           HB2      ALA  26  16.360 -15.045 -22.947
  197    HB3  ALA  26           HB3      ALA  26  15.492 -15.822 -21.597
  198    H    VAL  27           H        VAL  27  12.859 -14.543 -20.750
  199    HA   VAL  27           HA       VAL  27  11.145 -16.844 -21.478
  200    HB   VAL  27           HB       VAL  27  12.600 -16.739 -19.466
  201   HG11  VAL  27          1HG1      VAL  27  10.452 -14.953 -18.341
  202   HG12  VAL  27          HG21      VAL  27  11.933 -15.526 -17.526
  203   HG13  VAL  27          HG31      VAL  27  12.063 -14.382 -18.889
  204   HG21  VAL  27          HG32      VAL  27  10.892 -17.728 -17.973
  205   HG22  VAL  27          1HG2      VAL  27   9.600 -17.046 -18.998
  206   HG23  VAL  27          HG22      VAL  27  10.683 -18.308 -19.657
  207    H    PHE  28           H        PHE  28  11.029 -13.454 -20.427
  208    HA   PHE  28           HA       PHE  28   8.080 -13.474 -20.707
  209    HB2  PHE  28           HB2      PHE  28   9.991 -11.324 -19.764
  210    HB3  PHE  28           HB3      PHE  28   8.244 -11.110 -19.966
  211    HD1  PHE  28           HD1      PHE  28   6.633 -12.494 -18.641
  212    HD2  PHE  28           HD2      PHE  28  10.849 -12.431 -17.822
  213    HE1  PHE  28           HE1      PHE  28   6.219 -13.491 -16.408
  214    HE2  PHE  28           HE2      PHE  28  10.444 -13.463 -15.611
  215    HZ   PHE  28           HZ       PHE  28   8.122 -13.966 -14.887
  216    H    GLY  29           H        GLY  29  10.801 -12.973 -22.686
  217    HA2  GLY  29           2HA      GLY  29   9.559 -11.026 -24.462
  218    HA3  GLY  29           3HA      GLY  29  11.002 -12.004 -24.808
  219    H    LYS  30           H        LYS  30   8.811 -14.161 -23.683
  220    HA   LYS  30           HA       LYS  30   8.238 -15.229 -26.320
  221    HB2  LYS  30           HB2      LYS  30   7.485 -16.137 -23.492
  222    HB3  LYS  30           HB3      LYS  30   7.380 -17.132 -24.963
  223    HG2  LYS  30           HG2      LYS  30   9.801 -16.962 -25.267
  224    HG3  LYS  30           HG3      LYS  30   9.955 -15.893 -23.871
  225    HD2  LYS  30           2HD      LYS  30  10.612 -18.208 -23.317
  226    HD3  LYS  30           3HD      LYS  30   9.287 -17.602 -22.319
  227    HE2  LYS  30           HE2      LYS  30   8.836 -19.877 -22.951
  228    HE3  LYS  30           HE3      LYS  30   7.650 -18.809 -23.709
  229    HZ1  LYS  30           3HZ      LYS  30   8.921 -18.952 -25.745
  230    HZ2  LYS  30           1HZ      LYS  30  10.035 -19.929 -25.035
  231    HZ3  LYS  30           2HZ      LYS  30   8.491 -20.456 -25.243
  232    H    TYR  31           H        TYR  31   6.767 -13.061 -24.238
  233    HA   TYR  31           HA       TYR  31   4.028 -13.686 -25.252
  234    HB2  TYR  31           HB2      TYR  31   4.961 -12.200 -22.779
  235    HB3  TYR  31           HB3      TYR  31   3.276 -12.495 -23.215
  236    HD1  TYR  31           HD2      TYR  31   2.597 -15.014 -23.440
  237    HD2  TYR  31           HD1      TYR  31   6.194 -13.682 -21.507
  238    HE1  TYR  31           HE2      TYR  31   2.813 -17.226 -22.336
  239    HE2  TYR  31           HE1      TYR  31   6.404 -15.888 -20.358
  240    HH   TYR  31           HH       TYR  31   5.583 -18.055 -20.243
  241    H    GLY  32           H        GLY  32   6.581 -11.301 -25.297
  242    HA2  GLY  32           2HA      GLY  32   5.278  -9.684 -27.248
  243    HA3  GLY  32           3HA      GLY  32   5.164  -8.904 -25.642
  244    H    ARG  33           H        ARG  33   6.526  -7.786 -27.867
  245    HA   ARG  33           HA       ARG  33   9.333  -8.379 -27.447
  246    HB2  ARG  33           HB2      ARG  33   9.851  -6.760 -29.037
  247    HB3  ARG  33           HB3      ARG  33   8.376  -7.537 -29.619
  248    HG2  ARG  33           HG2      ARG  33   7.053  -5.580 -28.741
  249    HG3  ARG  33           HG3      ARG  33   8.581  -4.846 -28.189
  250    HD2  ARG  33           2HD      ARG  33   8.141  -3.865 -30.308
  251    HD3  ARG  33           3HD      ARG  33   9.446  -5.035 -30.534
  252    HE   ARG  33           HE       ARG  33   7.957  -6.486 -31.703
  253   HH11  ARG  33          1HH1      ARG  33   6.397  -3.467 -30.701
  254   HH12  ARG  33          2HH1      ARG  33   5.014  -3.708 -31.742
  255   HH21  ARG  33          1HH2      ARG  33   6.167  -6.743 -33.076
  256   HH22  ARG  33          2HH2      ARG  33   4.892  -5.547 -33.095
  257    H    ILE  34           H        ILE  34  10.512  -7.771 -25.957
  258    HA   ILE  34           HA       ILE  34   9.563  -6.044 -23.803
  259    HB   ILE  34           HB       ILE  34  12.111  -7.610 -24.294
  260   HG12  ILE  34          HG21      ILE  34   9.695  -7.926 -22.451
  261   HG13  ILE  34          HG31      ILE  34  10.055  -8.893 -23.885
  262   HG21  ILE  34          1HG2      ILE  34  11.339  -6.071 -21.781
  263   HG22  ILE  34          HG22      ILE  34  12.774  -7.106 -22.006
  264   HG23  ILE  34          HG32      ILE  34  12.631  -5.605 -22.914
  265   HD11  ILE  34          3HD1      ILE  34  12.149  -9.689 -22.795
  266   HD12  ILE  34          1HD1      ILE  34  11.699  -8.797 -21.317
  267   HD13  ILE  34          2HD1      ILE  34  10.682 -10.131 -21.883
  268    H    VAL  35           H        VAL  35  10.283  -4.082 -23.171
  269    HA   VAL  35           HA       VAL  35  12.006  -2.617 -25.108
  270    HB   VAL  35           HB       VAL  35  10.536  -0.851 -23.366
  271   HG11  VAL  35          1HG1      VAL  35  10.329  -1.424 -26.345
  272   HG12  VAL  35          HG21      VAL  35   9.744   0.034 -25.511
  273   HG13  VAL  35          HG31      VAL  35  11.487  -0.301 -25.579
  274   HG21  VAL  35          HG32      VAL  35   8.785  -2.785 -24.946
  275   HG22  VAL  35          1HG2      VAL  35   8.820  -2.607 -23.171
  276   HG23  VAL  35          HG22      VAL  35   8.244  -1.278 -24.176
  277    H    GLU  36           H        GLU  36  11.555  -3.660 -21.810
  278    HA   GLU  36           HA       GLU  36  14.280  -2.904 -21.150
  279    HB2  GLU  36           HB2      GLU  36  13.111  -0.767 -20.713
  280    HB3  GLU  36           HB3      GLU  36  11.940  -1.599 -19.675
  281    HG2  GLU  36           HG2      GLU  36  13.678  -2.179 -18.082
  282    HG3  GLU  36           HG3      GLU  36  14.936  -1.581 -19.178
  283    H    VAL  37           H        VAL  37  15.050  -4.090 -19.337
  284    HA   VAL  37           HA       VAL  37  13.035  -5.601 -17.794
  285    HB   VAL  37           HB       VAL  37  15.193  -6.797 -19.481
  286   HG11  VAL  37          1HG1      VAL  37  14.501  -7.912 -16.730
  287   HG12  VAL  37          HG21      VAL  37  15.402  -8.755 -18.000
  288   HG13  VAL  37          HG31      VAL  37  16.103  -7.310 -17.246
  289   HG21  VAL  37          HG32      VAL  37  12.553  -7.756 -18.270
  290   HG22  VAL  37          1HG2      VAL  37  12.783  -7.115 -19.916
  291   HG23  VAL  37          HG22      VAL  37  13.516  -8.664 -19.442
  292    H    LEU  38           H        LEU  38  13.508  -5.952 -15.713
  293    HA   LEU  38           HA       LEU  38  16.016  -4.719 -14.599
  294    HB2  LEU  38           HB2      LEU  38  13.149  -4.696 -13.910
  295    HB3  LEU  38           HB3      LEU  38  14.230  -4.789 -12.540
  296    HG   LEU  38           HG       LEU  38  14.278  -2.575 -14.644
  297   HD11  LEU  38          1HD1      LEU  38  12.361  -2.438 -13.088
  298   HD12  LEU  38          2HD1      LEU  38  13.459  -2.616 -11.700
  299   HD13  LEU  38          3HD1      LEU  38  13.552  -1.171 -12.731
  300   HD21  LEU  38          3HD2      LEU  38  15.907  -2.957 -12.104
  301   HD22  LEU  38          1HD2      LEU  38  16.546  -2.935 -13.771
  302   HD23  LEU  38          2HD2      LEU  38  15.841  -1.466 -13.069
  303    H    LEU  39           H        LEU  39  16.976  -5.831 -12.902
  304    HA   LEU  39           HA       LEU  39  15.732  -8.291 -11.969
  305    HB2  LEU  39           HB2      LEU  39  17.057  -8.990 -13.920
  306    HB3  LEU  39           HB3      LEU  39  18.480  -8.153 -13.290
  307    HG   LEU  39           HG       LEU  39  18.304 -10.701 -13.128
  308   HD11  LEU  39          1HD1      LEU  39  19.026  -9.145 -10.620
  309   HD12  LEU  39          2HD1      LEU  39  19.621 -10.756 -11.085
  310   HD13  LEU  39          3HD1      LEU  39  20.049  -9.345 -12.071
  311   HD21  LEU  39          3HD2      LEU  39  16.709 -10.049 -10.623
  312   HD22  LEU  39          1HD2      LEU  39  16.044 -10.797 -12.099
  313   HD23  LEU  39          2HD2      LEU  39  17.287 -11.647 -11.157
  314    H    MET  40           H        MET  40  15.871  -8.123  -9.774
  315    HA   MET  40           HA       MET  40  17.565  -5.898  -8.837
  316    HB2  MET  40           HB2      MET  40  15.471  -7.386  -7.231
  317    HB3  MET  40           HB3      MET  40  16.136  -5.786  -6.937
  318    HG2  MET  40           HG2      MET  40  14.034  -6.689  -8.851
  319    HG3  MET  40           HG3      MET  40  14.090  -5.240  -7.862
  320    HE1  MET  40           HE3      MET  40  15.566  -2.926  -8.729
  321    HE2  MET  40           HE1      MET  40  16.941  -4.056  -8.687
  322    HE3  MET  40           HE2      MET  40  16.627  -3.075 -10.146
  323    H    LYS  41           H        LYS  41  19.182  -6.080  -7.293
  324    HA   LYS  41           HA       LYS  41  19.544  -8.669  -5.984
  325    HB2  LYS  41           HB2      LYS  41  22.140  -8.238  -6.814
  326    HB3  LYS  41           HB3      LYS  41  21.027  -9.443  -7.459
  327    HG2  LYS  41           HG2      LYS  41  20.360  -8.017  -9.266
  328    HG3  LYS  41           HG3      LYS  41  21.319  -6.655  -8.622
  329    HD2  LYS  41           2HD      LYS  41  23.387  -7.914  -8.954
  330    HD3  LYS  41           3HD      LYS  41  22.478  -9.366  -9.426
  331    HE2  LYS  41           HE2      LYS  41  21.533  -8.102 -11.361
  332    HE3  LYS  41           HE3      LYS  41  22.503  -6.695 -10.900
  333    HZ1  LYS  41           3HZ      LYS  41  24.470  -8.014 -11.240
  334    HZ2  LYS  41           1HZ      LYS  41  23.578  -9.335 -11.655
  335    HZ3  LYS  41           2HZ      LYS  41  23.556  -8.003 -12.611
  336    H    ASP  42           H        ASP  42  20.870  -8.696  -4.254
  337    HA   ASP  42           HA       ASP  42  21.064  -6.389  -2.620
  338    HB2  ASP  42           HB2      ASP  42  21.074  -8.959  -2.087
  339    HB3  ASP  42           HB3      ASP  42  22.813  -8.827  -2.359
  340    H    ARG  43           H        ARG  43  23.002  -5.353  -1.769
  341    HA   ARG  43           HA       ARG  43  24.941  -4.819  -3.930
  342    HB2  ARG  43           HB2      ARG  43  23.660  -3.005  -2.740
  343    HB3  ARG  43           HB3      ARG  43  24.526  -3.433  -1.254
  344    HG2  ARG  43           HG2      ARG  43  26.698  -2.958  -2.465
  345    HG3  ARG  43           HG3      ARG  43  25.736  -2.424  -3.864
  346    HD2  ARG  43           2HD      ARG  43  26.355  -0.477  -2.573
  347    HD3  ARG  43           3HD      ARG  43  24.615  -0.747  -2.363
  348    HE   ARG  43           HE       ARG  43  26.238  -2.049  -0.319
  349   HH11  ARG  43          1HH1      ARG  43  24.698   1.003  -1.228
  350   HH12  ARG  43          2HH1      ARG  43  24.614   1.579   0.420
  351   HH21  ARG  43          1HH2      ARG  43  26.131  -1.275   1.793
  352   HH22  ARG  43          2HH2      ARG  43  25.418   0.290   2.130
  353    H    GLU  44           H        GLU  44  24.709  -6.524  -0.912
  354    HA   GLU  44           HA       GLU  44  27.652  -6.455  -0.527
  355    HB2  GLU  44           HB2      GLU  44  25.462  -7.454   1.319
  356    HB3  GLU  44           HB3      GLU  44  27.171  -7.247   1.724
  357    HG2  GLU  44           HG2      GLU  44  25.182  -5.053   1.018
  358    HG3  GLU  44           HG3      GLU  44  25.864  -5.387   2.611
  359    H    THR  45           H        THR  45  25.141  -8.504  -1.725
  360    HA   THR  45           HA       THR  45  27.041 -10.821  -1.678
  361    HB   THR  45           HB       THR  45  25.202 -12.329  -1.434
  362    HG1  THR  45           1HG      THR  45  23.074 -11.497  -1.290
  363   HG21  THR  45          1HG2      THR  45  24.663  -9.995   0.443
  364   HG22  THR  45          HG22      THR  45  24.326 -11.717   0.749
  365   HG23  THR  45          HG32      THR  45  26.013 -11.145   0.637
  366    H    ASN  46           H        ASN  46  25.131  -8.621  -3.516
  367    HA   ASN  46           HA       ASN  46  24.781  -8.415  -5.722
  368    HB2  ASN  46           HB2      ASN  46  27.324  -9.050  -5.457
  369    HB3  ASN  46           HB3      ASN  46  26.843 -10.521  -6.312
  370   HD21  ASN  46          2HD2      ASN  46  28.580  -9.377  -7.770
  371   HD22  ASN  46          1HD2      ASN  46  27.916  -8.368  -9.040
  372    H    LYS  47           H        LYS  47  23.800 -10.957  -4.055
  373    HA   LYS  47           HA       LYS  47  22.875 -12.727  -6.200
  374    HB2  LYS  47           HB2      LYS  47  22.409 -12.514  -3.201
  375    HB3  LYS  47           HB3      LYS  47  21.503 -13.651  -4.205
  376    HG2  LYS  47           HG2      LYS  47  24.464 -13.659  -4.569
  377    HG3  LYS  47           HG3      LYS  47  23.885 -14.257  -3.006
  378    HD2  LYS  47           2HD      LYS  47  22.748 -15.266  -5.645
  379    HD3  LYS  47           3HD      LYS  47  24.140 -16.020  -4.826
  380    HE2  LYS  47           HE2      LYS  47  22.772 -16.300  -2.784
  381    HE3  LYS  47           HE3      LYS  47  21.376 -15.600  -3.617
  382    HZ1  LYS  47           3HZ      LYS  47  22.786 -18.049  -4.455
  383    HZ2  LYS  47           1HZ      LYS  47  21.350 -18.008  -3.654
  384    HZ3  LYS  47           2HZ      LYS  47  21.454 -17.417  -5.178
  385    H    SER  48           H        SER  48  20.758 -12.890  -6.942
  386    HA   SER  48           HA       SER  48  19.298 -10.504  -7.207
  387    HB2  SER  48           HB2      SER  48  18.997 -12.439  -8.675
  388    HB3  SER  48           HB3      SER  48  18.346 -13.372  -7.304
  389    HG   SER  48           HG       SER  48  16.728 -12.405  -8.687
  390    H    ARG  49           H        ARG  49  17.539  -9.644  -6.177
  391    HA   ARG  49           HA       ARG  49  17.164 -10.086  -3.357
  392    HB2  ARG  49           HB2      ARG  49  15.525  -8.703  -5.511
  393    HB3  ARG  49           HB3      ARG  49  15.167  -8.592  -3.778
  394    HG2  ARG  49           HG2      ARG  49  17.879  -7.775  -4.858
  395    HG3  ARG  49           HG3      ARG  49  16.502  -6.679  -4.981
  396    HD2  ARG  49           2HD      ARG  49  17.602  -7.855  -2.417
  397    HD3  ARG  49           3HD      ARG  49  17.797  -6.178  -3.009
  398    HE   ARG  49           HE       ARG  49  15.375  -7.427  -1.852
  399   HH11  ARG  49          1HH1      ARG  49  16.814  -4.560  -3.375
  400   HH12  ARG  49          2HH1      ARG  49  15.555  -3.503  -2.806
  401   HH21  ARG  49          1HH2      ARG  49  13.729  -6.032  -1.189
  402   HH22  ARG  49          2HH2      ARG  49  13.769  -4.344  -1.636
  403    H    GLY  50           H        GLY  50  16.237 -11.861  -6.070
  404    HA2  GLY  50           2HA      GLY  50  14.968 -13.818  -6.129
  405    HA3  GLY  50           3HA      GLY  50  14.177 -13.364  -4.600
  406    H    PHE  51           H        PHE  51  14.148 -10.572  -6.465
  407    HA   PHE  51           HA       PHE  51  11.839 -11.417  -8.098
  408    HB2  PHE  51           HB2      PHE  51  10.479  -9.589  -7.350
  409    HB3  PHE  51           HB3      PHE  51  10.932 -10.588  -5.975
  410    HD1  PHE  51           HD1      PHE  51  12.626  -9.765  -4.329
  411    HD2  PHE  51           HD2      PHE  51  11.168  -7.303  -7.534
  412    HE1  PHE  51           HE1      PHE  51  13.394  -7.725  -3.118
  413    HE2  PHE  51           HE2      PHE  51  11.882  -5.280  -6.316
  414    HZ   PHE  51           HZ       PHE  51  13.055  -5.491  -4.129
  415    H    ALA  52           H        ALA  52  11.212  -9.756  -9.695
  416    HA   ALA  52           HA       ALA  52  13.339  -7.884 -10.497
  417    HB1  ALA  52           1HB      ALA  52  12.507 -10.315 -12.146
  418    HB2  ALA  52           HB2      ALA  52  13.611  -9.030 -12.681
  419    HB3  ALA  52           HB3      ALA  52  14.074 -10.099 -11.338
  420    H    PHE  53           H        PHE  53  12.635  -7.085 -12.871
  421    HA   PHE  53           HA       PHE  53   9.689  -6.883 -13.060
  422    HB2  PHE  53           HB2      PHE  53  11.549  -4.467 -13.027
  423    HB3  PHE  53           HB3      PHE  53   9.849  -4.415 -13.395
  424    HD1  PHE  53           HD1      PHE  53  12.346  -5.245 -10.783
  425    HD2  PHE  53           HD2      PHE  53   8.273  -4.179 -11.624
  426    HE1  PHE  53           HE1      PHE  53  11.944  -4.898  -8.360
  427    HE2  PHE  53           HE2      PHE  53   7.864  -3.829  -9.193
  428    HZ   PHE  53           HZ       PHE  53   9.700  -4.196  -7.566
  429    H    VAL  54           H        VAL  54   9.011  -6.000 -15.194
  430    HA   VAL  54           HA       VAL  54  11.051  -5.907 -17.300
  431    HB   VAL  54           HB       VAL  54  10.650  -8.324 -17.174
  432   HG11  VAL  54          1HG1      VAL  54   8.693  -8.359 -15.966
  433   HG12  VAL  54          HG21      VAL  54   7.758  -7.794 -17.409
  434   HG13  VAL  54          HG31      VAL  54   8.623  -9.371 -17.433
  435   HG21  VAL  54          HG32      VAL  54  10.720  -7.181 -19.492
  436   HG22  VAL  54          1HG2      VAL  54   9.876  -8.753 -19.436
  437   HG23  VAL  54          HG22      VAL  54   8.950  -7.237 -19.477
  438    H    THR  55           H        THR  55  10.389  -4.704 -19.044
  439    HA   THR  55           HA       THR  55   7.602  -3.644 -18.900
  440    HB   THR  55           HB       THR  55  10.023  -2.267 -20.103
  441    HG1  THR  55           1HG      THR  55  10.129  -2.393 -17.829
  442   HG21  THR  55          1HG2      THR  55   7.145  -1.421 -19.530
  443   HG22  THR  55          HG22      THR  55   8.436  -0.315 -20.051
  444   HG23  THR  55          HG32      THR  55   7.892  -1.615 -21.128
  445    H    PHE  56           H        PHE  56   6.322  -4.345 -20.421
  446    HA   PHE  56           HA       PHE  56   7.360  -5.375 -22.982
  447    HB2  PHE  56           HB2      PHE  56   4.636  -5.260 -21.655
  448    HB3  PHE  56           HB3      PHE  56   4.893  -5.857 -23.295
  449    HD1  PHE  56           HD1      PHE  56   6.373  -6.477 -19.835
  450    HD2  PHE  56           HD2      PHE  56   5.060  -8.075 -23.616
  451    HE1  PHE  56           HE1      PHE  56   6.895  -8.745 -19.054
  452    HE2  PHE  56           HE2      PHE  56   5.492 -10.356 -22.793
  453    HZ   PHE  56           HZ       PHE  56   6.355 -10.718 -20.495
  454    H    GLU  57           H        GLU  57   6.559  -4.588 -25.034
  455    HA   GLU  57           HA       GLU  57   6.123  -1.706 -25.088
  456    HB2  GLU  57           HB2      GLU  57   6.962  -3.765 -26.898
  457    HB3  GLU  57           HB3      GLU  57   5.547  -2.984 -27.598
  458    HG2  GLU  57           HG2      GLU  57   6.569  -0.749 -27.239
  459    HG3  GLU  57           HG3      GLU  57   8.031  -1.527 -26.621
  460    H    SER  58           H        SER  58   4.089  -4.635 -25.111
  461    HA   SER  58           HA       SER  58   1.767  -2.827 -25.526
  462    HB2  SER  58           HB2      SER  58   1.834  -4.505 -27.259
  463    HB3  SER  58           HB3      SER  58   2.142  -5.785 -26.065
  464    HG   SER  58           HG       SER  58  -0.075  -5.626 -26.741
  465    HA   PRO  59           HA       PRO  59   1.017  -3.563 -21.277
  466    HB2  PRO  59           HB2      PRO  59  -1.517  -2.635 -21.034
  467    HB3  PRO  59           HB3      PRO  59  -0.169  -1.521 -21.484
  468    HG2  PRO  59           HG2      PRO  59  -2.081  -2.989 -23.319
  469    HG3  PRO  59           HG3      PRO  59  -1.789  -1.222 -23.266
  470    HD2  PRO  59           2HD      PRO  59  -0.443  -2.793 -25.027
  471    HD3  PRO  59           3HD      PRO  59   0.443  -1.506 -24.144
  472    H    ALA  60           H        ALA  60  -0.491  -5.242 -23.867
  473    HA   ALA  60           HA       ALA  60  -1.978  -6.975 -21.966
  474    HB1  ALA  60           1HB      ALA  60  -2.451  -6.497 -24.927
  475    HB2  ALA  60           HB2      ALA  60  -3.397  -7.577 -23.869
  476    HB3  ALA  60           HB3      ALA  60  -3.407  -5.828 -23.575
  477    H    ASP  61           H        ASP  61   0.706  -6.806 -24.183
  478    HA   ASP  61           HA       ASP  61   1.016  -9.679 -24.488
  479    HB2  ASP  61           HB2      ASP  61   2.970  -7.331 -24.571
  480    HB3  ASP  61           HB3      ASP  61   3.447  -8.956 -24.813
  481    H    ALA  62           H        ALA  62   1.659  -7.212 -22.065
  482    HA   ALA  62           HA       ALA  62   3.221  -8.930 -20.321
  483    HB1  ALA  62           1HB      ALA  62   2.883  -7.077 -18.715
  484    HB2  ALA  62           HB2      ALA  62   3.461  -6.497 -20.307
  485    HB3  ALA  62           HB3      ALA  62   1.754  -6.300 -19.846
  486    H    LYS  63           H        LYS  63  -0.233  -8.101 -20.753
  487    HA   LYS  63           HA       LYS  63  -1.141  -9.365 -18.316
  488    HB2  LYS  63           HB2      LYS  63  -2.506  -8.827 -20.990
  489    HB3  LYS  63           HB3      LYS  63  -3.331  -9.516 -19.586
  490    HG2  LYS  63           HG2      LYS  63  -2.893  -7.542 -18.243
  491    HG3  LYS  63           HG3      LYS  63  -1.878  -6.853 -19.523
  492    HD2  LYS  63           2HD      LYS  63  -4.104  -5.800 -19.505
  493    HD3  LYS  63           3HD      LYS  63  -3.825  -6.660 -21.015
  494    HE2  LYS  63           HE2      LYS  63  -5.099  -8.617 -20.131
  495    HE3  LYS  63           HE3      LYS  63  -5.384  -7.740 -18.625
  496    HZ1  LYS  63           3HZ      LYS  63  -6.581  -6.079 -19.893
  497    HZ2  LYS  63           1HZ      LYS  63  -6.306  -6.891 -21.292
  498    HZ3  LYS  63           2HZ      LYS  63  -7.250  -7.560 -20.124
  499    H    ASP  64           H        ASP  64  -0.510 -10.461 -21.659
  500    HA   ASP  64           HA       ASP  64  -1.710 -13.035 -21.308
  501    HB2  ASP  64           HB2      ASP  64  -1.158 -11.798 -23.475
  502    HB3  ASP  64           HB3      ASP  64   0.537 -12.209 -23.200
  503    H    ALA  65           H        ALA  65   1.540 -11.721 -20.744
  504    HA   ALA  65           HA       ALA  65   2.704 -14.305 -20.097
  505    HB1  ALA  65           1HB      ALA  65   4.605 -13.025 -19.349
  506    HB2  ALA  65           HB2      ALA  65   4.002 -12.251 -20.834
  507    HB3  ALA  65           HB3      ALA  65   3.640 -11.531 -19.254
  508    H    ALA  66           H        ALA  66   1.295 -11.562 -18.247
  509    HA   ALA  66           HA       ALA  66   1.889 -12.759 -15.708
  510    HB1  ALA  66           1HB      ALA  66   1.630 -10.298 -16.117
  511    HB2  ALA  66           HB2      ALA  66  -0.086 -10.551 -16.460
  512    HB3  ALA  66           HB3      ALA  66   0.548 -10.874 -14.830
  513    H    ARG  67           H        ARG  67  -0.369 -13.536 -18.067
  514    HA   ARG  67           HA       ARG  67  -2.189 -14.879 -16.127
  515    HB2  ARG  67           HB2      ARG  67  -2.422 -14.162 -19.062
  516    HB3  ARG  67           HB3      ARG  67  -3.593 -15.197 -18.228
  517    HG2  ARG  67           HG2      ARG  67  -4.218 -13.459 -16.705
  518    HG3  ARG  67           HG3      ARG  67  -2.880 -12.416 -17.201
  519    HD2  ARG  67           2HD      ARG  67  -4.932 -11.610 -18.197
  520    HD3  ARG  67           3HD      ARG  67  -3.876 -12.214 -19.470
  521    HE   ARG  67           HE       ARG  67  -5.363 -13.945 -19.929
  522   HH11  ARG  67          1HH1      ARG  67  -6.332 -12.315 -16.936
  523   HH12  ARG  67          2HH1      ARG  67  -7.894 -13.097 -16.882
  524   HH21  ARG  67          1HH2      ARG  67  -7.396 -14.958 -19.821
  525   HH22  ARG  67          2HH2      ARG  67  -8.477 -14.613 -18.491
  526    H    ASP  68           H        ASP  68   0.711 -15.675 -17.558
  527    HA   ASP  68           HA       ASP  68  -0.175 -18.458 -18.172
  528    HB2  ASP  68           HB2      ASP  68   1.423 -16.391 -19.630
  529    HB3  ASP  68           HB3      ASP  68   2.188 -17.934 -19.485
  530    H    MET  69           H        MET  69   2.526 -16.277 -17.469
  531    HA   MET  69           HA       MET  69   4.229 -18.329 -16.357
  532    HB2  MET  69           HB2      MET  69   4.285 -15.468 -17.229
  533    HB3  MET  69           HB3      MET  69   5.389 -15.878 -15.957
  534    HG2  MET  69           HG2      MET  69   5.079 -17.236 -18.667
  535    HG3  MET  69           HG3      MET  69   6.385 -16.135 -18.215
  536    HE1  MET  69           HE3      MET  69   8.356 -18.143 -15.549
  537    HE2  MET  69           HE1      MET  69   8.038 -16.577 -16.356
  538    HE3  MET  69           HE2      MET  69   6.854 -17.247 -15.201
  539    H    ASN  70           H        ASN  70   1.706 -16.343 -15.077
  540    HA   ASN  70           HA       ASN  70   2.933 -15.890 -12.494
  541    HB2  ASN  70           HB2      ASN  70   1.124 -14.480 -13.433
  542    HB3  ASN  70           HB3      ASN  70   0.009 -15.849 -13.342
  543   HD21  ASN  70          2HD2      ASN  70  -1.269 -14.341 -11.982
  544   HD22  ASN  70          1HD2      ASN  70  -0.889 -14.218 -10.275
  545    H    GLY  71           H        GLY  71   3.179 -17.299 -10.881
  546    HA2  GLY  71           2HA      GLY  71   2.602 -19.006  -9.402
  547    HA3  GLY  71           3HA      GLY  71   1.276 -19.497 -10.474
  548    H    LYS  72           H        LYS  72   3.711 -19.245 -12.666
  549    HA   LYS  72           HA       LYS  72   4.494 -22.048 -12.602
  550    HB2  LYS  72           HB2      LYS  72   5.412 -19.724 -14.300
  551    HB3  LYS  72           HB3      LYS  72   5.561 -21.444 -14.658
  552    HG2  LYS  72           HG2      LYS  72   2.938 -19.908 -14.515
  553    HG3  LYS  72           HG3      LYS  72   3.741 -20.508 -15.977
  554    HD2  LYS  72           2HD      LYS  72   3.500 -22.843 -15.135
  555    HD3  LYS  72           3HD      LYS  72   2.634 -22.221 -13.708
  556    HE2  LYS  72           HE2      LYS  72   0.923 -21.221 -15.182
  557    HE3  LYS  72           HE3      LYS  72   1.777 -21.840 -16.603
  558    HZ1  LYS  72           3HZ      LYS  72   1.404 -24.066 -15.772
  559    HZ2  LYS  72           1HZ      LYS  72   0.602 -23.485 -14.461
  560    HZ3  LYS  72           2HZ      LYS  72  -0.021 -23.276 -15.967
  561    H    SER  73           H        SER  73   7.083 -21.442 -13.695
  562    HA   SER  73           HA       SER  73   8.615 -20.612 -11.265
  563    HB2  SER  73           HB2      SER  73   8.039 -23.037 -11.234
  564    HB3  SER  73           HB3      SER  73   8.847 -23.239 -12.799
  565    HG   SER  73           HG       SER  73  10.211 -23.754 -11.012
  566    H    LEU  74           H        LEU  74  10.784 -20.326 -11.516
  567    HA   LEU  74           HA       LEU  74  11.725 -19.916 -14.308
  568    HB2  LEU  74           HB2      LEU  74  11.162 -17.779 -12.509
  569    HB3  LEU  74           HB3      LEU  74  12.842 -18.076 -12.305
  570    HG   LEU  74           HG       LEU  74  12.647 -16.431 -13.975
  571   HD11  LEU  74          1HD1      LEU  74  13.230 -19.002 -15.489
  572   HD12  LEU  74          2HD1      LEU  74  13.728 -17.355 -15.928
  573   HD13  LEU  74          3HD1      LEU  74  14.392 -18.109 -14.467
  574   HD21  LEU  74          3HD2      LEU  74  11.307 -16.742 -16.023
  575   HD22  LEU  74          1HD2      LEU  74  10.861 -18.386 -15.497
  576   HD23  LEU  74          2HD2      LEU  74  10.278 -16.972 -14.592
  577    H    ASP  75           H        ASP  75  13.577 -20.946 -14.605
  578    HA   ASP  75           HA       ASP  75  15.481 -22.065 -14.264
  579    HB2  ASP  75           HB2      ASP  75  15.809 -19.615 -13.064
  580    HB3  ASP  75           HB3      ASP  75  15.863 -20.549 -11.674
  581    H    GLY  76           H        GLY  76  13.138 -22.197 -11.731
  582    HA2  GLY  76           2HA      GLY  76  13.113 -24.819 -11.393
  583    HA3  GLY  76           3HA      GLY  76  14.522 -24.390 -10.385
  584    H    LYS  77           H        LYS  77  12.689 -21.684 -10.073
  585    HA   LYS  77           HA       LYS  77  11.332 -22.766  -7.648
  586    HB2  LYS  77           HB2      LYS  77  12.733 -20.090  -7.917
  587    HB3  LYS  77           HB3      LYS  77  11.973 -20.753  -6.457
  588    HG2  LYS  77           HG2      LYS  77  14.360 -21.926  -7.928
  589    HG3  LYS  77           HG3      LYS  77  14.441 -20.982  -6.424
  590    HD2  LYS  77           2HD      LYS  77  13.314 -22.677  -5.166
  591    HD3  LYS  77           3HD      LYS  77  12.890 -23.589  -6.621
  592    HE2  LYS  77           HE2      LYS  77  14.787 -24.633  -5.475
  593    HE3  LYS  77           HE3      LYS  77  15.238 -24.053  -7.089
  594    HZ1  LYS  77           3HZ      LYS  77  15.779 -22.605  -4.580
  595    HZ2  LYS  77           1HZ      LYS  77  16.872 -23.508  -5.407
  596    HZ3  LYS  77           2HZ      LYS  77  16.248 -22.157  -6.096
  597    H    ALA  78           H        ALA  78   9.332 -22.014  -7.174
  598    HA   ALA  78           HA       ALA  78   7.829 -21.060  -9.408
  599    HB1  ALA  78           1HB      ALA  78   7.013 -21.430  -6.505
  600    HB2  ALA  78           HB2      ALA  78   5.912 -21.222  -7.890
  601    HB3  ALA  78           HB3      ALA  78   6.946 -22.662  -7.788
  602    H    ILE  79           H        ILE  79   6.860 -19.127  -9.833
  603    HA   ILE  79           HA       ILE  79   7.736 -16.819  -8.156
  604    HB   ILE  79           HB       ILE  79   8.011 -15.541 -10.156
  605   HG12  ILE  79          HG21      ILE  79   7.166 -17.975 -11.781
  606   HG13  ILE  79          HG31      ILE  79   6.109 -16.596 -11.429
  607   HG21  ILE  79          1HG2      ILE  79   9.335 -18.247 -10.592
  608   HG22  ILE  79          HG22      ILE  79   9.871 -16.674 -11.211
  609   HG23  ILE  79          HG32      ILE  79   9.896 -16.988  -9.460
  610   HD11  ILE  79          3HD1      ILE  79   8.673 -16.561 -13.041
  611   HD12  ILE  79          1HD1      ILE  79   7.008 -16.191 -13.574
  612   HD13  ILE  79          2HD1      ILE  79   7.839 -15.088 -12.470
  613    H    LYS  80           H        LYS  80   6.566 -14.803  -8.762
  614    HA   LYS  80           HA       LYS  80   3.672 -15.207  -9.312
  615    HB2  LYS  80           HB2      LYS  80   4.340 -14.374  -6.961
  616    HB3  LYS  80           HB3      LYS  80   4.956 -12.923  -7.767
  617    HG2  LYS  80           HG2      LYS  80   2.663 -12.635  -8.834
  618    HG3  LYS  80           HG3      LYS  80   2.089 -13.953  -7.787
  619    HD2  LYS  80           2HD      LYS  80   2.838 -12.619  -5.793
  620    HD3  LYS  80           3HD      LYS  80   3.311 -11.311  -6.903
  621    HE2  LYS  80           HE2      LYS  80   1.128 -10.817  -5.974
  622    HE3  LYS  80           HE3      LYS  80   0.978 -11.150  -7.706
  623    HZ1  LYS  80           3HZ      LYS  80   0.397 -13.067  -5.543
  624    HZ2  LYS  80           1HZ      LYS  80  -0.720 -12.251  -6.426
  625    HZ3  LYS  80           2HZ      LYS  80   0.247 -13.367  -7.155
  626    H    VAL  81           H        VAL  81   2.840 -13.876 -10.959
  627    HA   VAL  81           HA       VAL  81   4.638 -11.753 -12.014
  628    HB   VAL  81           HB       VAL  81   3.108 -13.716 -13.764
  629   HG11  VAL  81          1HG1      VAL  81   4.274 -12.561 -15.588
  630   HG12  VAL  81          HG21      VAL  81   3.301 -11.393 -14.662
  631   HG13  VAL  81          HG31      VAL  81   5.058 -11.462 -14.426
  632   HG21  VAL  81          HG32      VAL  81   5.084 -14.795 -12.772
  633   HG22  VAL  81          1HG2      VAL  81   5.392 -14.410 -14.480
  634   HG23  VAL  81          HG22      VAL  81   6.089 -13.391 -13.201
  635    H    GLU  82           H        GLU  82   3.638  -9.851 -12.111
  636    HA   GLU  82           HA       GLU  82   0.756  -9.647 -12.588
  637    HB2  GLU  82           HB2      GLU  82   0.979 -10.293 -10.155
  638    HB3  GLU  82           HB3      GLU  82   1.970  -8.863  -9.900
  639    HG2  GLU  82           HG2      GLU  82  -0.372  -8.532  -9.194
  640    HG3  GLU  82           HG3      GLU  82   0.087  -7.405 -10.469
  641    H    GLN  83           H        GLN  83   0.113  -7.269 -12.710
  642    HA   GLN  83           HA       GLN  83   2.130  -5.607 -13.852
  643    HB2  GLN  83           HB2      GLN  83  -0.185  -5.185 -14.350
  644    HB3  GLN  83           HB3      GLN  83  -0.603  -5.106 -12.635
  645    HG2  GLN  83           HG2      GLN  83  -0.625  -2.894 -13.543
  646    HG3  GLN  83           HG3      GLN  83   0.692  -3.032 -12.373
  647   HE21  GLN  83          HE22      GLN  83   2.039  -1.471 -13.076
  648   HE22  GLN  83          HE12      GLN  83   2.754  -1.409 -14.667
  649    H    ALA  84           H        ALA  84   3.547  -4.162 -12.928
  650    HA   ALA  84           HA       ALA  84   4.176  -4.749 -10.161
  651    HB1  ALA  84           1HB      ALA  84   5.465  -2.853 -12.158
  652    HB2  ALA  84           HB2      ALA  84   6.163  -3.373 -10.604
  653    HB3  ALA  84           HB3      ALA  84   5.902  -4.560 -11.903
  654    H    THR  85           H        THR  85   4.425  -3.322  -8.441
  655    HA   THR  85           HA       THR  85   3.034  -0.700  -8.697
  656    HB   THR  85           HB       THR  85   3.009  -0.695  -6.229
  657    HG1  THR  85           1HG      THR  85   3.431  -2.666  -5.180
  658   HG21  THR  85          1HG2      THR  85   1.037  -1.494  -7.530
  659   HG22  THR  85          HG22      THR  85   1.689  -3.147  -7.496
  660   HG23  THR  85          HG32      THR  85   1.181  -2.353  -5.984
  661    H    LYS  86           H        LYS  86   4.021   0.919  -7.080
  662    HA   LYS  86           HA       LYS  86   6.741   1.361  -8.007
  663    HB2  LYS  86           HB2      LYS  86   4.852   2.984  -6.247
  664    HB3  LYS  86           HB3      LYS  86   6.391   3.561  -6.925
  665    HG2  LYS  86           HG2      LYS  86   5.490   2.968  -9.233
  666    HG3  LYS  86           HG3      LYS  86   3.940   2.597  -8.461
  667    HD2  LYS  86           2HD      LYS  86   4.242   5.031  -7.431
  668    HD3  LYS  86           3HD      LYS  86   5.279   5.262  -8.847
  669    HE2  LYS  86           HE2      LYS  86   3.415   4.439 -10.310
  670    HE3  LYS  86           HE3      LYS  86   2.402   4.250  -8.866
  671    HZ1  LYS  86           3HZ      LYS  86   2.573   6.578  -8.461
  672    HZ2  LYS  86           1HZ      LYS  86   3.526   6.805  -9.786
  673    HZ3  LYS  86           2HZ      LYS  86   1.960   6.334  -9.962
  674    HA   PRO  87           HA       PRO  87   8.957  -0.172  -4.604
  675    HB2  PRO  87           HB2      PRO  87  11.100   1.504  -4.352
  676    HB3  PRO  87           HB3      PRO  87  10.854   0.447  -5.768
  677    HG2  PRO  87           HG2      PRO  87  10.062   3.367  -5.512
  678    HG3  PRO  87           HG3      PRO  87  11.026   2.603  -6.819
  679    HD2  PRO  87           2HD      PRO  87   8.366   2.991  -7.117
  680    HD3  PRO  87           3HD      PRO  87   9.122   1.471  -7.678
  681    H    SER  88           H        SER  88   9.592   0.191  -2.340
  682    HA   SER  88           HA       SER  88   7.605   1.979  -1.128
  683    HB2  SER  88           HB2      SER  88   7.899   0.625   0.868
  684    HB3  SER  88           HB3      SER  88   7.673  -0.431  -0.535
  685    HG   SER  88           HG       SER  88   9.426  -1.074   0.818
  686    H    PHE  89           H        PHE  89  10.926   2.182  -1.813
  687    HA   PHE  89           HA       PHE  89  11.443   3.870   0.558
  688    HB2  PHE  89           HB2      PHE  89  13.720   3.966  -0.159
  689    HB3  PHE  89           HB3      PHE  89  13.164   2.295  -0.045
  690    HD1  PHE  89           HD1      PHE  89  12.750   0.982  -2.156
  691    HD2  PHE  89           HD2      PHE  89  14.481   4.916  -2.192
  692    HE1  PHE  89           HE1      PHE  89  13.634   0.571  -4.425
  693    HE2  PHE  89           HE2      PHE  89  15.365   4.500  -4.491
  694    HZ   PHE  89           HZ       PHE  89  14.942   2.325  -5.594
  695    H    GLU  90           H        GLU  90   9.584   4.474  -1.845
  696    HA   GLU  90           HA       GLU  90  10.587   7.229  -2.264
  697    HB2  GLU  90           HB2      GLU  90  11.177   5.519  -4.165
  698    HB3  GLU  90           HB3      GLU  90   9.453   5.604  -4.552
  699    HG2  GLU  90           HG2      GLU  90   9.692   8.109  -4.729
  700    HG3  GLU  90           HG3      GLU  90  11.417   7.931  -4.361
  701    H    SER  91           H        SER  91   8.933   8.704  -2.997
  702    HA   SER  91           HA       SER  91   6.284   7.934  -1.910
  703    HB2  SER  91           HB2      SER  91   7.712   9.655  -0.747
  704    HB3  SER  91           HB3      SER  91   7.480  10.706  -2.164
  705    HG   SER  91           HG       SER  91   5.458   9.635  -0.476
  706    H    GLY  92           H        GLY  92   7.594   7.922  -4.817
  707    HA2  GLY  92           2HA      GLY  92   6.647   7.964  -6.913
  708    HA3  GLY  92           3HA      GLY  92   5.118   8.518  -6.202
  709    H    ARG  93           H        ARG  93   7.459  10.587  -5.067
  710    HA   ARG  93           HA       ARG  93   7.578  12.356  -7.436
  711    HB2  ARG  93           HB2      ARG  93   5.431  12.860  -6.245
  712    HB3  ARG  93           HB3      ARG  93   6.347  13.178  -4.766
  713    HG2  ARG  93           HG2      ARG  93   7.556  15.027  -5.933
  714    HG3  ARG  93           HG3      ARG  93   6.609  14.698  -7.402
  715    HD2  ARG  93           2HD      ARG  93   4.526  15.164  -6.131
  716    HD3  ARG  93           3HD      ARG  93   5.498  15.490  -4.681
  717    HE   ARG  93           HE       ARG  93   6.448  17.145  -6.790
  718   HH11  ARG  93          1HH1      ARG  93   3.587  16.762  -4.747
  719   HH12  ARG  93          2HH1      ARG  93   3.166  18.458  -4.820
  720   HH21  ARG  93          1HH2      ARG  93   5.865  19.353  -6.874
  721   HH22  ARG  93          2HH2      ARG  93   4.448  19.915  -6.021
  722    H    ARG  94           H        ARG  94   8.598  11.373  -4.217
  723    HA   ARG  94           HA       ARG  94  11.206  12.666  -4.606
  724    HB2  ARG  94           HB2      ARG  94  11.133  13.790  -2.426
  725    HB3  ARG  94           HB3      ARG  94   9.859  14.403  -3.492
  726    HG2  ARG  94           HG2      ARG  94   8.194  12.960  -2.369
  727    HG3  ARG  94           HG3      ARG  94   9.464  12.322  -1.299
  728    HD2  ARG  94           2HD      ARG  94   9.880  14.615  -0.446
  729    HD3  ARG  94           3HD      ARG  94   8.608  15.236  -1.506
  730    HE   ARG  94           HE       ARG  94   6.979  14.364  -0.090
  731   HH11  ARG  94          1HH1      ARG  94  10.171  13.182   0.884
  732   HH12  ARG  94          2HH1      ARG  94   9.595  12.527   2.397
  733   HH21  ARG  94          1HH2      ARG  94   6.256  13.493   1.891
  734   HH22  ARG  94          2HH2      ARG  94   7.387  12.710   2.968
  735    H    GLY  95           H        GLY  95  12.738  11.962  -2.846
  736    HA2  GLY  95           2HA      GLY  95  12.123   9.784  -1.097
  737    HA3  GLY  95           3HA      GLY  95  12.825   9.161  -2.603
  738    H5'    A  96           H5'        A  96  10.732 -14.028  -2.002
  739   H5''    A  96          H5''        A  96  12.366 -13.754  -1.396
  740    H4'    A  96           H4'        A  96  11.637 -15.528  -3.795
  741    H3'    A  96           H3'        A  96  11.743 -15.985  -0.870
  742    H2'    A  96           H2'        A  96  13.373 -17.707  -0.883
  743   HO2'    A  96          HO2'        A  96  12.483 -18.889  -2.635
  744    H1'    A  96           H1'        A  96  15.087 -16.712  -2.701
  745    H8     A  96           H8         A  96  14.316 -13.424  -1.503
  746    H61    A  96           H61        A  96  16.819 -14.776   4.013
  747    H62    A  96           H62        A  96  16.234 -13.482   2.987
  748    H2     A  96           H2         A  96  16.261 -18.572   1.780
  749   HO5'    A  96          H5T         A  96  11.680 -12.127  -2.869
  750    H5'    U  97           H5'        U  97  10.265 -18.990   1.570
  751   H5''    U  97          H5''        U  97   8.625 -18.469   1.176
  752    H4'    U  97           H4'        U  97   8.625 -16.968   2.807
  753    H3'    U  97           H3'        U  97  10.301 -15.520   1.197
  754    H2'    U  97           H2'        U  97  12.423 -16.234   1.775
  755   HO2'    U  97          HO2'        U  97  12.281 -14.181   2.866
  756    H1'    U  97           H1'        U  97  12.089 -17.075   4.527
  757    H3     U  97           H3         U  97  14.312 -20.963   4.092
  758    H5     U  97           H5         U  97  13.564 -19.802   0.123
  759    H6     U  97           H6         U  97  12.217 -17.975   0.974
  760    H5'    C  98           H5'        C  98   7.880 -11.373   1.618
  761   H5''    C  98          H5''        C  98   7.269 -12.560   0.451
  762    H4'    C  98           H4'        C  98   9.857 -10.962   0.156
  763    H3'    C  98           H3'        C  98   7.458  -9.765  -0.059
  764    H2'    C  98           H2'        C  98   6.418 -11.629  -1.187
  765   HO2'    C  98          HO2'        C  98   7.239  -9.715  -3.127
  766    H1'    C  98           H1'        C  98   8.609 -11.695  -3.238
  767    H41    C  98           H41        C  98   5.473 -17.117  -4.367
  768    H42    C  98           H42        C  98   5.777 -17.676  -2.733
  769    H5     C  98           H5         C  98   6.874 -16.297  -1.042
  770    H6     C  98           H6         C  98   7.898 -14.126  -0.627
  771    H5'    A  99           H5'        A  99   9.575  -5.435  -1.152
  772   H5''    A  99          H5''        A  99   8.288  -6.341  -1.985
  773    H4'    A  99           H4'        A  99  10.710  -5.405  -3.532
  774    H3'    A  99           H3'        A  99   9.203  -3.519  -2.136
  775    H2'    A  99           H2'        A  99   7.138  -4.132  -3.238
  776   HO2'    A  99          HO2'        A  99   7.466  -1.898  -3.663
  777    H1'    A  99           H1'        A  99   8.846  -4.347  -5.731
  778    H8     A  99           H8         A  99   6.915  -3.857  -7.295
  779    H61    A  99           H61        A  99   2.152  -7.775  -6.512
  780    H62    A  99           H62        A  99   2.819  -6.531  -7.555
  781    H2     A  99           H2         A  99   4.990  -8.342  -3.157
  782    H5'    A 100           H5'        A 100  12.401  -3.953  -5.019
  783   H5''    A 100          H5''        A 100  13.811  -3.612  -3.991
  784    H4'    A 100           H4'        A 100  14.775  -3.739  -6.092
  785    H3'    A 100           H3'        A 100  14.861  -1.264  -4.985
  786    H2'    A 100           H2'        A 100  12.734  -0.612  -5.903
  787   HO2'    A 100          HO2'        A 100  14.733   0.252  -7.746
  788    H1'    A 100           H1'        A 100  13.628  -1.636  -8.600
  789    H8     A 100           H8         A 100  10.539  -1.818  -6.195
  790    H61    A 100           H61        A 100   7.328  -0.035 -11.208
  791    H62    A 100           H62        A 100   7.214  -0.493  -9.519
  792    H2     A 100           H2         A 100  11.613  -0.352 -12.337
  793    H5'    A 101           H5'        A 101  16.721   0.856  -6.683
  794   H5''    A 101          H5''        A 101  18.184   0.245  -7.455
  795    H4'    A 101           H4'        A 101  18.544   2.478  -6.666
  796    H3'    A 101           H3'        A 101  20.311   0.454  -6.256
  797   HO3'    A 101          H3T         A 101  21.704   2.136  -5.391
  798    H2'    A 101           H2'        A 101  19.582  -0.254  -4.153
  799   HO2'    A 101          HO2'        A 101  20.988   0.622  -2.572
  800    H1'    A 101           H1'        A 101  19.206   2.539  -3.118
  801    H8     A 101           H8         A 101  17.957  -1.091  -3.331
  802    H61    A 101           H61        A 101  14.744   0.267   1.806
  803    H62    A 101           H62        A 101  15.200  -1.015   0.698
  804    H2     A 101           H2         A 101  16.585   4.015   0.293
  Start of MODEL   12
    1    H1   MET   1           H1       MET   1  -0.859   4.567  -1.083
    2    H2   MET   1           H2       MET   1   0.567   4.073  -0.432
    3    H3   MET   1           H3       MET   1  -0.690   3.016  -0.566
    4    HA   MET   1           HA       MET   1   0.775   4.238  -2.815
    5    HB2  MET   1           HB2      MET   1   2.031   2.467  -1.522
    6    HB3  MET   1           HB3      MET   1   0.722   1.337  -1.922
    7    HG2  MET   1           HG2      MET   1   1.169   2.129  -4.398
    8    HG3  MET   1           HG3      MET   1   2.707   2.698  -3.756
    9    HE1  MET   1           HE1      MET   1   1.246  -1.654  -4.151
   10    HE2  MET   1           HE2      MET   1   0.448  -0.505  -3.048
   11    HE3  MET   1           HE3      MET   1   0.450  -0.196  -4.798
   12    H    VAL   2           H        VAL   2  -1.245   4.979  -3.691
   13    HA   VAL   2           HA       VAL   2  -2.967   2.847  -4.757
   14    HB   VAL   2           HB       VAL   2  -4.012   4.889  -3.860
   15   HG11  VAL   2          1HG1      VAL   2  -2.427   6.355  -6.014
   16   HG12  VAL   2          HG21      VAL   2  -3.689   7.070  -4.994
   17   HG13  VAL   2          HG31      VAL   2  -2.179   6.493  -4.257
   18   HG21  VAL   2          HG32      VAL   2  -5.462   5.410  -5.689
   19   HG22  VAL   2          1HG2      VAL   2  -4.219   4.990  -6.885
   20   HG23  VAL   2          HG22      VAL   2  -4.964   3.706  -5.893
   21    H    GLU   3           H        GLU   3  -0.039   3.623  -5.375
   22    HA   GLU   3           HA       GLU   3  -0.156   4.667  -8.068
   23    HB2  GLU   3           HB2      GLU   3   2.144   3.667  -6.338
   24    HB3  GLU   3           HB3      GLU   3   2.345   4.516  -7.876
   25    HG2  GLU   3           HG2      GLU   3   0.857   5.656  -5.475
   26    HG3  GLU   3           HG3      GLU   3   2.561   5.975  -5.843
   27    H    ALA   4           H        ALA   4   0.200   3.824  -9.919
   28    HA   ALA   4           HA       ALA   4   1.177   1.062 -10.270
   29    HB1  ALA   4           1HB      ALA   4  -1.445   2.159 -11.393
   30    HB2  ALA   4           HB2      ALA   4  -0.703   0.601 -11.836
   31    HB3  ALA   4           HB3      ALA   4  -1.295   0.872 -10.177
   32    H    ASP   5           H        ASP   5   2.876   1.414 -11.474
   33    HA   ASP   5           HA       ASP   5   3.240   3.906 -12.886
   34    HB2  ASP   5           HB2      ASP   5   4.959   2.810 -11.499
   35    HB3  ASP   5           HB3      ASP   5   5.051   1.484 -12.636
   36    H    ARG   6           H        ARG   6   1.201   3.035 -14.165
   37    HA   ARG   6           HA       ARG   6   0.264   2.669 -16.136
   38    HB2  ARG   6           HB2      ARG   6   3.053   3.136 -17.224
   39    HB3  ARG   6           HB3      ARG   6   1.565   3.132 -18.182
   40    HG2  ARG   6           HG2      ARG   6   0.674   5.006 -16.834
   41    HG3  ARG   6           HG3      ARG   6   2.142   5.002 -15.844
   42    HD2  ARG   6           2HD      ARG   6   2.294   6.749 -17.534
   43    HD3  ARG   6           3HD      ARG   6   3.506   5.505 -17.854
   44    HE   ARG   6           HE       ARG   6   2.415   4.908 -19.815
   45   HH11  ARG   6          1HH1      ARG   6   0.407   7.153 -17.968
   46   HH12  ARG   6          2HH1      ARG   6  -0.722   7.410 -19.282
   47   HH21  ARG   6          1HH2      ARG   6   0.939   5.268 -21.511
   48   HH22  ARG   6          2HH2      ARG   6  -0.416   6.348 -21.283
   49    HA   PRO   7           HA       PRO   7   0.189  -1.550 -17.348
   50    HB2  PRO   7           HB2      PRO   7  -0.130  -0.374 -20.103
   51    HB3  PRO   7           HB3      PRO   7  -1.081  -1.712 -19.369
   52    HG2  PRO   7           HG2      PRO   7  -2.122   0.744 -19.518
   53    HG3  PRO   7           HG3      PRO   7  -2.229  -0.129 -17.946
   54    HD2  PRO   7           2HD      PRO   7  -0.242   2.004 -18.786
   55    HD3  PRO   7           3HD      PRO   7  -1.141   1.842 -17.242
   56    H    GLY   8           H        GLY   8   1.558  -3.160 -18.251
   57    HA2  GLY   8           2HA      GLY   8   2.927  -3.900 -20.072
   58    HA3  GLY   8           3HA      GLY   8   3.585  -2.252 -20.225
   59    H    LYS   9           H        LYS   9   3.638  -2.234 -17.066
   60    HA   LYS   9           HA       LYS   9   6.300  -3.541 -16.999
   61    HB2  LYS   9           HB2      LYS   9   6.236  -1.165 -16.378
   62    HB3  LYS   9           HB3      LYS   9   5.094  -1.547 -15.061
   63    HG2  LYS   9           HG2      LYS   9   6.762  -3.105 -14.079
   64    HG3  LYS   9           HG3      LYS   9   7.883  -2.770 -15.405
   65    HD2  LYS   9           2HD      LYS   9   6.845  -0.663 -13.476
   66    HD3  LYS   9           3HD      LYS   9   8.365  -1.563 -13.264
   67    HE2  LYS   9           HE2      LYS   9   9.191  -0.724 -15.432
   68    HE3  LYS   9           HE3      LYS   9   7.680   0.168 -15.680
   69    HZ1  LYS   9           3HZ      LYS   9   8.183   1.521 -13.818
   70    HZ2  LYS   9           1HZ      LYS   9   9.510   0.625 -13.423
   71    HZ3  LYS   9           2HZ      LYS   9   9.485   1.525 -14.803
   72    H    LEU  10           H        LEU  10   6.659  -5.325 -15.833
   73    HA   LEU  10           HA       LEU  10   4.386  -6.351 -14.190
   74    HB2  LEU  10           HB2      LEU  10   6.506  -7.737 -15.845
   75    HB3  LEU  10           HB3      LEU  10   5.426  -8.618 -14.823
   76    HG   LEU  10           HG       LEU  10   4.618  -6.933 -17.237
   77   HD11  LEU  10          1HD1      LEU  10   4.154  -9.096 -18.242
   78   HD12  LEU  10          2HD1      LEU  10   5.778  -9.210 -17.499
   79   HD13  LEU  10          3HD1      LEU  10   4.380  -9.924 -16.686
   80   HD21  LEU  10          3HD2      LEU  10   2.913  -8.547 -15.309
   81   HD22  LEU  10          1HD2      LEU  10   2.815  -6.789 -15.629
   82   HD23  LEU  10          2HD2      LEU  10   2.370  -7.954 -16.892
   83    H    PHE  11           H        PHE  11   4.876  -7.473 -12.314
   84    HA   PHE  11           HA       PHE  11   7.603  -7.068 -11.178
   85    HB2  PHE  11           HB2      PHE  11   5.928  -5.986  -9.824
   86    HB3  PHE  11           HB3      PHE  11   4.850  -7.383  -9.938
   87    HD1  PHE  11           HD2      PHE  11   8.224  -6.362  -8.678
   88    HD2  PHE  11           HD1      PHE  11   4.906  -9.072  -8.299
   89    HE1  PHE  11           HE2      PHE  11   9.235  -7.311  -6.625
   90    HE2  PHE  11           HE1      PHE  11   5.917 -10.021  -6.246
   91    HZ   PHE  11           HZ       PHE  11   8.097  -9.136  -5.416
   92    H    ILE  12           H        ILE  12   8.774  -8.873 -10.740
   93    HA   ILE  12           HA       ILE  12   7.452 -11.500 -11.252
   94    HB   ILE  12           HB       ILE  12  10.331 -10.888 -11.917
   95   HG12  ILE  12          HG21      ILE  12   9.166  -9.230 -13.243
   96   HG13  ILE  12          HG31      ILE  12   9.822 -10.522 -14.232
   97   HG21  ILE  12          1HG2      ILE  12   8.291 -12.913 -12.905
   98   HG22  ILE  12          HG22      ILE  12   9.976 -12.789 -13.467
   99   HG23  ILE  12          HG32      ILE  12   9.618 -13.218 -11.773
  100   HD11  ILE  12          3HD1      ILE  12   6.906 -10.110 -13.488
  101   HD12  ILE  12          1HD1      ILE  12   7.670  -9.943 -15.090
  102   HD13  ILE  12          2HD1      ILE  12   7.520 -11.545 -14.345
  103    H    GLY  13           H        GLY  13   7.150 -11.677  -8.889
  104    HA2  GLY  13           2HA      GLY  13   9.650 -11.639  -7.292
  105    HA3  GLY  13           3HA      GLY  13   8.018 -11.720  -6.659
  106    H    GLY  14           H        GLY  14  10.573 -13.435  -6.317
  107    HA2  GLY  14           2HA      GLY  14  10.346 -15.522  -5.199
  108    HA3  GLY  14           3HA      GLY  14   9.038 -15.985  -6.304
  109    H    LEU  15           H        LEU  15  11.622 -14.407  -7.891
  110    HA   LEU  15           HA       LEU  15  12.189 -16.674  -9.538
  111    HB2  LEU  15           HB2      LEU  15  13.689 -14.066  -9.108
  112    HB3  LEU  15           HB3      LEU  15  13.972 -15.235 -10.431
  113    HG   LEU  15           HG       LEU  15  11.235 -14.017 -10.094
  114   HD11  LEU  15          1HD1      LEU  15  13.682 -12.879 -11.517
  115   HD12  LEU  15          2HD1      LEU  15  12.010 -12.325 -11.785
  116   HD13  LEU  15          3HD1      LEU  15  12.781 -12.110 -10.194
  117   HD21  LEU  15          3HD2      LEU  15  11.754 -15.996 -11.597
  118   HD22  LEU  15          1HD2      LEU  15  11.153 -14.565 -12.483
  119   HD23  LEU  15          2HD2      LEU  15  12.887 -14.958 -12.484
  120    H    ASN  16           H        ASN  16  14.391 -17.540  -9.954
  121    HA   ASN  16           HA       ASN  16  15.578 -18.523  -7.525
  122    HB2  ASN  16           HB2      ASN  16  15.140 -19.758  -9.657
  123    HB3  ASN  16           HB3      ASN  16  16.455 -18.830 -10.402
  124   HD21  ASN  16          2HD2      ASN  16  17.142 -21.110 -10.762
  125   HD22  ASN  16          1HD2      ASN  16  18.107 -21.868  -9.544
  126    H    THR  17           H        THR  17  17.876 -18.305  -6.992
  127    HA   THR  17           HA       THR  17  18.942 -15.640  -7.267
  128    HB   THR  17           HB       THR  17  20.826 -16.576  -5.974
  129    HG1  THR  17           1HG      THR  17  20.934 -18.618  -6.956
  130   HG21  THR  17          1HG2      THR  17  18.184 -17.742  -5.019
  131   HG22  THR  17          HG22      THR  17  19.589 -17.327  -4.015
  132   HG23  THR  17          HG32      THR  17  18.662 -16.032  -4.815
  133    H    GLU  18           H        GLU  18  18.821 -18.256  -9.327
  134    HA   GLU  18           HA       GLU  18  21.514 -17.923 -10.487
  135    HB2  GLU  18           HB2      GLU  18  19.373 -19.936 -11.215
  136    HB3  GLU  18           HB3      GLU  18  21.122 -20.073 -11.462
  137    HG2  GLU  18           HG2      GLU  18  19.672 -20.046  -8.773
  138    HG3  GLU  18           HG3      GLU  18  20.258 -21.480  -9.567
  139    H    THR  19           H        THR  19  18.326 -16.802 -10.873
  140    HA   THR  19           HA       THR  19  18.352 -16.621 -13.791
  141    HB   THR  19           HB       THR  19  16.494 -15.343 -11.742
  142    HG1  THR  19           1HG      THR  19  16.288 -17.783 -13.160
  143   HG21  THR  19          1HG2      THR  19  14.892 -15.335 -13.633
  144   HG22  THR  19          HG22      THR  19  16.316 -14.330 -13.987
  145   HG23  THR  19          HG32      THR  19  16.161 -15.947 -14.713
  146    H    ASN  20           H        ASN  20  18.732 -14.782 -14.993
  147    HA   ASN  20           HA       ASN  20  19.334 -12.275 -13.519
  148    HB2  ASN  20           HB2      ASN  20  20.931 -12.747 -15.936
  149    HB3  ASN  20           HB3      ASN  20  21.362 -11.918 -14.436
  150   HD21  ASN  20          2HD2      ASN  20  21.446 -14.869 -16.255
  151   HD22  ASN  20          1HD2      ASN  20  22.340 -15.822 -15.091
  152    H    GLU  21           H        GLU  21  19.923 -10.736 -15.719
  153    HA   GLU  21           HA       GLU  21  17.244 -10.135 -16.590
  154    HB2  GLU  21           HB2      GLU  21  19.975  -9.069 -17.409
  155    HB3  GLU  21           HB3      GLU  21  18.432  -8.362 -17.929
  156    HG2  GLU  21           HG2      GLU  21  17.799  -7.880 -15.630
  157    HG3  GLU  21           HG3      GLU  21  19.165  -8.816 -15.022
  158    H    LYS  22           H        LYS  22  20.014 -11.819 -18.076
  159    HA   LYS  22           HA       LYS  22  19.071 -11.672 -20.755
  160    HB2  LYS  22           HB2      LYS  22  21.368 -12.368 -19.644
  161    HB3  LYS  22           HB3      LYS  22  20.686 -13.989 -19.660
  162    HG2  LYS  22           HG2      LYS  22  21.185 -12.156 -22.046
  163    HG3  LYS  22           HG3      LYS  22  22.097 -13.604 -21.598
  164    HD2  LYS  22           2HD      LYS  22  19.954 -14.940 -21.950
  165    HD3  LYS  22           3HD      LYS  22  19.257 -13.472 -22.679
  166    HE2  LYS  22           HE2      LYS  22  21.799 -14.859 -23.613
  167    HE3  LYS  22           HE3      LYS  22  20.204 -15.015 -24.367
  168    HZ1  LYS  22           3HZ      LYS  22  20.257 -12.650 -24.804
  169    HZ2  LYS  22           1HZ      LYS  22  21.740 -12.514 -24.111
  170    HZ3  LYS  22           2HZ      LYS  22  21.553 -13.394 -25.485
  171    H    ALA  23           H        ALA  23  18.275 -13.805 -18.023
  172    HA   ALA  23           HA       ALA  23  16.975 -15.758 -19.801
  173    HB1  ALA  23           1HB      ALA  23  17.217 -15.598 -16.766
  174    HB2  ALA  23           HB2      ALA  23  16.567 -16.973 -17.680
  175    HB3  ALA  23           HB3      ALA  23  18.278 -16.525 -17.855
  176    H    LEU  24           H        LEU  24  16.270 -12.894 -18.023
  177    HA   LEU  24           HA       LEU  24  13.437 -13.425 -17.602
  178    HB2  LEU  24           HB2      LEU  24  15.640 -11.698 -16.704
  179    HB3  LEU  24           HB3      LEU  24  14.241 -10.707 -17.019
  180    HG   LEU  24           HG       LEU  24  14.111 -13.323 -15.488
  181   HD11  LEU  24          1HD1      LEU  24  14.644 -10.547 -14.335
  182   HD12  LEU  24          2HD1      LEU  24  14.288 -12.018 -13.391
  183   HD13  LEU  24          3HD1      LEU  24  15.775 -11.929 -14.355
  184   HD21  LEU  24          3HD2      LEU  24  12.410 -10.784 -15.320
  185   HD22  LEU  24          1HD2      LEU  24  11.983 -12.235 -16.248
  186   HD23  LEU  24          2HD2      LEU  24  12.092 -12.318 -14.468
  187    H    GLU  25           H        GLU  25  15.597 -11.768 -19.836
  188    HA   GLU  25           HA       GLU  25  13.384 -10.479 -21.228
  189    HB2  GLU  25           HB2      GLU  25  16.320 -10.979 -21.944
  190    HB3  GLU  25           HB3      GLU  25  15.194 -10.125 -23.019
  191    HG2  GLU  25           HG2      GLU  25  14.687  -8.548 -21.207
  192    HG3  GLU  25           HG3      GLU  25  15.931  -9.299 -20.194
  193    H    ALA  26           H        ALA  26  15.131 -13.465 -21.268
  194    HA   ALA  26           HA       ALA  26  14.391 -14.296 -23.963
  195    HB1  ALA  26           1HB      ALA  26  15.625 -15.743 -21.601
  196    HB2  ALA  26           HB2      ALA  26  15.546 -16.381 -23.262
  197    HB3  ALA  26           HB3      ALA  26  16.520 -14.926 -22.911
  198    H    VAL  27           H        VAL  27  12.968 -14.473 -20.793
  199    HA   VAL  27           HA       VAL  27  11.299 -16.792 -21.572
  200    HB   VAL  27           HB       VAL  27  12.745 -16.715 -19.546
  201   HG11  VAL  27          1HG1      VAL  27  10.546 -15.005 -18.390
  202   HG12  VAL  27          HG21      VAL  27  12.044 -15.555 -17.582
  203   HG13  VAL  27          HG31      VAL  27  12.144 -14.373 -18.910
  204   HG21  VAL  27          HG32      VAL  27  10.885 -18.322 -19.789
  205   HG22  VAL  27          1HG2      VAL  27  11.062 -17.782 -18.095
  206   HG23  VAL  27          HG22      VAL  27   9.757 -17.106 -19.111
  207    H    PHE  28           H        PHE  28  11.133 -13.436 -20.411
  208    HA   PHE  28           HA       PHE  28   8.199 -13.464 -20.706
  209    HB2  PHE  28           HB2      PHE  28  10.120 -11.306 -19.807
  210    HB3  PHE  28           HB3      PHE  28   8.388 -11.052 -20.054
  211    HD1  PHE  28           HD1      PHE  28   6.707 -12.088 -18.613
  212    HD2  PHE  28           HD2      PHE  28  10.906 -12.662 -17.933
  213    HE1  PHE  28           HE1      PHE  28   6.221 -13.015 -16.363
  214    HE2  PHE  28           HE2      PHE  28  10.431 -13.590 -15.693
  215    HZ   PHE  28           HZ       PHE  28   8.081 -13.765 -14.900
  216    H    GLY  29           H        GLY  29  10.921 -12.953 -22.709
  217    HA2  GLY  29           2HA      GLY  29   9.668 -11.053 -24.523
  218    HA3  GLY  29           3HA      GLY  29  11.115 -12.033 -24.846
  219    H    LYS  30           H        LYS  30   8.966 -14.213 -23.701
  220    HA   LYS  30           HA       LYS  30   8.352 -15.279 -26.334
  221    HB2  LYS  30           HB2      LYS  30   7.641 -16.205 -23.506
  222    HB3  LYS  30           HB3      LYS  30   7.542 -17.191 -24.980
  223    HG2  LYS  30           HG2      LYS  30   9.961 -16.998 -25.292
  224    HG3  LYS  30           HG3      LYS  30  10.110 -15.931 -23.886
  225    HD2  LYS  30           2HD      LYS  30  10.787 -18.235 -23.314
  226    HD3  LYS  30           3HD      LYS  30   9.427 -17.666 -22.352
  227    HE2  LYS  30           HE2      LYS  30   9.041 -19.949 -23.007
  228    HE3  LYS  30           HE3      LYS  30   7.852 -18.900 -23.785
  229    HZ1  LYS  30           3HZ      LYS  30  10.294 -19.965 -25.058
  230    HZ2  LYS  30           1HZ      LYS  30   8.767 -20.518 -25.314
  231    HZ3  LYS  30           2HZ      LYS  30   9.182 -18.999 -25.793
  232    H    TYR  31           H        TYR  31   6.896 -13.163 -24.160
  233    HA   TYR  31           HA       TYR  31   4.145 -13.800 -25.132
  234    HB2  TYR  31           HB2      TYR  31   5.120 -12.243 -22.720
  235    HB3  TYR  31           HB3      TYR  31   3.426 -12.534 -23.125
  236    HD1  TYR  31           HD2      TYR  31   2.718 -15.070 -23.265
  237    HD2  TYR  31           HD1      TYR  31   6.337 -13.689 -21.406
  238    HE1  TYR  31           HE2      TYR  31   2.888 -17.209 -22.021
  239    HE2  TYR  31           HE1      TYR  31   6.510 -15.830 -20.132
  240    HH   TYR  31           HH       TYR  31   5.626 -17.931 -19.830
  241    H    GLY  32           H        GLY  32   6.691 -11.371 -25.262
  242    HA2  GLY  32           2HA      GLY  32   5.352  -9.851 -27.243
  243    HA3  GLY  32           3HA      GLY  32   5.154  -9.042 -25.667
  244    H    ARG  33           H        ARG  33   6.422  -7.836 -27.807
  245    HA   ARG  33           HA       ARG  33   9.245  -8.048 -27.634
  246    HB2  ARG  33           HB2      ARG  33   7.734  -6.967 -29.429
  247    HB3  ARG  33           HB3      ARG  33   7.637  -5.557 -28.346
  248    HG2  ARG  33           HG2      ARG  33  10.136  -5.461 -28.313
  249    HG3  ARG  33           HG3      ARG  33  10.150  -6.871 -29.409
  250    HD2  ARG  33           2HD      ARG  33   8.887  -4.161 -30.025
  251    HD3  ARG  33           3HD      ARG  33  10.486  -4.683 -30.593
  252    HE   ARG  33           HE       ARG  33   8.739  -6.688 -31.418
  253   HH11  ARG  33          1HH1      ARG  33   9.062  -3.207 -31.950
  254   HH12  ARG  33          2HH1      ARG  33   8.333  -3.265 -33.541
  255   HH21  ARG  33          1HH2      ARG  33   7.801  -6.735 -33.496
  256   HH22  ARG  33          2HH2      ARG  33   7.629  -5.257 -34.414
  257    H    ILE  34           H        ILE  34  10.412  -7.662 -25.985
  258    HA   ILE  34           HA       ILE  34   9.540  -6.023 -23.722
  259    HB   ILE  34           HB       ILE  34  12.120  -7.486 -24.367
  260   HG12  ILE  34          HG21      ILE  34   9.702  -8.048 -22.588
  261   HG13  ILE  34          HG31      ILE  34  10.202  -8.943 -24.025
  262   HG21  ILE  34          1HG2      ILE  34  11.295  -6.160 -21.751
  263   HG22  ILE  34          HG22      ILE  34  12.786  -7.090 -22.059
  264   HG23  ILE  34          HG32      ILE  34  12.549  -5.547 -22.866
  265   HD11  ILE  34          3HD1      ILE  34  11.706  -8.808 -21.385
  266   HD12  ILE  34          1HD1      ILE  34  10.840 -10.196 -22.055
  267   HD13  ILE  34          2HD1      ILE  34  12.307  -9.598 -22.872
  268    H    VAL  35           H        VAL  35  10.248  -4.049 -23.099
  269    HA   VAL  35           HA       VAL  35  11.962  -2.570 -25.037
  270    HB   VAL  35           HB       VAL  35  10.463  -0.803 -23.325
  271   HG11  VAL  35          1HG1      VAL  35  10.306  -1.408 -26.301
  272   HG12  VAL  35          HG21      VAL  35   9.703   0.057 -25.494
  273   HG13  VAL  35          HG31      VAL  35  11.454  -0.283 -25.524
  274   HG21  VAL  35          HG32      VAL  35   8.746  -2.786 -24.874
  275   HG22  VAL  35          1HG2      VAL  35   8.761  -2.546 -23.108
  276   HG23  VAL  35          HG22      VAL  35   8.189  -1.253 -24.175
  277    H    GLU  36           H        GLU  36  11.499  -3.646 -21.749
  278    HA   GLU  36           HA       GLU  36  14.202  -2.839 -21.057
  279    HB2  GLU  36           HB2      GLU  36  12.952  -0.741 -20.619
  280    HB3  GLU  36           HB3      GLU  36  11.826  -1.624 -19.569
  281    HG2  GLU  36           HG2      GLU  36  13.632  -2.157 -18.018
  282    HG3  GLU  36           HG3      GLU  36  14.824  -1.446 -19.117
  283    H    VAL  37           H        VAL  37  14.979  -4.035 -19.260
  284    HA   VAL  37           HA       VAL  37  12.985  -5.600 -17.736
  285    HB   VAL  37           HB       VAL  37  15.185  -6.749 -19.409
  286   HG11  VAL  37          1HG1      VAL  37  14.354  -7.941 -16.730
  287   HG12  VAL  37          HG21      VAL  37  15.332  -8.746 -17.975
  288   HG13  VAL  37          HG31      VAL  37  15.980  -7.327 -17.141
  289   HG21  VAL  37          HG32      VAL  37  12.491  -7.720 -18.343
  290   HG22  VAL  37          1HG2      VAL  37  12.803  -7.065 -19.971
  291   HG23  VAL  37          HG22      VAL  37  13.510  -8.623 -19.470
  292    H    LEU  38           H        LEU  38  13.455  -5.964 -15.661
  293    HA   LEU  38           HA       LEU  38  16.004  -4.822 -14.531
  294    HB2  LEU  38           HB2      LEU  38  13.139  -4.684 -13.853
  295    HB3  LEU  38           HB3      LEU  38  14.199  -4.869 -12.475
  296    HG   LEU  38           HG       LEU  38  14.330  -2.602 -14.518
  297   HD11  LEU  38          1HD1      LEU  38  12.465  -2.441 -12.911
  298   HD12  LEU  38          2HD1      LEU  38  13.593  -2.696 -11.558
  299   HD13  LEU  38          3HD1      LEU  38  13.714  -1.227 -12.539
  300   HD21  LEU  38          3HD2      LEU  38  16.024  -3.132 -12.052
  301   HD22  LEU  38          1HD2      LEU  38  16.609  -3.061 -13.732
  302   HD23  LEU  38          2HD2      LEU  38  15.975  -1.598 -12.947
  303    H    LEU  39           H        LEU  39  16.945  -6.012 -12.873
  304    HA   LEU  39           HA       LEU  39  15.550  -8.363 -11.876
  305    HB2  LEU  39           HB2      LEU  39  16.811  -9.178 -13.849
  306    HB3  LEU  39           HB3      LEU  39  18.298  -8.467 -13.204
  307    HG   LEU  39           HG       LEU  39  17.943 -10.973 -13.039
  308   HD11  LEU  39          1HD1      LEU  39  18.604  -9.491 -10.475
  309   HD12  LEU  39          2HD1      LEU  39  19.088 -11.148 -10.876
  310   HD13  LEU  39          3HD1      LEU  39  19.713  -9.794 -11.849
  311   HD21  LEU  39          3HD2      LEU  39  16.776 -11.887 -11.172
  312   HD22  LEU  39          1HD2      LEU  39  16.282 -10.268 -10.603
  313   HD23  LEU  39          2HD2      LEU  39  15.636 -10.923 -12.135
  314    H    MET  40           H        MET  40  15.788  -8.198  -9.683
  315    HA   MET  40           HA       MET  40  17.652  -6.080  -8.828
  316    HB2  MET  40           HB2      MET  40  15.541  -7.426  -7.125
  317    HB3  MET  40           HB3      MET  40  16.304  -5.853  -6.894
  318    HG2  MET  40           HG2      MET  40  14.092  -6.696  -8.705
  319    HG3  MET  40           HG3      MET  40  14.233  -5.251  -7.724
  320    HE1  MET  40           HE3      MET  40  17.145  -4.213  -8.709
  321    HE2  MET  40           HE1      MET  40  16.734  -3.155 -10.086
  322    HE3  MET  40           HE2      MET  40  15.808  -3.068  -8.560
  323    H    LYS  41           H        LYS  41  19.327  -6.356  -7.314
  324    HA   LYS  41           HA       LYS  41  19.555  -9.087  -6.236
  325    HB2  LYS  41           HB2      LYS  41  22.156  -7.994  -7.064
  326    HB3  LYS  41           HB3      LYS  41  21.461  -9.631  -7.107
  327    HG2  LYS  41           HG2      LYS  41  20.319  -9.171  -9.185
  328    HG3  LYS  41           HG3      LYS  41  20.774  -7.445  -9.118
  329    HD2  LYS  41           2HD      LYS  41  23.152  -8.058  -9.234
  330    HD3  LYS  41           3HD      LYS  41  22.718  -9.782  -9.332
  331    HE2  LYS  41           HE2      LYS  41  21.519  -9.379 -11.430
  332    HE3  LYS  41           HE3      LYS  41  21.857  -7.640 -11.321
  333    HZ1  LYS  41           3HZ      LYS  41  23.888  -9.762 -11.578
  334    HZ2  LYS  41           1HZ      LYS  41  23.407  -8.735 -12.770
  335    HZ3  LYS  41           2HZ      LYS  41  24.200  -8.156 -11.456
  336    H    ASP  42           H        ASP  42  20.997  -9.367  -4.498
  337    HA   ASP  42           HA       ASP  42  20.794  -7.455  -2.447
  338    HB2  ASP  42           HB2      ASP  42  21.227 -10.002  -2.362
  339    HB3  ASP  42           HB3      ASP  42  22.908  -9.608  -2.700
  340    H    ARG  43           H        ARG  43  22.352  -6.057  -1.480
  341    HA   ARG  43           HA       ARG  43  24.115  -4.859  -3.486
  342    HB2  ARG  43           HB2      ARG  43  22.540  -3.503  -2.176
  343    HB3  ARG  43           HB3      ARG  43  23.313  -4.009  -0.671
  344    HG2  ARG  43           HG2      ARG  43  23.984  -1.728  -1.398
  345    HG3  ARG  43           HG3      ARG  43  25.361  -2.828  -1.255
  346    HD2  ARG  43           2HD      ARG  43  25.309  -3.195  -3.722
  347    HD3  ARG  43           3HD      ARG  43  23.929  -2.094  -3.843
  348    HE   ARG  43           HE       ARG  43  25.368  -0.286  -3.647
  349   HH11  ARG  43          1HH1      ARG  43  27.076  -3.227  -2.662
  350   HH12  ARG  43          2HH1      ARG  43  28.631  -2.435  -2.591
  351   HH21  ARG  43          1HH2      ARG  43  27.409   0.716  -3.534
  352   HH22  ARG  43          2HH2      ARG  43  28.815  -0.214  -3.067
  353    H    GLU  44           H        GLU  44  24.503  -7.229  -1.089
  354    HA   GLU  44           HA       GLU  44  27.403  -6.563  -0.814
  355    HB2  GLU  44           HB2      GLU  44  25.516  -7.879   1.162
  356    HB3  GLU  44           HB3      GLU  44  27.266  -7.713   1.376
  357    HG2  GLU  44           HG2      GLU  44  27.038  -5.236   1.219
  358    HG3  GLU  44           HG3      GLU  44  25.285  -5.412   1.077
  359    H    THR  45           H        THR  45  25.110  -8.888  -1.967
  360    HA   THR  45           HA       THR  45  27.356 -10.848  -2.190
  361    HB   THR  45           HB       THR  45  25.865 -12.663  -1.925
  362    HG1  THR  45           1HG      THR  45  23.617 -12.305  -1.727
  363   HG21  THR  45          1HG2      THR  45  24.912 -12.308   0.291
  364   HG22  THR  45          HG22      THR  45  26.470 -11.438   0.182
  365   HG23  THR  45          HG32      THR  45  24.935 -10.543   0.050
  366    H    ASN  46           H        ASN  46  25.006  -8.917  -3.771
  367    HA   ASN  46           HA       ASN  46  24.514  -8.602  -5.939
  368    HB2  ASN  46           HB2      ASN  46  27.113  -8.559  -5.699
  369    HB3  ASN  46           HB3      ASN  46  27.057 -10.028  -6.677
  370   HD21  ASN  46          2HD2      ASN  46  28.411  -8.407  -8.037
  371   HD22  ASN  46          1HD2      ASN  46  27.507  -7.495  -9.231
  372    H    LYS  47           H        LYS  47  23.814 -11.282  -4.662
  373    HA   LYS  47           HA       LYS  47  23.682 -13.247  -6.802
  374    HB2  LYS  47           HB2      LYS  47  22.336 -12.934  -4.095
  375    HB3  LYS  47           HB3      LYS  47  22.051 -14.315  -5.159
  376    HG2  LYS  47           HG2      LYS  47  24.775 -13.495  -4.062
  377    HG3  LYS  47           HG3      LYS  47  23.748 -14.779  -3.409
  378    HD2  LYS  47           2HD      LYS  47  23.851 -15.953  -5.620
  379    HD3  LYS  47           3HD      LYS  47  24.987 -14.714  -6.194
  380    HE2  LYS  47           HE2      LYS  47  26.532 -15.267  -4.342
  381    HE3  LYS  47           HE3      LYS  47  25.399 -16.504  -3.770
  382    HZ1  LYS  47           3HZ      LYS  47  26.733 -16.498  -6.393
  383    HZ2  LYS  47           1HZ      LYS  47  27.140 -17.446  -5.113
  384    HZ3  LYS  47           2HZ      LYS  47  25.685 -17.645  -5.858
  385    H    SER  48           H        SER  48  20.758 -12.813  -5.236
  386    HA   SER  48           HA       SER  48  19.546 -10.949  -7.153
  387    HB2  SER  48           HB2      SER  48  19.350 -13.213  -8.269
  388    HB3  SER  48           HB3      SER  48  18.452 -13.772  -6.852
  389    HG   SER  48           HG       SER  48  17.115 -12.985  -8.567
  390    H    ARG  49           H        ARG  49  17.735  -9.937  -6.226
  391    HA   ARG  49           HA       ARG  49  17.260 -10.301  -3.373
  392    HB2  ARG  49           HB2      ARG  49  15.681  -8.813  -5.501
  393    HB3  ARG  49           HB3      ARG  49  15.450  -8.654  -3.748
  394    HG2  ARG  49           HG2      ARG  49  18.135  -8.076  -4.989
  395    HG3  ARG  49           HG3      ARG  49  16.861  -6.858  -5.065
  396    HD2  ARG  49           2HD      ARG  49  17.898  -8.100  -2.495
  397    HD3  ARG  49           3HD      ARG  49  18.397  -6.531  -3.180
  398    HE   ARG  49           HE       ARG  49  15.853  -7.163  -1.845
  399   HH11  ARG  49          1HH1      ARG  49  17.661  -4.865  -3.844
  400   HH12  ARG  49          2HH1      ARG  49  16.652  -3.511  -3.411
  401   HH21  ARG  49          1HH2      ARG  49  14.553  -5.371  -1.292
  402   HH22  ARG  49          2HH2      ARG  49  14.904  -3.797  -1.957
  403    H    GLY  50           H        GLY  50  16.338 -11.929  -6.189
  404    HA2  GLY  50           2HA      GLY  50  14.977 -13.797  -6.390
  405    HA3  GLY  50           3HA      GLY  50  14.280 -13.473  -4.788
  406    H    PHE  51           H        PHE  51  14.163 -10.526  -6.460
  407    HA   PHE  51           HA       PHE  51  11.720 -11.271  -7.968
  408    HB2  PHE  51           HB2      PHE  51  10.495  -9.396  -7.122
  409    HB3  PHE  51           HB3      PHE  51  11.009 -10.411  -5.774
  410    HD1  PHE  51           HD2      PHE  51  12.796  -9.625  -4.232
  411    HD2  PHE  51           HD1      PHE  51  11.310  -7.156  -7.423
  412    HE1  PHE  51           HE2      PHE  51  13.755  -7.610  -3.130
  413    HE2  PHE  51           HE1      PHE  51  12.289  -5.163  -6.344
  414    HZ   PHE  51           HZ       PHE  51  13.550  -5.393  -4.211
  415    H    ALA  52           H        ALA  52  11.089  -9.563  -9.542
  416    HA   ALA  52           HA       ALA  52  13.264  -7.807 -10.461
  417    HB1  ALA  52           1HB      ALA  52  13.470  -8.993 -12.609
  418    HB2  ALA  52           HB2      ALA  52  13.871 -10.082 -11.262
  419    HB3  ALA  52           HB3      ALA  52  12.294 -10.203 -12.076
  420    H    PHE  53           H        PHE  53  12.533  -7.057 -12.853
  421    HA   PHE  53           HA       PHE  53   9.602  -6.784 -13.020
  422    HB2  PHE  53           HB2      PHE  53  11.523  -4.405 -13.012
  423    HB3  PHE  53           HB3      PHE  53   9.838  -4.308 -13.417
  424    HD1  PHE  53           HD2      PHE  53  12.276  -5.064 -10.746
  425    HD2  PHE  53           HD1      PHE  53   8.205  -4.078 -11.683
  426    HE1  PHE  53           HE2      PHE  53  11.825  -4.656  -8.334
  427    HE2  PHE  53           HE1      PHE  53   7.749  -3.650  -9.276
  428    HZ   PHE  53           HZ       PHE  53   9.564  -3.957  -7.598
  429    H    VAL  54           H        VAL  54   8.937  -5.924 -15.174
  430    HA   VAL  54           HA       VAL  54  10.985  -5.817 -17.260
  431    HB   VAL  54           HB       VAL  54  10.612  -8.243 -17.149
  432   HG11  VAL  54          1HG1      VAL  54   7.718  -7.753 -17.449
  433   HG12  VAL  54          HG21      VAL  54   8.619  -9.313 -17.461
  434   HG13  VAL  54          HG31      VAL  54   8.634  -8.311 -15.990
  435   HG21  VAL  54          HG32      VAL  54   9.911  -8.657 -19.441
  436   HG22  VAL  54          1HG2      VAL  54   8.935  -7.179 -19.473
  437   HG23  VAL  54          HG22      VAL  54  10.707  -7.068 -19.467
  438    H    THR  55           H        THR  55  10.329  -4.617 -19.002
  439    HA   THR  55           HA       THR  55   7.511  -3.630 -18.912
  440    HB   THR  55           HB       THR  55   9.938  -2.223 -20.065
  441    HG1  THR  55           1HG      THR  55   9.945  -2.296 -17.783
  442   HG21  THR  55          1HG2      THR  55   7.023  -1.408 -19.659
  443   HG22  THR  55          HG22      THR  55   8.332  -0.292 -20.121
  444   HG23  THR  55          HG32      THR  55   7.864  -1.609 -21.207
  445    H    PHE  56           H        PHE  56   6.250  -4.284 -20.471
  446    HA   PHE  56           HA       PHE  56   7.348  -5.358 -22.995
  447    HB2  PHE  56           HB2      PHE  56   4.614  -5.305 -21.689
  448    HB3  PHE  56           HB3      PHE  56   4.889  -5.898 -23.324
  449    HD1  PHE  56           HD2      PHE  56   6.312  -6.491 -19.848
  450    HD2  PHE  56           HD1      PHE  56   5.153  -8.096 -23.668
  451    HE1  PHE  56           HE2      PHE  56   6.882  -8.756 -19.066
  452    HE2  PHE  56           HE1      PHE  56   5.646 -10.376 -22.860
  453    HZ   PHE  56           HZ       PHE  56   6.468 -10.723 -20.535
  454    H    GLU  57           H        GLU  57   6.541  -4.638 -25.047
  455    HA   GLU  57           HA       GLU  57   6.063  -1.766 -25.160
  456    HB2  GLU  57           HB2      GLU  57   6.932  -3.880 -26.936
  457    HB3  GLU  57           HB3      GLU  57   5.599  -3.010 -27.689
  458    HG2  GLU  57           HG2      GLU  57   8.044  -1.641 -26.520
  459    HG3  GLU  57           HG3      GLU  57   7.836  -2.051 -28.231
  460    H    SER  58           H        SER  58   4.078  -4.701 -25.107
  461    HA   SER  58           HA       SER  58   1.740  -2.939 -25.655
  462    HB2  SER  58           HB2      SER  58   1.936  -4.682 -27.347
  463    HB3  SER  58           HB3      SER  58   2.118  -5.915 -26.084
  464    HG   SER  58           HG       SER  58  -0.166  -4.356 -26.688
  465    HA   PRO  59           HA       PRO  59   0.838  -3.651 -21.417
  466    HB2  PRO  59           HB2      PRO  59  -1.654  -2.634 -21.257
  467    HB3  PRO  59           HB3      PRO  59  -0.262  -1.564 -21.685
  468    HG2  PRO  59           HG2      PRO  59  -2.163  -3.015 -23.543
  469    HG3  PRO  59           HG3      PRO  59  -1.837  -1.252 -23.513
  470    HD2  PRO  59           2HD      PRO  59  -0.475  -2.884 -25.216
  471    HD3  PRO  59           3HD      PRO  59   0.410  -1.592 -24.335
  472    H    ALA  60           H        ALA  60  -0.435  -5.397 -24.011
  473    HA   ALA  60           HA       ALA  60  -2.020  -7.102 -22.159
  474    HB1  ALA  60           1HB      ALA  60  -2.418  -6.656 -25.140
  475    HB2  ALA  60           HB2      ALA  60  -3.359  -7.763 -24.108
  476    HB3  ALA  60           HB3      ALA  60  -3.434  -6.013 -23.826
  477    H    ASP  61           H        ASP  61   0.734  -6.922 -24.305
  478    HA   ASP  61           HA       ASP  61   1.064  -9.800 -24.535
  479    HB2  ASP  61           HB2      ASP  61   3.003  -7.438 -24.647
  480    HB3  ASP  61           HB3      ASP  61   3.507  -9.070 -24.822
  481    H    ALA  62           H        ALA  62   1.653  -7.279 -22.145
  482    HA   ALA  62           HA       ALA  62   3.245  -8.927 -20.374
  483    HB1  ALA  62           1HB      ALA  62   2.813  -7.051 -18.795
  484    HB2  ALA  62           HB2      ALA  62   3.412  -6.492 -20.382
  485    HB3  ALA  62           HB3      ALA  62   1.688  -6.333 -19.974
  486    H    LYS  63           H        LYS  63  -0.211  -8.330 -20.919
  487    HA   LYS  63           HA       LYS  63  -1.076  -9.572 -18.434
  488    HB2  LYS  63           HB2      LYS  63  -2.500  -9.068 -21.079
  489    HB3  LYS  63           HB3      LYS  63  -3.297  -9.616 -19.595
  490    HG2  LYS  63           HG2      LYS  63  -2.607  -7.569 -18.418
  491    HG3  LYS  63           HG3      LYS  63  -1.691  -7.047 -19.836
  492    HD2  LYS  63           2HD      LYS  63  -3.794  -5.824 -19.735
  493    HD3  LYS  63           3HD      LYS  63  -3.788  -6.869 -21.154
  494    HE2  LYS  63           HE2      LYS  63  -5.101  -8.578 -19.904
  495    HE3  LYS  63           HE3      LYS  63  -5.121  -7.510 -18.489
  496    HZ1  LYS  63           3HZ      LYS  63  -6.304  -5.890 -19.802
  497    HZ2  LYS  63           1HZ      LYS  63  -6.272  -6.876 -21.123
  498    HZ3  LYS  63           2HZ      LYS  63  -7.125  -7.313 -19.787
  499    H    ASP  64           H        ASP  64  -0.412 -10.610 -21.776
  500    HA   ASP  64           HA       ASP  64  -1.513 -13.243 -21.461
  501    HB2  ASP  64           HB2      ASP  64  -1.010 -11.929 -23.592
  502    HB3  ASP  64           HB3      ASP  64   0.699 -12.266 -23.310
  503    H    ALA  65           H        ALA  65   1.562 -11.749 -20.702
  504    HA   ALA  65           HA       ALA  65   2.836 -14.301 -20.010
  505    HB1  ALA  65           1HB      ALA  65   4.117 -12.239 -20.731
  506    HB2  ALA  65           HB2      ALA  65   3.640 -11.480 -19.201
  507    HB3  ALA  65           HB3      ALA  65   4.653 -12.951 -19.191
  508    H    ALA  66           H        ALA  66   1.283 -11.546 -18.272
  509    HA   ALA  66           HA       ALA  66   1.908 -12.609 -15.690
  510    HB1  ALA  66           1HB      ALA  66   0.449 -10.770 -14.899
  511    HB2  ALA  66           HB2      ALA  66   1.528 -10.194 -16.194
  512    HB3  ALA  66           HB3      ALA  66  -0.167 -10.539 -16.555
  513    H    ARG  67           H        ARG  67  -0.618 -13.398 -17.953
  514    HA   ARG  67           HA       ARG  67  -2.128 -14.809 -15.840
  515    HB2  ARG  67           HB2      ARG  67  -2.674 -14.127 -18.740
  516    HB3  ARG  67           HB3      ARG  67  -3.559 -15.415 -17.918
  517    HG2  ARG  67           HG2      ARG  67  -4.932 -13.578 -17.559
  518    HG3  ARG  67           HG3      ARG  67  -4.026 -13.746 -16.041
  519    HD2  ARG  67           2HD      ARG  67  -2.487 -11.934 -16.813
  520    HD3  ARG  67           3HD      ARG  67  -3.509 -11.729 -18.251
  521    HE   ARG  67           HE       ARG  67  -4.082 -10.864 -15.527
  522   HH11  ARG  67          1HH1      ARG  67  -5.482 -11.647 -18.682
  523   HH12  ARG  67          2HH1      ARG  67  -6.931 -10.709 -18.396
  524   HH21  ARG  67          1HH2      ARG  67  -5.987  -9.659 -15.187
  525   HH22  ARG  67          2HH2      ARG  67  -7.213  -9.594 -16.432
  526    H    ASP  68           H        ASP  68   0.727 -15.592 -17.269
  527    HA   ASP  68           HA       ASP  68  -0.109 -18.405 -17.842
  528    HB2  ASP  68           HB2      ASP  68   1.428 -16.311 -19.317
  529    HB3  ASP  68           HB3      ASP  68   2.226 -17.836 -19.185
  530    H    MET  69           H        MET  69   2.569 -16.197 -17.273
  531    HA   MET  69           HA       MET  69   4.376 -18.136 -16.152
  532    HB2  MET  69           HB2      MET  69   4.198 -15.169 -16.732
  533    HB3  MET  69           HB3      MET  69   5.428 -15.699 -15.656
  534    HG2  MET  69           HG2      MET  69   5.342 -17.424 -18.017
  535    HG3  MET  69           HG3      MET  69   5.445 -15.708 -18.462
  536    HE1  MET  69           HE3      MET  69   7.139 -18.644 -16.459
  537    HE2  MET  69           HE1      MET  69   8.399 -17.748 -15.567
  538    HE3  MET  69           HE2      MET  69   6.669 -17.396 -15.282
  539    H    ASN  70           H        ASN  70   1.785 -16.212 -14.817
  540    HA   ASN  70           HA       ASN  70   2.977 -15.873 -12.199
  541    HB2  ASN  70           HB2      ASN  70   1.212 -14.391 -13.104
  542    HB3  ASN  70           HB3      ASN  70   0.080 -15.749 -13.128
  543   HD21  ASN  70          2HD2      ASN  70  -1.222 -14.260 -11.748
  544   HD22  ASN  70          1HD2      ASN  70  -0.906 -14.243 -10.021
  545    H    GLY  71           H        GLY  71   3.237 -17.366 -10.696
  546    HA2  GLY  71           2HA      GLY  71   2.547 -19.047  -9.214
  547    HA3  GLY  71           3HA      GLY  71   1.252 -19.512 -10.330
  548    H    LYS  72           H        LYS  72   3.752 -19.264 -12.433
  549    HA   LYS  72           HA       LYS  72   4.505 -22.078 -12.382
  550    HB2  LYS  72           HB2      LYS  72   5.431 -19.760 -14.077
  551    HB3  LYS  72           HB3      LYS  72   5.583 -21.476 -14.431
  552    HG2  LYS  72           HG2      LYS  72   2.949 -19.955 -14.294
  553    HG3  LYS  72           HG3      LYS  72   3.743 -20.571 -15.759
  554    HD2  LYS  72           2HD      LYS  72   3.573 -22.887 -14.851
  555    HD3  LYS  72           3HD      LYS  72   2.624 -22.264 -13.491
  556    HE2  LYS  72           HE2      LYS  72   1.912 -21.898 -16.433
  557    HE3  LYS  72           HE3      LYS  72   1.242 -23.154 -15.382
  558    HZ1  LYS  72           3HZ      LYS  72   0.387 -21.380 -13.958
  559    HZ2  LYS  72           1HZ      LYS  72   0.961 -20.253 -15.015
  560    HZ3  LYS  72           2HZ      LYS  72  -0.226 -21.292 -15.482
  561    H    SER  73           H        SER  73   7.090 -21.476 -13.478
  562    HA   SER  73           HA       SER  73   8.642 -20.555 -11.107
  563    HB2  SER  73           HB2      SER  73   8.109 -22.973 -10.940
  564    HB3  SER  73           HB3      SER  73   8.864 -23.248 -12.521
  565    HG   SER  73           HG       SER  73  10.294 -23.676 -10.785
  566    H    LEU  74           H        LEU  74  10.806 -20.240 -11.426
  567    HA   LEU  74           HA       LEU  74  11.670 -19.951 -14.257
  568    HB2  LEU  74           HB2      LEU  74  11.083 -17.742 -12.586
  569    HB3  LEU  74           HB3      LEU  74  12.754 -17.997 -12.319
  570    HG   LEU  74           HG       LEU  74  12.615 -16.444 -14.084
  571   HD11  LEU  74          1HD1      LEU  74  14.338 -18.163 -14.494
  572   HD12  LEU  74          2HD1      LEU  74  13.166 -19.078 -15.495
  573   HD13  LEU  74          3HD1      LEU  74  13.693 -17.457 -15.984
  574   HD21  LEU  74          3HD2      LEU  74  10.807 -18.438 -15.527
  575   HD22  LEU  74          1HD2      LEU  74  10.255 -16.954 -14.696
  576   HD23  LEU  74          2HD2      LEU  74  11.295 -16.838 -16.132
  577    H    ASP  75           H        ASP  75  13.538 -20.942 -14.578
  578    HA   ASP  75           HA       ASP  75  15.431 -22.082 -14.252
  579    HB2  ASP  75           HB2      ASP  75  15.937 -19.654 -13.150
  580    HB3  ASP  75           HB3      ASP  75  15.805 -20.495 -11.689
  581    H    GLY  76           H        GLY  76  13.182 -22.076 -11.629
  582    HA2  GLY  76           2HA      GLY  76  13.058 -24.688 -11.207
  583    HA3  GLY  76           3HA      GLY  76  14.526 -24.300 -10.286
  584    H    LYS  77           H        LYS  77  12.793 -21.493 -10.034
  585    HA   LYS  77           HA       LYS  77  11.632 -22.353  -7.433
  586    HB2  LYS  77           HB2      LYS  77  12.888 -19.676  -8.091
  587    HB3  LYS  77           HB3      LYS  77  12.334 -20.231  -6.508
  588    HG2  LYS  77           HG2      LYS  77  14.618 -21.424  -8.131
  589    HG3  LYS  77           HG3      LYS  77  14.791 -20.383  -6.711
  590    HD2  LYS  77           2HD      LYS  77  13.850 -22.053  -5.253
  591    HD3  LYS  77           3HD      LYS  77  13.355 -23.068  -6.616
  592    HE2  LYS  77           HE2      LYS  77  15.378 -23.979  -5.626
  593    HE3  LYS  77           HE3      LYS  77  15.687 -23.421  -7.274
  594    HZ1  LYS  77           3HZ      LYS  77  17.415 -22.748  -5.737
  595    HZ2  LYS  77           1HZ      LYS  77  16.660 -21.431  -6.364
  596    HZ3  LYS  77           2HZ      LYS  77  16.336 -21.918  -4.822
  597    H    ALA  78           H        ALA  78   9.601 -21.706  -6.947
  598    HA   ALA  78           HA       ALA  78   7.968 -20.965  -9.190
  599    HB1  ALA  78           1HB      ALA  78   7.219 -22.533  -7.471
  600    HB2  ALA  78           HB2      ALA  78   7.263 -21.240  -6.249
  601    HB3  ALA  78           HB3      ALA  78   6.110 -21.151  -7.602
  602    H    ILE  79           H        ILE  79   6.886 -19.090  -9.672
  603    HA   ILE  79           HA       ILE  79   7.706 -16.691  -8.101
  604    HB   ILE  79           HB       ILE  79   8.008 -15.487 -10.130
  605   HG12  ILE  79          HG21      ILE  79   7.168 -17.988 -11.662
  606   HG13  ILE  79          HG31      ILE  79   6.161 -16.545 -11.437
  607   HG21  ILE  79          1HG2      ILE  79   9.912 -16.609 -11.074
  608   HG22  ILE  79          HG22      ILE  79   9.867 -16.959  -9.330
  609   HG23  ILE  79          HG32      ILE  79   9.336 -18.193 -10.502
  610   HD11  ILE  79          3HD1      ILE  79   7.962 -15.175 -12.519
  611   HD12  ILE  79          1HD1      ILE  79   8.807 -16.694 -12.918
  612   HD13  ILE  79          2HD1      ILE  79   7.195 -16.366 -13.591
  613    H    LYS  80           H        LYS  80   6.545 -14.730  -8.761
  614    HA   LYS  80           HA       LYS  80   3.639 -15.120  -9.273
  615    HB2  LYS  80           HB2      LYS  80   4.287 -14.307  -6.934
  616    HB3  LYS  80           HB3      LYS  80   5.018 -12.896  -7.710
  617    HG2  LYS  80           HG2      LYS  80   2.740 -12.462  -8.821
  618    HG3  LYS  80           HG3      LYS  80   2.085 -13.707  -7.743
  619    HD2  LYS  80           2HD      LYS  80   2.988 -12.351  -5.795
  620    HD3  LYS  80           3HD      LYS  80   3.447 -11.088  -6.971
  621    HE2  LYS  80           HE2      LYS  80   1.087 -10.938  -7.722
  622    HE3  LYS  80           HE3      LYS  80   0.645 -12.168  -6.526
  623    HZ1  LYS  80           3HZ      LYS  80   1.492 -10.653  -4.818
  624    HZ2  LYS  80           1HZ      LYS  80   1.732  -9.491  -5.951
  625    HZ3  LYS  80           2HZ      LYS  80   0.211 -10.038  -5.635
  626    H    VAL  81           H        VAL  81   2.777 -13.719 -10.872
  627    HA   VAL  81           HA       VAL  81   4.570 -11.579 -11.874
  628    HB   VAL  81           HB       VAL  81   3.090 -13.525 -13.686
  629   HG11  VAL  81          1HG1      VAL  81   3.147 -11.193 -14.545
  630   HG12  VAL  81          HG21      VAL  81   4.906 -11.141 -14.274
  631   HG13  VAL  81          HG31      VAL  81   4.209 -12.248 -15.486
  632   HG21  VAL  81          HG32      VAL  81   6.049 -13.077 -13.110
  633   HG22  VAL  81          1HG2      VAL  81   5.114 -14.552 -12.777
  634   HG23  VAL  81          HG22      VAL  81   5.418 -14.050 -14.459
  635    H    GLU  82           H        GLU  82   3.569  -9.689 -12.114
  636    HA   GLU  82           HA       GLU  82   0.685  -9.466 -12.516
  637    HB2  GLU  82           HB2      GLU  82   0.943 -10.067 -10.073
  638    HB3  GLU  82           HB3      GLU  82   1.945  -8.631  -9.860
  639    HG2  GLU  82           HG2      GLU  82  -0.397  -8.275  -9.133
  640    HG3  GLU  82           HG3      GLU  82   0.072  -7.169 -10.419
  641    H    GLN  83           H        GLN  83   0.066  -7.070 -12.654
  642    HA   GLN  83           HA       GLN  83   2.088  -5.488 -13.896
  643    HB2  GLN  83           HB2      GLN  83  -0.202  -5.003 -14.382
  644    HB3  GLN  83           HB3      GLN  83  -0.622  -4.923 -12.668
  645    HG2  GLN  83           HG2      GLN  83  -0.628  -2.704 -13.564
  646    HG3  GLN  83           HG3      GLN  83   0.684  -2.853 -12.400
  647   HE21  GLN  83          HE22      GLN  83   2.152  -1.416 -13.044
  648   HE22  GLN  83          HE12      GLN  83   2.809  -1.276 -14.657
  649    H    ALA  84           H        ALA  84   3.487  -3.968 -13.076
  650    HA   ALA  84           HA       ALA  84   4.222  -4.400 -10.303
  651    HB1  ALA  84           1HB      ALA  84   5.879  -4.219 -12.132
  652    HB2  ALA  84           HB2      ALA  84   5.356  -2.535 -12.409
  653    HB3  ALA  84           HB3      ALA  84   6.137  -2.977 -10.880
  654    H    THR  85           H        THR  85   4.614  -2.794  -8.731
  655    HA   THR  85           HA       THR  85   3.239  -0.180  -9.148
  656    HB   THR  85           HB       THR  85   2.881  -0.103  -6.728
  657    HG1  THR  85           1HG      THR  85   3.136  -2.019  -5.541
  658   HG21  THR  85          1HG2      THR  85   1.082  -0.921  -8.269
  659   HG22  THR  85          HG22      THR  85   1.656  -2.584  -8.037
  660   HG23  THR  85          HG32      THR  85   0.968  -1.678  -6.669
  661    H    LYS  86           H        LYS  86   4.159   1.440  -7.497
  662    HA   LYS  86           HA       LYS  86   6.954   1.720  -8.141
  663    HB2  LYS  86           HB2      LYS  86   5.042   3.335  -6.398
  664    HB3  LYS  86           HB3      LYS  86   6.665   3.859  -6.894
  665    HG2  LYS  86           HG2      LYS  86   5.967   3.482  -9.302
  666    HG3  LYS  86           HG3      LYS  86   4.321   3.173  -8.727
  667    HD2  LYS  86           2HD      LYS  86   4.352   5.477  -7.669
  668    HD3  LYS  86           3HD      LYS  86   5.888   5.765  -8.526
  669    HE2  LYS  86           HE2      LYS  86   4.766   5.194 -10.676
  670    HE3  LYS  86           HE3      LYS  86   3.254   4.922  -9.810
  671    HZ1  LYS  86           3HZ      LYS  86   3.332   7.131 -10.758
  672    HZ2  LYS  86           1HZ      LYS  86   3.292   7.227  -9.120
  673    HZ3  LYS  86           2HZ      LYS  86   4.701   7.487  -9.924
  674    HA   PRO  87           HA       PRO  87   8.889  -0.188  -4.786
  675    HB2  PRO  87           HB2      PRO  87  10.993   1.459  -4.109
  676    HB3  PRO  87           HB3      PRO  87  10.917   0.528  -5.628
  677    HG2  PRO  87           HG2      PRO  87  10.110   3.413  -5.208
  678    HG3  PRO  87           HG3      PRO  87  11.194   2.747  -6.472
  679    HD2  PRO  87           2HD      PRO  87   8.588   3.218  -7.003
  680    HD3  PRO  87           3HD      PRO  87   9.360   1.723  -7.611
  681    H    SER  88           H        SER  88   9.089  -0.243  -2.489
  682    HA   SER  88           HA       SER  88   7.028   1.346  -1.228
  683    HB2  SER  88           HB2      SER  88   7.378  -0.144   0.669
  684    HB3  SER  88           HB3      SER  88   7.347  -1.102  -0.827
  685    HG   SER  88           HG       SER  88   9.097  -1.672   0.532
  686    H    PHE  89           H        PHE  89  10.366   1.826  -1.708
  687    HA   PHE  89           HA       PHE  89  10.712   3.390   0.755
  688    HB2  PHE  89           HB2      PHE  89  12.951   3.819  -0.084
  689    HB3  PHE  89           HB3      PHE  89  12.586   2.095   0.002
  690    HD1  PHE  89           HD2      PHE  89  12.497   4.939  -2.456
  691    HD2  PHE  89           HD1      PHE  89  13.188   0.737  -1.833
  692    HE1  PHE  89           HE2      PHE  89  13.370   4.726  -4.768
  693    HE2  PHE  89           HE1      PHE  89  14.231   0.572  -4.053
  694    HZ   PHE  89           HZ       PHE  89  14.278   2.556  -5.555
  695    H    GLU  90           H        GLU  90   8.928   3.933  -1.874
  696    HA   GLU  90           HA       GLU  90   9.518   6.849  -1.914
  697    HB2  GLU  90           HB2      GLU  90  10.448   5.427  -3.883
  698    HB3  GLU  90           HB3      GLU  90   8.754   5.267  -4.386
  699    HG2  GLU  90           HG2      GLU  90   8.586   7.758  -4.460
  700    HG3  GLU  90           HG3      GLU  90  10.264   7.872  -3.899
  701    H    SER  91           H        SER  91   7.644   8.070  -2.952
  702    HA   SER  91           HA       SER  91   5.026   6.817  -2.399
  703    HB2  SER  91           HB2      SER  91   5.938   7.806  -0.266
  704    HB3  SER  91           HB3      SER  91   5.982   9.382  -1.077
  705    HG   SER  91           HG       SER  91   3.713   7.759  -0.548
  706    H    GLY  92           H        GLY  92   3.218   8.328  -3.013
  707    HA2  GLY  92           2HA      GLY  92   3.674   9.378  -5.650
  708    HA3  GLY  92           3HA      GLY  92   2.176   9.485  -4.704
  709    H    ARG  93           H        ARG  93   4.161  10.710  -2.557
  710    HA   ARG  93           HA       ARG  93   4.437  12.754  -1.696
  711    HB2  ARG  93           HB2      ARG  93   6.083  14.135  -2.830
  712    HB3  ARG  93           HB3      ARG  93   6.495  12.428  -2.801
  713    HG2  ARG  93           HG2      ARG  93   7.140  13.314  -4.906
  714    HG3  ARG  93           HG3      ARG  93   5.777  12.226  -5.189
  715    HD2  ARG  93           2HD      ARG  93   4.270  14.146  -5.450
  716    HD3  ARG  93           3HD      ARG  93   5.550  15.256  -4.933
  717    HE   ARG  93           HE       ARG  93   6.525  15.143  -7.035
  718   HH11  ARG  93          1HH1      ARG  93   3.999  12.681  -6.790
  719   HH12  ARG  93          2HH1      ARG  93   4.019  12.335  -8.508
  720   HH21  ARG  93          1HH2      ARG  93   6.526  14.666  -9.253
  721   HH22  ARG  93          2HH2      ARG  93   5.442  13.456  -9.895
  722    H    ARG  94           H        ARG  94   1.850  12.501  -3.080
  723    HA   ARG  94           HA       ARG  94   1.281  15.405  -3.261
  724    HB2  ARG  94           HB2      ARG  94  -0.024  15.137  -5.265
  725    HB3  ARG  94           HB3      ARG  94   1.598  14.484  -5.564
  726    HG2  ARG  94           HG2      ARG  94   0.683  12.178  -5.088
  727    HG3  ARG  94           HG3      ARG  94  -0.930  12.900  -4.938
  728    HD2  ARG  94           2HD      ARG  94  -0.676  13.816  -7.264
  729    HD3  ARG  94           3HD      ARG  94   0.855  12.941  -7.409
  730    HE   ARG  94           HE       ARG  94  -1.852  11.848  -7.517
  731   HH11  ARG  94          1HH1      ARG  94   1.561  11.050  -6.980
  732   HH12  ARG  94          2HH1      ARG  94   1.330   9.361  -7.388
  733   HH21  ARG  94          1HH2      ARG  94  -2.102   9.648  -7.999
  734   HH22  ARG  94          2HH2      ARG  94  -0.730   8.568  -7.894
  735    H    GLY  95           H        GLY  95  -1.046  15.885  -3.094
  736    HA2  GLY  95           2HA      GLY  95  -3.091  15.713  -2.050
  737    HA3  GLY  95           3HA      GLY  95  -2.941  13.952  -2.147
  738    H5'    A  96           H5'        A  96   0.552 -12.660  -4.141
  739   H5''    A  96          H5''        A  96   0.306 -14.241  -3.399
  740    H4'    A  96           H4'        A  96  -1.456 -12.904  -5.525
  741    H3'    A  96           H3'        A  96  -1.393 -12.889  -2.621
  742    H2'    A  96           H2'        A  96  -3.090 -14.367  -2.019
  743   HO2'    A  96          HO2'        A  96  -4.636 -13.208  -3.357
  744    H1'    A  96           H1'        A  96  -3.132 -16.169  -4.036
  745    H8     A  96           H8         A  96   0.185 -16.509  -4.469
  746    H61    A  96           H61        A  96   1.299 -18.143   1.416
  747    H62    A  96           H62        A  96   1.944 -18.141  -0.219
  748    H2     A  96           H2         A  96  -2.709 -16.268   1.250
  749   HO5'    A  96          H5T         A  96   1.814 -14.324  -5.119
  750    H5'    U  97           H5'        U  97  -2.106 -11.232  -1.171
  751   H5''    U  97          H5''        U  97  -1.968  -9.466  -1.180
  752    H4'    U  97           H4'        U  97   0.397  -9.558  -0.760
  753    H3'    U  97           H3'        U  97   0.444 -12.125  -1.822
  754    H2'    U  97           H2'        U  97  -0.157 -13.529  -0.103
  755   HO2'    U  97          HO2'        U  97   2.170 -12.360   0.983
  756    H1'    U  97           H1'        U  97   0.006 -11.928   2.255
  757    H3     U  97           H3         U  97  -4.258 -12.500   3.588
  758    H5     U  97           H5         U  97  -4.255 -13.871  -0.384
  759    H6     U  97           H6         U  97  -1.965 -13.055  -0.599
  760    H5'    C  98           H5'        C  98   4.504 -10.898   0.220
  761   H5''    C  98          H5''        C  98   4.953  -9.337  -0.487
  762    H4'    C  98           H4'        C  98   6.946 -10.443   0.215
  763    H3'    C  98           H3'        C  98   6.753  -9.455  -2.325
  764    H2'    C  98           H2'        C  98   5.900 -11.478  -3.301
  765   HO2'    C  98          HO2'        C  98   8.743 -11.575  -3.496
  766    H1'    C  98           H1'        C  98   7.958 -13.151  -1.900
  767    H41    C  98           H41        C  98   3.816 -17.439  -4.131
  768    H42    C  98           H42        C  98   2.513 -16.728  -3.195
  769    H5     C  98           H5         C  98   2.795 -14.668  -1.897
  770    H6     C  98           H6         C  98   4.404 -12.955  -1.236
  771    H5'    A  99           H5'        A  99   9.788  -6.189  -1.157
  772   H5''    A  99          H5''        A  99   8.118  -6.356  -1.752
  773    H4'    A  99           H4'        A  99  10.558  -6.121  -3.564
  774    H3'    A  99           H3'        A  99   9.489  -4.021  -2.014
  775    H2'    A  99           H2'        A  99   7.392  -4.010  -3.191
  776   HO2'    A  99          HO2'        A  99   8.894  -2.040  -3.752
  777    H1'    A  99           H1'        A  99   9.066  -4.635  -5.634
  778    H8     A  99           H8         A  99   7.358  -3.548  -7.197
  779    H61    A  99           H61        A  99   1.892  -6.508  -7.015
  780    H62    A  99           H62        A  99   2.849  -5.326  -7.889
  781    H2     A  99           H2         A  99   4.346  -7.895  -3.584
  782    H5'    A 100           H5'        A 100  12.734  -3.920  -4.906
  783   H5''    A 100          H5''        A 100  14.019  -3.175  -3.917
  784    H4'    A 100           H4'        A 100  14.884  -3.461  -6.108
  785    H3'    A 100           H3'        A 100  14.940  -1.012  -5.004
  786    H2'    A 100           H2'        A 100  12.773  -0.433  -5.806
  787   HO2'    A 100          HO2'        A 100  14.669   0.562  -7.708
  788    H1'    A 100           H1'        A 100  13.668  -1.398  -8.540
  789    H8     A 100           H8         A 100  10.521  -1.546  -6.210
  790    H61    A 100           H61        A 100   7.460   0.045 -11.387
  791    H62    A 100           H62        A 100   7.284  -0.345  -9.685
  792    H2     A 100           H2         A 100  11.770  -0.324 -12.370
  793    H5'    A 101           H5'        A 101  16.407   0.222  -4.765
  794   H5''    A 101          H5''        A 101  18.182   0.225  -5.052
  795    H4'    A 101           H4'        A 101  18.135  -1.171  -2.836
  796    H3'    A 101           H3'        A 101  15.465  -0.299  -2.821
  797   HO3'    A 101          H3T         A 101  17.090  -0.973  -0.585
  798    H2'    A 101           H2'        A 101  15.473   1.761  -1.704
  799   HO2'    A 101          HO2'        A 101  15.966   0.657   0.270
  800    H1'    A 101           H1'        A 101  18.100   2.492  -1.489
  801    H8     A 101           H8         A 101  17.159   1.862  -5.188
  802    H61    A 101           H61        A 101  15.306   7.779  -5.035
  803    H62    A 101           H62        A 101  15.687   6.424  -6.081
  804    H2     A 101           H2         A 101  16.035   6.460  -0.860
  Start of MODEL   13
    1    H1   MET   1           H1       MET   1   0.986   6.073  -0.622
    2    H2   MET   1           H2       MET   1  -0.077   4.980  -0.007
    3    H3   MET   1           H3       MET   1  -0.526   5.936  -1.268
    4    HA   MET   1           HA       MET   1   1.075   4.911  -2.708
    5    HB2  MET   1           HB2      MET   1   2.647   4.389  -0.828
    6    HB3  MET   1           HB3      MET   1   1.602   3.037  -0.365
    7    HG2  MET   1           HG2      MET   1   2.862   3.385  -3.113
    8    HG3  MET   1           HG3      MET   1   3.577   2.441  -1.802
    9    HE1  MET   1           HE1      MET   1   3.029   1.349  -4.770
   10    HE2  MET   1           HE2      MET   1   3.845   0.443  -3.470
   11    HE3  MET   1           HE3      MET   1   2.495  -0.301  -4.354
   12    H    VAL   2           H        VAL   2  -0.606   4.504  -3.922
   13    HA   VAL   2           HA       VAL   2  -1.827   1.842  -3.710
   14    HB   VAL   2           HB       VAL   2  -3.520   3.336  -2.777
   15   HG11  VAL   2          1HG1      VAL   2  -3.087   5.048  -5.265
   16   HG12  VAL   2          HG21      VAL   2  -4.364   5.294  -4.061
   17   HG13  VAL   2          HG31      VAL   2  -2.660   5.497  -3.596
   18   HG21  VAL   2          HG32      VAL   2  -4.263   3.007  -5.689
   19   HG22  VAL   2          1HG2      VAL   2  -4.193   1.631  -4.556
   20   HG23  VAL   2          HG22      VAL   2  -5.337   2.975  -4.280
   21    H    GLU   3           H        GLU   3   0.360   3.442  -5.072
   22    HA   GLU   3           HA       GLU   3  -0.654   4.051  -7.709
   23    HB2  GLU   3           HB2      GLU   3   2.087   4.251  -6.384
   24    HB3  GLU   3           HB3      GLU   3   1.733   4.815  -8.029
   25    HG2  GLU   3           HG2      GLU   3  -0.027   6.296  -7.166
   26    HG3  GLU   3           HG3      GLU   3   0.339   5.780  -5.505
   27    H    ALA   4           H        ALA   4  -0.306   3.209  -9.564
   28    HA   ALA   4           HA       ALA   4   1.348   0.758  -9.812
   29    HB1  ALA   4           1HB      ALA   4  -1.456   1.238 -10.907
   30    HB2  ALA   4           HB2      ALA   4  -0.446  -0.199 -11.208
   31    HB3  ALA   4           HB3      ALA   4  -1.028   0.159  -9.562
   32    H    ASP   5           H        ASP   5   2.890   1.269 -11.117
   33    HA   ASP   5           HA       ASP   5   2.915   3.703 -12.642
   34    HB2  ASP   5           HB2      ASP   5   4.819   2.867 -11.377
   35    HB3  ASP   5           HB3      ASP   5   4.919   1.443 -12.400
   36    H    ARG   6           H        ARG   6   0.905   2.720 -13.831
   37    HA   ARG   6           HA       ARG   6  -0.043   2.384 -15.823
   38    HB2  ARG   6           HB2      ARG   6   2.750   3.030 -16.796
   39    HB3  ARG   6           HB3      ARG   6   1.326   2.983 -17.840
   40    HG2  ARG   6           HG2      ARG   6   0.317   4.835 -16.799
   41    HG3  ARG   6           HG3      ARG   6   1.337   4.715 -15.352
   42    HD2  ARG   6           2HD      ARG   6   2.410   5.394 -18.108
   43    HD3  ARG   6           3HD      ARG   6   1.978   6.597 -16.874
   44    HE   ARG   6           HE       ARG   6   3.694   4.801 -15.597
   45   HH11  ARG   6          1HH1      ARG   6   3.927   6.989 -18.372
   46   HH12  ARG   6          2HH1      ARG   6   5.636   7.272 -18.130
   47   HH21  ARG   6          1HH2      ARG   6   5.879   5.159 -15.335
   48   HH22  ARG   6          2HH2      ARG   6   6.763   6.179 -16.448
   49    HA   PRO   7           HA       PRO   7   0.092  -1.771 -17.209
   50    HB2  PRO   7           HB2      PRO   7  -0.270  -0.503 -19.924
   51    HB3  PRO   7           HB3      PRO   7  -1.156  -1.914 -19.244
   52    HG2  PRO   7           HG2      PRO   7  -2.299   0.500 -19.328
   53    HG3  PRO   7           HG3      PRO   7  -2.398  -0.437 -17.787
   54    HD2  PRO   7           2HD      PRO   7  -0.496   1.813 -18.514
   55    HD3  PRO   7           3HD      PRO   7  -1.398   1.542 -16.983
   56    H    GLY   8           H        GLY   8   1.586  -3.259 -18.073
   57    HA2  GLY   8           2HA      GLY   8   2.975  -3.875 -19.943
   58    HA3  GLY   8           3HA      GLY   8   3.591  -2.209 -20.010
   59    H    LYS   9           H        LYS   9   3.630  -2.311 -16.865
   60    HA   LYS   9           HA       LYS   9   6.306  -3.590 -16.816
   61    HB2  LYS   9           HB2      LYS   9   6.241  -1.234 -16.133
   62    HB3  LYS   9           HB3      LYS   9   5.066  -1.638 -14.855
   63    HG2  LYS   9           HG2      LYS   9   6.713  -3.241 -13.879
   64    HG3  LYS   9           HG3      LYS   9   7.878  -2.820 -15.140
   65    HD2  LYS   9           2HD      LYS   9   6.719  -0.843 -13.142
   66    HD3  LYS   9           3HD      LYS   9   8.265  -1.710 -12.944
   67    HE2  LYS   9           HE2      LYS   9   9.123  -0.708 -15.015
   68    HE3  LYS   9           HE3      LYS   9   7.579   0.114 -15.288
   69    HZ1  LYS   9           3HZ      LYS   9   9.284   1.517 -14.268
   70    HZ2  LYS   9           1HZ      LYS   9   7.929   1.409 -13.361
   71    HZ3  LYS   9           2HZ      LYS   9   9.274   0.559 -12.923
   72    H    LEU  10           H        LEU  10   6.655  -5.410 -15.720
   73    HA   LEU  10           HA       LEU  10   4.376  -6.478 -14.111
   74    HB2  LEU  10           HB2      LEU  10   6.527  -7.826 -15.746
   75    HB3  LEU  10           HB3      LEU  10   5.433  -8.728 -14.748
   76    HG   LEU  10           HG       LEU  10   4.656  -7.013 -17.150
   77   HD11  LEU  10          1HD1      LEU  10   4.406 -10.011 -16.626
   78   HD12  LEU  10          2HD1      LEU  10   4.201  -9.170 -18.181
   79   HD13  LEU  10          3HD1      LEU  10   5.815  -9.297 -17.425
   80   HD21  LEU  10          3HD2      LEU  10   2.922  -8.638 -15.252
   81   HD22  LEU  10          1HD2      LEU  10   2.826  -6.883 -15.577
   82   HD23  LEU  10          2HD2      LEU  10   2.402  -8.057 -16.846
   83    H    PHE  11           H        PHE  11   4.793  -7.548 -12.201
   84    HA   PHE  11           HA       PHE  11   7.484  -7.160 -10.990
   85    HB2  PHE  11           HB2      PHE  11   5.719  -6.175  -9.664
   86    HB3  PHE  11           HB3      PHE  11   4.714  -7.623  -9.835
   87    HD1  PHE  11           HD1      PHE  11   7.946  -6.409  -8.423
   88    HD2  PHE  11           HD2      PHE  11   4.863  -9.395  -8.288
   89    HE1  PHE  11           HE1      PHE  11   8.950  -7.351  -6.350
   90    HE2  PHE  11           HE2      PHE  11   5.881 -10.344  -6.219
   91    HZ   PHE  11           HZ       PHE  11   7.932  -9.316  -5.270
   92    H    ILE  12           H        ILE  12   8.717  -8.924 -10.653
   93    HA   ILE  12           HA       ILE  12   7.473 -11.575 -11.219
   94    HB   ILE  12           HB       ILE  12  10.350 -10.862 -11.802
   95   HG12  ILE  12          HG21      ILE  12   9.159  -9.248 -13.143
   96   HG13  ILE  12          HG31      ILE  12   9.849 -10.523 -14.141
   97   HG21  ILE  12          1HG2      ILE  12   8.400 -12.928 -12.887
   98   HG22  ILE  12          HG22      ILE  12  10.112 -12.775 -13.345
   99   HG23  ILE  12          HG32      ILE  12   9.663 -13.222 -11.674
  100   HD11  ILE  12          3HD1      ILE  12   6.922 -10.163 -13.413
  101   HD12  ILE  12          1HD1      ILE  12   7.691  -9.995 -15.007
  102   HD13  ILE  12          2HD1      ILE  12   7.564 -11.596 -14.255
  103    H    GLY  13           H        GLY  13   7.114 -11.746  -8.847
  104    HA2  GLY  13           2HA      GLY  13   9.582 -11.761  -7.192
  105    HA3  GLY  13           3HA      GLY  13   7.931 -11.847  -6.603
  106    H    GLY  14           H        GLY  14  10.404 -13.617  -6.154
  107    HA2  GLY  14           2HA      GLY  14  10.102 -15.762  -5.165
  108    HA3  GLY  14           3HA      GLY  14   8.851 -16.145  -6.360
  109    H    LEU  15           H        LEU  15  11.526 -14.536  -7.741
  110    HA   LEU  15           HA       LEU  15  12.192 -16.728  -9.441
  111    HB2  LEU  15           HB2      LEU  15  13.660 -14.135  -8.797
  112    HB3  LEU  15           HB3      LEU  15  14.018 -15.236 -10.161
  113    HG   LEU  15           HG       LEU  15  11.266 -14.023  -9.871
  114   HD11  LEU  15          1HD1      LEU  15  13.734 -12.868 -11.248
  115   HD12  LEU  15          2HD1      LEU  15  12.067 -12.285 -11.471
  116   HD13  LEU  15          3HD1      LEU  15  12.856 -12.146  -9.880
  117   HD21  LEU  15          3HD2      LEU  15  11.238 -14.525 -12.274
  118   HD22  LEU  15          1HD2      LEU  15  12.970 -14.899 -12.235
  119   HD23  LEU  15          2HD2      LEU  15  11.818 -15.978 -11.415
  120    H    ASN  16           H        ASN  16  14.399 -17.585  -9.783
  121    HA   ASN  16           HA       ASN  16  15.475 -18.722  -7.370
  122    HB2  ASN  16           HB2      ASN  16  15.159 -19.808  -9.615
  123    HB3  ASN  16           HB3      ASN  16  16.490 -18.797 -10.227
  124   HD21  ASN  16          2HD2      ASN  16  17.412 -20.901 -10.780
  125   HD22  ASN  16          1HD2      ASN  16  18.113 -21.906  -9.567
  126    H    THR  17           H        THR  17  17.834 -18.611  -6.863
  127    HA   THR  17           HA       THR  17  18.817 -15.871  -6.873
  128    HB   THR  17           HB       THR  17  20.706 -16.817  -5.613
  129    HG1  THR  17           1HG      THR  17  20.882 -18.823  -6.640
  130   HG21  THR  17          1HG2      THR  17  18.052 -18.037  -4.755
  131   HG22  THR  17          HG22      THR  17  19.442 -17.675  -3.700
  132   HG23  THR  17          HG32      THR  17  18.531 -16.346  -4.459
  133    H    GLU  18           H        GLU  18  18.706 -18.123  -9.241
  134    HA   GLU  18           HA       GLU  18  21.478 -17.732 -10.249
  135    HB2  GLU  18           HB2      GLU  18  19.451 -19.801 -11.119
  136    HB3  GLU  18           HB3      GLU  18  21.216 -19.853 -11.311
  137    HG2  GLU  18           HG2      GLU  18  19.691 -20.016  -8.663
  138    HG3  GLU  18           HG3      GLU  18  20.339 -21.385  -9.513
  139    H    THR  19           H        THR  19  18.363 -16.562 -10.630
  140    HA   THR  19           HA       THR  19  18.282 -16.496 -13.553
  141    HB   THR  19           HB       THR  19  16.542 -15.105 -11.481
  142    HG1  THR  19           1HG      THR  19  16.188 -17.549 -12.865
  143   HG21  THR  19          1HG2      THR  19  16.110 -15.726 -14.435
  144   HG22  THR  19          HG22      THR  19  14.871 -15.074 -13.333
  145   HG23  THR  19          HG32      THR  19  16.301 -14.107 -13.716
  146    H    ASN  20           H        ASN  20  18.598 -14.733 -14.861
  147    HA   ASN  20           HA       ASN  20  19.468 -12.190 -13.591
  148    HB2  ASN  20           HB2      ASN  20  20.916 -12.866 -16.049
  149    HB3  ASN  20           HB3      ASN  20  21.488 -12.106 -14.565
  150   HD21  ASN  20          2HD2      ASN  20  21.106 -15.050 -16.384
  151   HD22  ASN  20          1HD2      ASN  20  21.990 -16.096 -15.291
  152    H    GLU  21           H        GLU  21  20.047 -10.839 -15.865
  153    HA   GLU  21           HA       GLU  21  17.389 -10.085 -16.662
  154    HB2  GLU  21           HB2      GLU  21  20.061  -9.179 -17.819
  155    HB3  GLU  21           HB3      GLU  21  18.502  -8.338 -17.898
  156    HG2  GLU  21           HG2      GLU  21  19.419  -7.228 -16.080
  157    HG3  GLU  21           HG3      GLU  21  18.622  -8.573 -15.261
  158    H    LYS  22           H        LYS  22  20.026 -11.920 -18.180
  159    HA   LYS  22           HA       LYS  22  18.982 -11.863 -20.829
  160    HB2  LYS  22           HB2      LYS  22  21.310 -12.593 -19.756
  161    HB3  LYS  22           HB3      LYS  22  20.565 -14.194 -19.740
  162    HG2  LYS  22           HG2      LYS  22  21.056 -12.393 -22.147
  163    HG3  LYS  22           HG3      LYS  22  21.955 -13.856 -21.708
  164    HD2  LYS  22           2HD      LYS  22  19.788 -15.161 -21.983
  165    HD3  LYS  22           3HD      LYS  22  19.089 -13.686 -22.698
  166    HE2  LYS  22           HE2      LYS  22  21.572 -15.122 -23.711
  167    HE3  LYS  22           HE3      LYS  22  19.950 -15.259 -24.408
  168    HZ1  LYS  22           3HZ      LYS  22  20.006 -12.898 -24.850
  169    HZ2  LYS  22           1HZ      LYS  22  21.524 -12.777 -24.226
  170    HZ3  LYS  22           2HZ      LYS  22  21.264 -13.658 -25.589
  171    H    ALA  23           H        ALA  23  18.128 -13.750 -17.954
  172    HA   ALA  23           HA       ALA  23  16.881 -15.870 -19.599
  173    HB1  ALA  23           1HB      ALA  23  18.210 -16.495 -17.603
  174    HB2  ALA  23           HB2      ALA  23  17.145 -15.499 -16.578
  175    HB3  ALA  23           HB3      ALA  23  16.499 -16.935 -17.397
  176    H    LEU  24           H        LEU  24  16.188 -12.919 -17.980
  177    HA   LEU  24           HA       LEU  24  13.349 -13.453 -17.553
  178    HB2  LEU  24           HB2      LEU  24  15.483 -11.438 -16.895
  179    HB3  LEU  24           HB3      LEU  24  13.864 -10.789 -17.021
  180    HG   LEU  24           HG       LEU  24  14.634 -13.201 -15.317
  181   HD11  LEU  24          1HD1      LEU  24  15.730 -11.144 -14.498
  182   HD12  LEU  24          2HD1      LEU  24  14.157 -10.301 -14.499
  183   HD13  LEU  24          3HD1      LEU  24  14.440 -11.673 -13.396
  184   HD21  LEU  24          3HD2      LEU  24  12.279 -13.194 -15.917
  185   HD22  LEU  24          1HD2      LEU  24  12.418 -12.687 -14.219
  186   HD23  LEU  24          2HD2      LEU  24  12.127 -11.475 -15.494
  187    H    GLU  25           H        GLU  25  15.532 -11.840 -19.839
  188    HA   GLU  25           HA       GLU  25  13.301 -10.621 -21.248
  189    HB2  GLU  25           HB2      GLU  25  16.237 -11.093 -21.976
  190    HB3  GLU  25           HB3      GLU  25  15.080 -10.245 -23.043
  191    HG2  GLU  25           HG2      GLU  25  14.564  -8.706 -21.198
  192    HG3  GLU  25           HG3      GLU  25  15.844  -9.438 -20.223
  193    H    ALA  26           H        ALA  26  14.985 -13.617 -21.176
  194    HA   ALA  26           HA       ALA  26  14.210 -14.543 -23.839
  195    HB1  ALA  26           1HB      ALA  26  15.431 -15.915 -21.416
  196    HB2  ALA  26           HB2      ALA  26  15.323 -16.628 -23.042
  197    HB3  ALA  26           HB3      ALA  26  16.329 -15.180 -22.772
  198    H    VAL  27           H        VAL  27  12.845 -14.596 -20.613
  199    HA   VAL  27           HA       VAL  27  11.063 -16.861 -21.307
  200    HB   VAL  27           HB       VAL  27  12.552 -16.698 -19.305
  201   HG11  VAL  27          1HG1      VAL  27  10.380 -14.935 -18.209
  202   HG12  VAL  27          HG21      VAL  27  11.892 -15.470 -17.408
  203   HG13  VAL  27          HG31      VAL  27  11.973 -14.342 -18.786
  204   HG21  VAL  27          HG32      VAL  27   9.556 -17.093 -18.840
  205   HG22  VAL  27          1HG2      VAL  27  10.687 -18.331 -19.456
  206   HG23  VAL  27          HG22      VAL  27  10.863 -17.696 -17.788
  207    H    PHE  28           H        PHE  28  11.064 -13.427 -20.486
  208    HA   PHE  28           HA       PHE  28   8.099 -13.404 -20.726
  209    HB2  PHE  28           HB2      PHE  28  10.029 -11.281 -19.768
  210    HB3  PHE  28           HB3      PHE  28   8.298 -11.042 -20.017
  211    HD1  PHE  28           HD1      PHE  28   6.642 -12.456 -18.736
  212    HD2  PHE  28           HD2      PHE  28  10.821 -12.292 -17.744
  213    HE1  PHE  28           HE1      PHE  28   6.142 -13.377 -16.491
  214    HE2  PHE  28           HE2      PHE  28  10.331 -13.257 -15.527
  215    HZ   PHE  28           HZ       PHE  28   7.988 -13.767 -14.875
  216    H    GLY  29           H        GLY  29  10.861 -12.973 -22.669
  217    HA2  GLY  29           2HA      GLY  29   9.711 -10.960 -24.442
  218    HA3  GLY  29           3HA      GLY  29  11.136 -11.954 -24.773
  219    H    LYS  30           H        LYS  30   8.961 -14.152 -23.798
  220    HA   LYS  30           HA       LYS  30   8.387 -15.153 -26.457
  221    HB2  LYS  30           HB2      LYS  30   7.524 -15.959 -23.631
  222    HB3  LYS  30           HB3      LYS  30   7.289 -16.955 -25.088
  223    HG2  LYS  30           HG2      LYS  30   9.616 -17.233 -25.395
  224    HG3  LYS  30           HG3      LYS  30  10.036 -15.972 -24.239
  225    HD2  LYS  30           2HD      LYS  30  10.467 -18.204 -23.320
  226    HD3  LYS  30           3HD      LYS  30   9.330 -17.285 -22.349
  227    HE2  LYS  30           HE2      LYS  30   8.487 -19.406 -24.352
  228    HE3  LYS  30           HE3      LYS  30   8.795 -19.702 -22.626
  229    HZ1  LYS  30           3HZ      LYS  30   7.071 -18.126 -22.105
  230    HZ2  LYS  30           1HZ      LYS  30   6.734 -17.902 -23.701
  231    HZ3  LYS  30           2HZ      LYS  30   6.487 -19.369 -23.012
  232    H    TYR  31           H        TYR  31   6.832 -13.188 -24.127
  233    HA   TYR  31           HA       TYR  31   4.123 -13.669 -25.251
  234    HB2  TYR  31           HB2      TYR  31   5.085 -12.232 -22.762
  235    HB3  TYR  31           HB3      TYR  31   3.393 -12.511 -23.195
  236    HD1  TYR  31           HD2      TYR  31   2.763 -15.057 -23.569
  237    HD2  TYR  31           HD1      TYR  31   6.232 -13.716 -21.409
  238    HE1  TYR  31           HE2      TYR  31   2.929 -17.272 -22.461
  239    HE2  TYR  31           HE1      TYR  31   6.398 -15.927 -20.284
  240    HH   TYR  31           HH       TYR  31   5.560 -18.086 -20.187
  241    H    GLY  32           H        GLY  32   6.695 -11.273 -25.270
  242    HA2  GLY  32           2HA      GLY  32   5.372  -9.629 -27.179
  243    HA3  GLY  32           3HA      GLY  32   5.228  -8.890 -25.568
  244    H    ARG  33           H        ARG  33   6.528  -7.591 -27.628
  245    HA   ARG  33           HA       ARG  33   9.361  -8.053 -27.424
  246    HB2  ARG  33           HB2      ARG  33   7.858  -6.909 -29.292
  247    HB3  ARG  33           HB3      ARG  33   8.114  -5.443 -28.319
  248    HG2  ARG  33           HG2      ARG  33  10.575  -5.814 -28.461
  249    HG3  ARG  33           HG3      ARG  33  10.249  -7.321 -29.369
  250    HD2  ARG  33           2HD      ARG  33   9.106  -5.985 -31.122
  251    HD3  ARG  33           3HD      ARG  33   9.503  -4.501 -30.248
  252    HE   ARG  33           HE       ARG  33  11.342  -6.247 -31.773
  253   HH11  ARG  33          1HH1      ARG  33  10.996  -3.426 -29.641
  254   HH12  ARG  33          2HH1      ARG  33  12.576  -2.805 -30.036
  255   HH21  ARG  33          1HH2      ARG  33  13.397  -5.405 -32.242
  256   HH22  ARG  33          2HH2      ARG  33  13.926  -3.911 -31.500
  257    H    ILE  34           H        ILE  34  10.483  -7.662 -25.737
  258    HA   ILE  34           HA       ILE  34   9.585  -5.943 -23.570
  259    HB   ILE  34           HB       ILE  34  12.143  -7.492 -24.095
  260   HG12  ILE  34          HG21      ILE  34   9.662  -7.897 -22.367
  261   HG13  ILE  34          HG31      ILE  34  10.145  -8.853 -23.765
  262   HG21  ILE  34          1HG2      ILE  34  12.774  -7.056 -21.798
  263   HG22  ILE  34          HG22      ILE  34  12.609  -5.522 -22.650
  264   HG23  ILE  34          HG32      ILE  34  11.310  -6.061 -21.547
  265   HD11  ILE  34          3HD1      ILE  34  12.180  -9.601 -22.555
  266   HD12  ILE  34          1HD1      ILE  34  11.626  -8.730 -21.098
  267   HD13  ILE  34          2HD1      ILE  34  10.681 -10.082 -21.726
  268    H    VAL  35           H        VAL  35  10.210  -3.933 -23.007
  269    HA   VAL  35           HA       VAL  35  12.015  -2.496 -24.896
  270    HB   VAL  35           HB       VAL  35  10.650  -0.691 -23.144
  271   HG11  VAL  35          1HG1      VAL  35  10.358  -1.279 -26.108
  272   HG12  VAL  35          HG21      VAL  35   9.836   0.207 -25.277
  273   HG13  VAL  35          HG31      VAL  35  11.567  -0.205 -25.357
  274   HG21  VAL  35          HG32      VAL  35   8.746  -2.568 -24.604
  275   HG22  VAL  35          1HG2      VAL  35   8.854  -2.324 -22.843
  276   HG23  VAL  35          HG22      VAL  35   8.318  -1.003 -23.903
  277    H    GLU  36           H        GLU  36  11.550  -3.570 -21.606
  278    HA   GLU  36           HA       GLU  36  14.266  -2.780 -20.914
  279    HB2  GLU  36           HB2      GLU  36  13.052  -0.678 -20.466
  280    HB3  GLU  36           HB3      GLU  36  11.862  -1.551 -19.481
  281    HG2  GLU  36           HG2      GLU  36  13.565  -2.126 -17.841
  282    HG3  GLU  36           HG3      GLU  36  14.834  -1.445 -18.873
  283    H    VAL  37           H        VAL  37  15.042  -3.979 -19.125
  284    HA   VAL  37           HA       VAL  37  13.041  -5.557 -17.628
  285    HB   VAL  37           HB       VAL  37  15.206  -6.681 -19.345
  286   HG11  VAL  37          1HG1      VAL  37  14.580  -7.872 -16.614
  287   HG12  VAL  37          HG21      VAL  37  15.508  -8.655 -17.910
  288   HG13  VAL  37          HG31      VAL  37  16.157  -7.209 -17.122
  289   HG21  VAL  37          HG32      VAL  37  13.590  -8.588 -19.328
  290   HG22  VAL  37          1HG2      VAL  37  12.620  -7.738 -18.105
  291   HG23  VAL  37          HG22      VAL  37  12.789  -7.044 -19.733
  292    H    LEU  38           H        LEU  38  13.462  -5.891 -15.562
  293    HA   LEU  38           HA       LEU  38  15.971  -4.709 -14.377
  294    HB2  LEU  38           HB2      LEU  38  13.102  -4.609 -13.758
  295    HB3  LEU  38           HB3      LEU  38  14.124  -4.826 -12.355
  296    HG   LEU  38           HG       LEU  38  14.453  -2.558 -14.374
  297   HD11  LEU  38          1HD1      LEU  38  13.350  -2.598 -11.537
  298   HD12  LEU  38          2HD1      LEU  38  13.611  -1.140 -12.522
  299   HD13  LEU  38          3HD1      LEU  38  12.402  -2.341 -13.024
  300   HD21  LEU  38          3HD2      LEU  38  16.591  -3.117 -13.275
  301   HD22  LEU  38          1HD2      LEU  38  15.945  -1.580 -12.655
  302   HD23  LEU  38          2HD2      LEU  38  15.785  -3.062 -11.688
  303    H    LEU  39           H        LEU  39  16.892  -5.860 -12.688
  304    HA   LEU  39           HA       LEU  39  15.619  -8.315 -11.827
  305    HB2  LEU  39           HB2      LEU  39  16.865  -9.026 -13.802
  306    HB3  LEU  39           HB3      LEU  39  18.317  -8.194 -13.246
  307    HG   LEU  39           HG       LEU  39  18.174 -10.737 -13.101
  308   HD11  LEU  39          1HD1      LEU  39  18.975  -9.247 -10.581
  309   HD12  LEU  39          2HD1      LEU  39  19.602 -10.806 -11.158
  310   HD13  LEU  39          3HD1      LEU  39  19.930  -9.328 -12.092
  311   HD21  LEU  39          3HD2      LEU  39  15.970 -10.888 -12.000
  312   HD22  LEU  39          1HD2      LEU  39  17.253 -11.720 -11.102
  313   HD23  LEU  39          2HD2      LEU  39  16.661 -10.142 -10.531
  314    H    MET  40           H        MET  40  15.848  -8.255  -9.619
  315    HA   MET  40           HA       MET  40  17.675  -6.141  -8.661
  316    HB2  MET  40           HB2      MET  40  15.583  -7.548  -7.002
  317    HB3  MET  40           HB3      MET  40  16.342  -5.981  -6.728
  318    HG2  MET  40           HG2      MET  40  14.108  -6.763  -8.538
  319    HG3  MET  40           HG3      MET  40  14.268  -5.345  -7.512
  320    HE1  MET  40           HE3      MET  40  17.138  -4.258  -8.485
  321    HE2  MET  40           HE1      MET  40  16.732  -3.197  -9.863
  322    HE3  MET  40           HE2      MET  40  15.793  -3.105  -8.350
  323    H    LYS  41           H        LYS  41  19.386  -6.467  -7.328
  324    HA   LYS  41           HA       LYS  41  19.649  -9.056  -5.984
  325    HB2  LYS  41           HB2      LYS  41  22.215  -8.817  -6.851
  326    HB3  LYS  41           HB3      LYS  41  20.997  -9.898  -7.533
  327    HG2  LYS  41           HG2      LYS  41  20.451  -8.326  -9.281
  328    HG3  LYS  41           HG3      LYS  41  21.567  -7.108  -8.605
  329    HD2  LYS  41           2HD      LYS  41  23.458  -8.672  -8.976
  330    HD3  LYS  41           3HD      LYS  41  22.330  -9.872  -9.642
  331    HE2  LYS  41           HE2      LYS  41  21.685  -8.255 -11.422
  332    HE3  LYS  41           HE3      LYS  41  22.839  -7.082 -10.766
  333    HZ1  LYS  41           3HZ      LYS  41  24.594  -8.671 -11.208
  334    HZ2  LYS  41           1HZ      LYS  41  23.513  -9.740 -11.839
  335    HZ3  LYS  41           2HZ      LYS  41  23.780  -8.304 -12.591
  336    H    ASP  42           H        ASP  42  21.152  -9.121  -4.324
  337    HA   ASP  42           HA       ASP  42  21.226  -6.869  -2.645
  338    HB2  ASP  42           HB2      ASP  42  21.392  -9.338  -2.093
  339    HB3  ASP  42           HB3      ASP  42  23.079  -9.270  -2.612
  340    H    ARG  43           H        ARG  43  23.033  -5.619  -1.862
  341    HA   ARG  43           HA       ARG  43  24.781  -4.859  -4.116
  342    HB2  ARG  43           HB2      ARG  43  24.980  -2.739  -3.033
  343    HB3  ARG  43           HB3      ARG  43  23.271  -3.216  -3.114
  344    HG2  ARG  43           HG2      ARG  43  23.523  -4.079  -0.715
  345    HG3  ARG  43           HG3      ARG  43  25.097  -3.247  -0.681
  346    HD2  ARG  43           2HD      ARG  43  22.386  -1.997  -1.258
  347    HD3  ARG  43           3HD      ARG  43  23.304  -1.832   0.249
  348    HE   ARG  43           HE       ARG  43  25.111  -0.765  -1.256
  349   HH11  ARG  43          1HH1      ARG  43  21.637  -0.485  -1.872
  350   HH12  ARG  43          2HH1      ARG  43  21.804   1.012  -2.761
  351   HH21  ARG  43          1HH2      ARG  43  25.289   1.183  -2.395
  352   HH22  ARG  43          2HH2      ARG  43  23.858   1.964  -3.031
  353    H    GLU  44           H        GLU  44  25.065  -6.876  -1.526
  354    HA   GLU  44           HA       GLU  44  27.998  -6.330  -1.284
  355    HB2  GLU  44           HB2      GLU  44  26.077  -7.413   0.811
  356    HB3  GLU  44           HB3      GLU  44  27.832  -7.296   0.991
  357    HG2  GLU  44           HG2      GLU  44  27.692  -4.829   0.652
  358    HG3  GLU  44           HG3      GLU  44  25.930  -4.959   0.558
  359    H    THR  45           H        THR  45  25.551  -8.601  -2.196
  360    HA   THR  45           HA       THR  45  27.677 -10.693  -2.423
  361    HB   THR  45           HB       THR  45  26.096 -12.413  -1.943
  362    HG1  THR  45           1HG      THR  45  23.907 -11.872  -1.569
  363   HG21  THR  45          1HG2      THR  45  26.963 -11.118   0.025
  364   HG22  THR  45          HG22      THR  45  25.457 -10.154  -0.022
  365   HG23  THR  45          HG32      THR  45  25.383 -11.907   0.309
  366    H    ASN  46           H        ASN  46  25.314  -8.736  -3.965
  367    HA   ASN  46           HA       ASN  46  24.628  -8.590  -6.104
  368    HB2  ASN  46           HB2      ASN  46  27.210  -8.975  -6.212
  369    HB3  ASN  46           HB3      ASN  46  26.775 -10.502  -6.988
  370   HD21  ASN  46          2HD2      ASN  46  26.188  -6.956  -7.165
  371   HD22  ASN  46          1HD2      ASN  46  25.966  -6.907  -8.901
  372    H    LYS  47           H        LYS  47  23.978 -11.120  -4.295
  373    HA   LYS  47           HA       LYS  47  22.976 -13.011  -6.283
  374    HB2  LYS  47           HB2      LYS  47  22.635 -12.703  -3.276
  375    HB3  LYS  47           HB3      LYS  47  21.864 -14.004  -4.204
  376    HG2  LYS  47           HG2      LYS  47  24.807 -13.502  -4.523
  377    HG3  LYS  47           HG3      LYS  47  24.233 -14.369  -3.067
  378    HD2  LYS  47           2HD      LYS  47  23.130 -16.040  -4.516
  379    HD3  LYS  47           3HD      LYS  47  23.717 -15.188  -5.965
  380    HE2  LYS  47           HE2      LYS  47  25.512 -16.266  -3.753
  381    HE3  LYS  47           HE3      LYS  47  25.143 -17.157  -5.242
  382    HZ1  LYS  47           3HZ      LYS  47  26.117 -15.359  -6.492
  383    HZ2  LYS  47           1HZ      LYS  47  26.468 -14.531  -5.110
  384    HZ3  LYS  47           2HZ      LYS  47  27.202 -15.965  -5.420
  385    H    SER  48           H        SER  48  20.907 -13.240  -6.954
  386    HA   SER  48           HA       SER  48  19.269 -10.996  -7.233
  387    HB2  SER  48           HB2      SER  48  18.357 -13.893  -7.191
  388    HB3  SER  48           HB3      SER  48  17.545 -12.529  -7.980
  389    HG   SER  48           HG       SER  48  18.843 -13.696  -9.455
  390    H    ARG  49           H        ARG  49  17.647 -10.062  -6.119
  391    HA   ARG  49           HA       ARG  49  17.341 -10.528  -3.284
  392    HB2  ARG  49           HB2      ARG  49  15.708  -8.968  -5.316
  393    HB3  ARG  49           HB3      ARG  49  15.524  -8.816  -3.553
  394    HG2  ARG  49           HG2      ARG  49  18.150  -8.256  -4.943
  395    HG3  ARG  49           HG3      ARG  49  16.868  -7.030  -4.875
  396    HD2  ARG  49           2HD      ARG  49  18.034  -8.362  -2.419
  397    HD3  ARG  49           3HD      ARG  49  18.613  -6.829  -3.127
  398    HE   ARG  49           HE       ARG  49  16.138  -7.250  -1.611
  399   HH11  ARG  49          1HH1      ARG  49  17.937  -5.186  -3.835
  400   HH12  ARG  49          2HH1      ARG  49  17.026  -3.751  -3.456
  401   HH21  ARG  49          1HH2      ARG  49  14.959  -5.359  -1.100
  402   HH22  ARG  49          2HH2      ARG  49  15.347  -3.846  -1.888
  403    H    GLY  50           H        GLY  50  16.123 -12.095  -6.015
  404    HA2  GLY  50           2HA      GLY  50  14.681 -13.942  -6.026
  405    HA3  GLY  50           3HA      GLY  50  13.993 -13.440  -4.469
  406    H    PHE  51           H        PHE  51  14.146 -10.648  -6.397
  407    HA   PHE  51           HA       PHE  51  11.647 -11.255  -7.846
  408    HB2  PHE  51           HB2      PHE  51  10.453  -9.424  -6.998
  409    HB3  PHE  51           HB3      PHE  51  11.013 -10.355  -5.612
  410    HD1  PHE  51           HD2      PHE  51  13.064  -9.484  -4.313
  411    HD2  PHE  51           HD1      PHE  51  10.935  -7.129  -7.221
  412    HE1  PHE  51           HE2      PHE  51  14.014  -7.401  -3.336
  413    HE2  PHE  51           HE1      PHE  51  11.841  -5.061  -6.196
  414    HZ   PHE  51           HZ       PHE  51  13.406  -5.198  -4.304
  415    H    ALA  52           H        ALA  52  11.107  -9.611  -9.460
  416    HA   ALA  52           HA       ALA  52  13.258  -7.806 -10.313
  417    HB1  ALA  52           1HB      ALA  52  12.433 -10.246 -11.959
  418    HB2  ALA  52           HB2      ALA  52  13.569  -8.989 -12.464
  419    HB3  ALA  52           HB3      ALA  52  13.991 -10.054 -11.112
  420    H    PHE  53           H        PHE  53  12.573  -7.078 -12.726
  421    HA   PHE  53           HA       PHE  53   9.634  -6.878 -12.948
  422    HB2  PHE  53           HB2      PHE  53  11.457  -4.429 -12.912
  423    HB3  PHE  53           HB3      PHE  53   9.754  -4.431 -13.273
  424    HD1  PHE  53           HD2      PHE  53  12.295  -5.104 -10.659
  425    HD2  PHE  53           HD1      PHE  53   8.156  -4.311 -11.494
  426    HE1  PHE  53           HE2      PHE  53  11.870  -4.825  -8.238
  427    HE2  PHE  53           HE1      PHE  53   7.720  -4.037  -9.066
  428    HZ   PHE  53           HZ       PHE  53   9.573  -4.320  -7.432
  429    H    VAL  54           H        VAL  54   8.964  -5.984 -15.076
  430    HA   VAL  54           HA       VAL  54  11.022  -5.826 -17.154
  431    HB   VAL  54           HB       VAL  54  10.638  -8.263 -17.061
  432   HG11  VAL  54          1HG1      VAL  54   7.752  -7.739 -17.343
  433   HG12  VAL  54          HG21      VAL  54   8.633  -9.311 -17.419
  434   HG13  VAL  54          HG31      VAL  54   8.679  -8.351 -15.914
  435   HG21  VAL  54          HG32      VAL  54   8.978  -7.162 -19.387
  436   HG22  VAL  54          1HG2      VAL  54  10.747  -7.071 -19.368
  437   HG23  VAL  54          HG22      VAL  54   9.933  -8.660 -19.353
  438    H    THR  55           H        THR  55  10.348  -4.634 -18.918
  439    HA   THR  55           HA       THR  55   7.539  -3.645 -18.792
  440    HB   THR  55           HB       THR  55   9.949  -2.171 -19.892
  441    HG1  THR  55           1HG      THR  55   9.677  -0.931 -18.014
  442   HG21  THR  55          1HG2      THR  55   7.833  -1.547 -20.976
  443   HG22  THR  55          HG22      THR  55   7.037  -1.403 -19.400
  444   HG23  THR  55          HG32      THR  55   8.326  -0.260 -19.858
  445    H    PHE  56           H        PHE  56   6.296  -4.300 -20.376
  446    HA   PHE  56           HA       PHE  56   7.425  -5.374 -22.874
  447    HB2  PHE  56           HB2      PHE  56   4.651  -5.236 -21.654
  448    HB3  PHE  56           HB3      PHE  56   4.957  -5.852 -23.272
  449    HD1  PHE  56           HD1      PHE  56   6.384  -6.414 -19.791
  450    HD2  PHE  56           HD2      PHE  56   5.096  -8.074 -23.548
  451    HE1  PHE  56           HE1      PHE  56   6.890  -8.680 -18.961
  452    HE2  PHE  56           HE2      PHE  56   5.540 -10.339 -22.695
  453    HZ   PHE  56           HZ       PHE  56   6.361 -10.669 -20.380
  454    H    GLU  57           H        GLU  57   6.718  -4.672 -25.003
  455    HA   GLU  57           HA       GLU  57   6.279  -1.836 -25.277
  456    HB2  GLU  57           HB2      GLU  57   6.490  -4.237 -27.118
  457    HB3  GLU  57           HB3      GLU  57   5.887  -2.677 -27.694
  458    HG2  GLU  57           HG2      GLU  57   7.969  -1.595 -26.726
  459    HG3  GLU  57           HG3      GLU  57   8.608  -3.231 -26.467
  460    H    SER  58           H        SER  58   4.179  -4.693 -25.030
  461    HA   SER  58           HA       SER  58   1.866  -2.861 -25.540
  462    HB2  SER  58           HB2      SER  58   1.948  -4.542 -27.276
  463    HB3  SER  58           HB3      SER  58   2.199  -5.825 -26.071
  464    HG   SER  58           HG       SER  58   0.004  -5.627 -26.782
  465    HA   PRO  59           HA       PRO  59   1.009  -3.582 -21.322
  466    HB2  PRO  59           HB2      PRO  59  -1.578  -2.754 -21.172
  467    HB3  PRO  59           HB3      PRO  59  -0.258  -1.590 -21.565
  468    HG2  PRO  59           HG2      PRO  59  -2.045  -3.113 -23.480
  469    HG3  PRO  59           HG3      PRO  59  -1.804  -1.339 -23.405
  470    HD2  PRO  59           2HD      PRO  59  -0.340  -2.850 -25.123
  471    HD3  PRO  59           3HD      PRO  59   0.476  -1.557 -24.189
  472    H    ALA  60           H        ALA  60  -0.475  -5.286 -23.950
  473    HA   ALA  60           HA       ALA  60  -1.972  -7.029 -22.062
  474    HB1  ALA  60           1HB      ALA  60  -3.368  -5.902 -23.717
  475    HB2  ALA  60           HB2      ALA  60  -2.369  -6.560 -25.039
  476    HB3  ALA  60           HB3      ALA  60  -3.329  -7.654 -24.009
  477    H    ASP  61           H        ASP  61   0.757  -6.857 -24.216
  478    HA   ASP  61           HA       ASP  61   1.091  -9.730 -24.484
  479    HB2  ASP  61           HB2      ASP  61   3.021  -7.360 -24.563
  480    HB3  ASP  61           HB3      ASP  61   3.519  -8.992 -24.766
  481    H    ALA  62           H        ALA  62   1.691  -7.232 -22.063
  482    HA   ALA  62           HA       ALA  62   3.230  -8.924 -20.289
  483    HB1  ALA  62           1HB      ALA  62   2.836  -7.089 -18.691
  484    HB2  ALA  62           HB2      ALA  62   3.446  -6.499 -20.264
  485    HB3  ALA  62           HB3      ALA  62   1.722  -6.320 -19.847
  486    H    LYS  63           H        LYS  63  -0.233  -8.108 -20.768
  487    HA   LYS  63           HA       LYS  63  -1.172  -9.411 -18.370
  488    HB2  LYS  63           HB2      LYS  63  -2.482  -8.901 -21.073
  489    HB3  LYS  63           HB3      LYS  63  -3.330  -9.587 -19.681
  490    HG2  LYS  63           HG2      LYS  63  -2.939  -7.575 -18.357
  491    HG3  LYS  63           HG3      LYS  63  -1.926  -6.898 -19.644
  492    HD2  LYS  63           2HD      LYS  63  -4.165  -5.888 -19.712
  493    HD3  LYS  63           3HD      LYS  63  -3.864  -6.815 -21.171
  494    HE2  LYS  63           HE2      LYS  63  -6.099  -7.333 -20.428
  495    HE3  LYS  63           HE3      LYS  63  -5.099  -8.764 -20.143
  496    HZ1  LYS  63           3HZ      LYS  63  -5.837  -6.766 -18.111
  497    HZ2  LYS  63           1HZ      LYS  63  -6.484  -8.267 -18.257
  498    HZ3  LYS  63           2HZ      LYS  63  -4.904  -8.095 -17.843
  499    H    ASP  64           H        ASP  64  -0.446 -10.490 -21.704
  500    HA   ASP  64           HA       ASP  64  -1.633 -13.073 -21.383
  501    HB2  ASP  64           HB2      ASP  64  -1.043 -11.822 -23.533
  502    HB3  ASP  64           HB3      ASP  64   0.645 -12.237 -23.220
  503    H    ALA  65           H        ALA  65   1.611 -11.745 -20.778
  504    HA   ALA  65           HA       ALA  65   2.784 -14.321 -20.125
  505    HB1  ALA  65           1HB      ALA  65   4.077 -12.269 -20.827
  506    HB2  ALA  65           HB2      ALA  65   3.670 -11.537 -19.260
  507    HB3  ALA  65           HB3      ALA  65   4.651 -13.027 -19.324
  508    H    ALA  66           H        ALA  66   1.337 -11.601 -18.268
  509    HA   ALA  66           HA       ALA  66   1.892 -12.807 -15.732
  510    HB1  ALA  66           1HB      ALA  66  -0.118 -10.637 -16.523
  511    HB2  ALA  66           HB2      ALA  66   0.492 -10.945 -14.877
  512    HB3  ALA  66           HB3      ALA  66   1.582 -10.344 -16.159
  513    H    ARG  67           H        ARG  67  -0.349 -13.561 -18.134
  514    HA   ARG  67           HA       ARG  67  -2.170 -14.951 -16.236
  515    HB2  ARG  67           HB2      ARG  67  -2.372 -14.211 -19.170
  516    HB3  ARG  67           HB3      ARG  67  -3.536 -15.270 -18.355
  517    HG2  ARG  67           HG2      ARG  67  -4.195 -13.553 -16.819
  518    HG3  ARG  67           HG3      ARG  67  -2.869 -12.489 -17.310
  519    HD2  ARG  67           2HD      ARG  67  -4.948 -11.725 -18.294
  520    HD3  ARG  67           3HD      ARG  67  -3.862 -12.285 -19.570
  521    HE   ARG  67           HE       ARG  67  -5.777 -14.277 -18.539
  522   HH11  ARG  67          1HH1      ARG  67  -5.088 -11.870 -21.037
  523   HH12  ARG  67          2HH1      ARG  67  -6.236 -12.549 -22.170
  524   HH21  ARG  67          1HH2      ARG  67  -7.277 -15.123 -20.022
  525   HH22  ARG  67          2HH2      ARG  67  -7.472 -14.382 -21.593
  526    H    ASP  68           H        ASP  68   0.765 -15.726 -17.619
  527    HA   ASP  68           HA       ASP  68  -0.103 -18.509 -18.276
  528    HB2  ASP  68           HB2      ASP  68   1.499 -16.418 -19.691
  529    HB3  ASP  68           HB3      ASP  68   2.279 -17.956 -19.554
  530    H    MET  69           H        MET  69   2.555 -16.310 -17.494
  531    HA   MET  69           HA       MET  69   4.274 -18.370 -16.398
  532    HB2  MET  69           HB2      MET  69   4.321 -15.490 -17.219
  533    HB3  MET  69           HB3      MET  69   5.401 -15.911 -15.936
  534    HG2  MET  69           HG2      MET  69   5.152 -17.222 -18.680
  535    HG3  MET  69           HG3      MET  69   6.443 -16.122 -18.172
  536    HE1  MET  69           HE3      MET  69   8.393 -18.191 -15.539
  537    HE2  MET  69           HE1      MET  69   8.039 -16.606 -16.273
  538    HE3  MET  69           HE2      MET  69   6.864 -17.356 -15.156
  539    H    ASN  70           H        ASN  70   1.739 -16.421 -15.094
  540    HA   ASN  70           HA       ASN  70   2.956 -15.980 -12.505
  541    HB2  ASN  70           HB2      ASN  70   1.130 -14.575 -13.442
  542    HB3  ASN  70           HB3      ASN  70   0.041 -15.961 -13.377
  543   HD21  ASN  70          2HD2      ASN  70  -1.273 -14.469 -12.011
  544   HD22  ASN  70          1HD2      ASN  70  -0.907 -14.373 -10.299
  545    H    GLY  71           H        GLY  71   3.184 -17.378 -10.879
  546    HA2  GLY  71           2HA      GLY  71   2.607 -19.094  -9.422
  547    HA3  GLY  71           3HA      GLY  71   1.308 -19.604 -10.517
  548    H    LYS  72           H        LYS  72   3.773 -19.339 -12.667
  549    HA   LYS  72           HA       LYS  72   4.536 -22.148 -12.579
  550    HB2  LYS  72           HB2      LYS  72   5.470 -19.869 -14.328
  551    HB3  LYS  72           HB3      LYS  72   5.534 -21.599 -14.671
  552    HG2  LYS  72           HG2      LYS  72   2.984 -19.948 -14.499
  553    HG3  LYS  72           HG3      LYS  72   3.743 -20.591 -15.965
  554    HD2  LYS  72           2HD      LYS  72   3.409 -22.903 -15.131
  555    HD3  LYS  72           3HD      LYS  72   2.621 -22.258 -13.670
  556    HE2  LYS  72           HE2      LYS  72   0.910 -21.169 -15.090
  557    HE3  LYS  72           HE3      LYS  72   1.687 -21.823 -16.536
  558    HZ1  LYS  72           3HZ      LYS  72   1.257 -24.031 -15.698
  559    HZ2  LYS  72           1HZ      LYS  72   0.512 -23.423 -14.362
  560    HZ3  LYS  72           2HZ      LYS  72  -0.146 -23.183 -15.851
  561    H    SER  73           H        SER  73   7.087 -21.697 -13.711
  562    HA   SER  73           HA       SER  73   8.706 -20.716 -11.397
  563    HB2  SER  73           HB2      SER  73   8.169 -23.128 -11.239
  564    HB3  SER  73           HB3      SER  73   8.908 -23.393 -12.829
  565    HG   SER  73           HG       SER  73  10.363 -23.805 -11.090
  566    H    LEU  74           H        LEU  74  10.846 -20.244 -11.841
  567    HA   LEU  74           HA       LEU  74  11.130 -19.366 -14.679
  568    HB2  LEU  74           HB2      LEU  74  11.347 -17.804 -12.479
  569    HB3  LEU  74           HB3      LEU  74  12.956 -18.441 -12.465
  570    HG   LEU  74           HG       LEU  74  12.954 -16.355 -13.646
  571   HD11  LEU  74          1HD1      LEU  74  13.172 -18.492 -15.788
  572   HD12  LEU  74          2HD1      LEU  74  13.914 -16.883 -15.770
  573   HD13  LEU  74          3HD1      LEU  74  14.442 -18.099 -14.592
  574   HD21  LEU  74          3HD2      LEU  74  10.497 -16.521 -14.242
  575   HD22  LEU  74          1HD2      LEU  74  11.540 -15.872 -15.521
  576   HD23  LEU  74          2HD2      LEU  74  10.973 -17.558 -15.616
  577    H    ASP  75           H        ASP  75  13.369 -20.312 -12.098
  578    HA   ASP  75           HA       ASP  75  14.935 -21.841 -14.122
  579    HB2  ASP  75           HB2      ASP  75  15.865 -19.573 -12.989
  580    HB3  ASP  75           HB3      ASP  75  15.977 -20.552 -11.589
  581    H    GLY  76           H        GLY  76  12.784 -22.337 -11.896
  582    HA2  GLY  76           2HA      GLY  76  12.753 -24.802 -11.326
  583    HA3  GLY  76           3HA      GLY  76  14.288 -24.472 -10.474
  584    H    LYS  77           H        LYS  77  12.781 -21.657 -10.119
  585    HA   LYS  77           HA       LYS  77  11.511 -22.405  -7.537
  586    HB2  LYS  77           HB2      LYS  77  12.873 -19.796  -8.282
  587    HB3  LYS  77           HB3      LYS  77  12.236 -20.252  -6.694
  588    HG2  LYS  77           HG2      LYS  77  14.535 -21.582  -8.197
  589    HG3  LYS  77           HG3      LYS  77  14.691 -20.545  -6.771
  590    HD2  LYS  77           2HD      LYS  77  13.686 -22.176  -5.340
  591    HD3  LYS  77           3HD      LYS  77  13.122 -23.157  -6.708
  592    HE2  LYS  77           HE2      LYS  77  15.377 -23.659  -7.396
  593    HE3  LYS  77           HE3      LYS  77  16.047 -22.628  -6.112
  594    HZ1  LYS  77           3HZ      LYS  77  14.421 -25.051  -5.699
  595    HZ2  LYS  77           1HZ      LYS  77  16.045 -24.945  -5.485
  596    HZ3  LYS  77           2HZ      LYS  77  15.032 -24.099  -4.505
  597    H    ALA  78           H        ALA  78   9.476 -21.742  -7.158
  598    HA   ALA  78           HA       ALA  78   8.010 -20.954  -9.521
  599    HB1  ALA  78           1HB      ALA  78   7.073 -21.474  -6.682
  600    HB2  ALA  78           HB2      ALA  78   6.025 -21.286  -8.113
  601    HB3  ALA  78           HB3      ALA  78   7.157 -22.657  -8.011
  602    H    ILE  79           H        ILE  79   6.984 -19.080  -9.996
  603    HA   ILE  79           HA       ILE  79   7.712 -16.766  -8.269
  604    HB   ILE  79           HB       ILE  79   7.980 -15.458 -10.231
  605   HG12  ILE  79          HG21      ILE  79   7.091 -17.867 -11.878
  606   HG13  ILE  79          HG31      ILE  79   6.093 -16.443 -11.540
  607   HG21  ILE  79          1HG2      ILE  79   9.851 -16.558 -11.313
  608   HG22  ILE  79          HG22      ILE  79   9.870 -16.948  -9.577
  609   HG23  ILE  79          HG32      ILE  79   9.299 -18.152 -10.757
  610   HD11  ILE  79          3HD1      ILE  79   7.039 -16.062 -13.681
  611   HD12  ILE  79          1HD1      ILE  79   7.923 -15.016 -12.555
  612   HD13  ILE  79          2HD1      ILE  79   8.672 -16.524 -13.136
  613    H    LYS  80           H        LYS  80   6.506 -14.792  -8.847
  614    HA   LYS  80           HA       LYS  80   3.602 -15.225  -9.354
  615    HB2  LYS  80           HB2      LYS  80   4.262 -14.496  -6.994
  616    HB3  LYS  80           HB3      LYS  80   4.919 -13.019  -7.713
  617    HG2  LYS  80           HG2      LYS  80   2.666 -12.523  -8.708
  618    HG3  LYS  80           HG3      LYS  80   2.028 -13.975  -7.915
  619    HD2  LYS  80           2HD      LYS  80   1.462 -12.074  -6.549
  620    HD3  LYS  80           3HD      LYS  80   2.749 -12.976  -5.702
  621    HE2  LYS  80           HE2      LYS  80   4.410 -11.384  -6.685
  622    HE3  LYS  80           HE3      LYS  80   3.053 -10.441  -7.346
  623    HZ1  LYS  80           3HZ      LYS  80   2.261 -10.162  -5.080
  624    HZ2  LYS  80           1HZ      LYS  80   3.545 -11.008  -4.496
  625    HZ3  LYS  80           2HZ      LYS  80   3.790  -9.570  -5.242
  626    H    VAL  81           H        VAL  81   2.748 -13.875 -10.978
  627    HA   VAL  81           HA       VAL  81   4.519 -11.704 -11.978
  628    HB   VAL  81           HB       VAL  81   3.054 -13.683 -13.765
  629   HG11  VAL  81          1HG1      VAL  81   3.178 -11.360 -14.651
  630   HG12  VAL  81          HG21      VAL  81   4.938 -11.366 -14.392
  631   HG13  VAL  81          HG31      VAL  81   4.202 -12.479 -15.573
  632   HG21  VAL  81          HG32      VAL  81   6.022 -13.279 -13.207
  633   HG22  VAL  81          1HG2      VAL  81   5.054 -14.713 -12.776
  634   HG23  VAL  81          HG22      VAL  81   5.349 -14.321 -14.482
  635    H    GLU  82           H        GLU  82   3.507  -9.835 -12.094
  636    HA   GLU  82           HA       GLU  82   0.631  -9.628 -12.588
  637    HB2  GLU  82           HB2      GLU  82   0.801 -10.308 -10.163
  638    HB3  GLU  82           HB3      GLU  82   1.821  -8.893  -9.871
  639    HG2  GLU  82           HG2      GLU  82  -0.513  -8.528  -9.181
  640    HG3  GLU  82           HG3      GLU  82  -0.023  -7.390 -10.430
  641    H    GLN  83           H        GLN  83   0.005  -7.240 -12.705
  642    HA   GLN  83           HA       GLN  83   2.064  -5.610 -13.810
  643    HB2  GLN  83           HB2      GLN  83  -0.213  -5.121 -14.362
  644    HB3  GLN  83           HB3      GLN  83  -0.688  -5.099 -12.658
  645    HG2  GLN  83           HG2      GLN  83  -0.677  -2.846 -13.464
  646    HG3  GLN  83           HG3      GLN  83   0.613  -3.047 -12.276
  647   HE21  GLN  83          HE22      GLN  83   2.098  -1.597 -12.828
  648   HE22  GLN  83          HE12      GLN  83   2.781  -1.384 -14.425
  649    H    ALA  84           H        ALA  84   3.499  -4.205 -12.864
  650    HA   ALA  84           HA       ALA  84   4.011  -4.689 -10.047
  651    HB1  ALA  84           1HB      ALA  84   5.417  -2.900 -12.058
  652    HB2  ALA  84           HB2      ALA  84   6.041  -3.367 -10.461
  653    HB3  ALA  84           HB3      ALA  84   5.820  -4.600 -11.723
  654    H    THR  85           H        THR  85   4.349  -3.085  -8.437
  655    HA   THR  85           HA       THR  85   2.969  -0.482  -8.916
  656    HB   THR  85           HB       THR  85   2.704  -0.386  -6.461
  657    HG1  THR  85           1HG      THR  85   4.231  -1.983  -5.911
  658   HG21  THR  85          1HG2      THR  85   0.840  -1.087  -7.964
  659   HG22  THR  85          HG22      THR  85   1.360  -2.783  -7.811
  660   HG23  THR  85          HG32      THR  85   0.746  -1.903  -6.390
  661    H    LYS  86           H        LYS  86   3.855   1.286  -7.581
  662    HA   LYS  86           HA       LYS  86   6.597   1.627  -8.219
  663    HB2  LYS  86           HB2      LYS  86   4.699   3.171  -6.403
  664    HB3  LYS  86           HB3      LYS  86   6.308   3.737  -6.889
  665    HG2  LYS  86           HG2      LYS  86   5.596   3.409  -9.307
  666    HG3  LYS  86           HG3      LYS  86   3.949   3.091  -8.713
  667    HD2  LYS  86           2HD      LYS  86   3.991   5.354  -7.598
  668    HD3  LYS  86           3HD      LYS  86   5.551   5.653  -8.387
  669    HE2  LYS  86           HE2      LYS  86   4.466   5.178 -10.604
  670    HE3  LYS  86           HE3      LYS  86   2.913   5.018  -9.770
  671    HZ1  LYS  86           3HZ      LYS  86   4.576   7.453  -9.757
  672    HZ2  LYS  86           1HZ      LYS  86   3.217   7.236 -10.658
  673    HZ3  LYS  86           2HZ      LYS  86   3.131   7.275  -9.013
  674    HA   PRO  87           HA       PRO  87   8.768  -0.069  -4.812
  675    HB2  PRO  87           HB2      PRO  87  10.904   1.626  -4.529
  676    HB3  PRO  87           HB3      PRO  87  10.718   0.499  -5.905
  677    HG2  PRO  87           HG2      PRO  87   9.978   3.429  -5.803
  678    HG3  PRO  87           HG3      PRO  87  10.926   2.572  -7.067
  679    HD2  PRO  87           2HD      PRO  87   8.279   3.057  -7.389
  680    HD3  PRO  87           3HD      PRO  87   8.969   1.490  -7.902
  681    H    SER  88           H        SER  88   9.351   0.292  -2.564
  682    HA   SER  88           HA       SER  88   7.300   1.931  -1.346
  683    HB2  SER  88           HB2      SER  88   7.831  -0.446  -0.719
  684    HB3  SER  88           HB3      SER  88   9.391   0.107  -0.083
  685    HG   SER  88           HG       SER  88   7.767  -0.022   1.537
  686    H    PHE  89           H        PHE  89  10.582   2.495  -2.143
  687    HA   PHE  89           HA       PHE  89  10.865   4.478   0.032
  688    HB2  PHE  89           HB2      PHE  89  13.157   4.726  -0.706
  689    HB3  PHE  89           HB3      PHE  89  12.765   3.064  -0.271
  690    HD1  PHE  89           HD2      PHE  89  12.489   1.334  -2.067
  691    HD2  PHE  89           HD1      PHE  89  13.858   5.318  -2.915
  692    HE1  PHE  89           HE2      PHE  89  13.449   0.547  -4.196
  693    HE2  PHE  89           HE1      PHE  89  14.830   4.522  -5.065
  694    HZ   PHE  89           HZ       PHE  89  14.618   2.140  -5.709
  695    H    GLU  90           H        GLU  90   8.987   4.640  -2.385
  696    HA   GLU  90           HA       GLU  90   9.792   7.358  -3.211
  697    HB2  GLU  90           HB2      GLU  90  10.654   5.474  -4.787
  698    HB3  GLU  90           HB3      GLU  90   8.951   5.261  -5.230
  699    HG2  GLU  90           HG2      GLU  90   8.887   7.669  -5.916
  700    HG3  GLU  90           HG3      GLU  90  10.577   7.840  -5.401
  701    H    SER  91           H        SER  91   8.037   8.493  -4.379
  702    HA   SER  91           HA       SER  91   5.324   7.423  -4.024
  703    HB2  SER  91           HB2      SER  91   6.125   8.478  -1.826
  704    HB3  SER  91           HB3      SER  91   6.142  10.025  -2.703
  705    HG   SER  91           HG       SER  91   4.136   9.634  -1.630
  706    H    GLY  92           H        GLY  92   3.812   8.513  -5.343
  707    HA2  GLY  92           2HA      GLY  92   3.086   9.836  -7.079
  708    HA3  GLY  92           3HA      GLY  92   4.129  11.098  -6.408
  709    H    ARG  93           H        ARG  93   5.133  11.931  -8.076
  710    HA   ARG  93           HA       ARG  93   6.336  12.250  -9.942
  711    HB2  ARG  93           HB2      ARG  93   7.719   9.803  -8.817
  712    HB3  ARG  93           HB3      ARG  93   8.316  10.647 -10.251
  713    HG2  ARG  93           HG2      ARG  93   7.833  11.991  -7.562
  714    HG3  ARG  93           HG3      ARG  93   9.402  11.407  -8.143
  715    HD2  ARG  93           2HD      ARG  93   9.209  12.890 -10.134
  716    HD3  ARG  93           3HD      ARG  93   7.690  13.540  -9.496
  717    HE   ARG  93           HE       ARG  93   9.640  13.812  -7.469
  718   HH11  ARG  93          1HH1      ARG  93   8.977  15.066 -10.705
  719   HH12  ARG  93          2HH1      ARG  93   9.782  16.590 -10.407
  720   HH21  ARG  93          1HH2      ARG  93  10.678  15.811  -7.104
  721   HH22  ARG  93          2HH2      ARG  93  10.749  17.005  -8.381
  722    H    ARG  94           H        ARG  94   7.173  11.467 -12.003
  723    HA   ARG  94           HA       ARG  94   5.473   9.429 -13.307
  724    HB2  ARG  94           HB2      ARG  94   5.497  12.414 -13.843
  725    HB3  ARG  94           HB3      ARG  94   4.929  11.227 -15.050
  726    HG2  ARG  94           HG2      ARG  94   3.250  10.395 -13.403
  727    HG3  ARG  94           HG3      ARG  94   3.775  11.657 -12.260
  728    HD2  ARG  94           2HD      ARG  94   3.176  13.395 -13.904
  729    HD3  ARG  94           3HD      ARG  94   2.649  12.141 -15.047
  730    HE   ARG  94           HE       ARG  94   1.260  11.751 -12.606
  731   HH11  ARG  94          1HH1      ARG  94   1.454  14.121 -15.222
  732   HH12  ARG  94          2HH1      ARG  94  -0.202  14.647 -15.025
  733   HH21  ARG  94          1HH2      ARG  94  -0.893  12.470 -12.364
  734   HH22  ARG  94          2HH2      ARG  94  -1.525  13.710 -13.421
  735    H    GLY  95           H        GLY  95   6.182   9.055 -15.557
  736    HA2  GLY  95           2HA      GLY  95   8.394  10.146 -16.837
  737    HA3  GLY  95           3HA      GLY  95   9.055   8.907 -15.750
  738    H5'    A  96           H5'        A  96   6.448 -11.480   2.869
  739   H5''    A  96          H5''        A  96   7.059 -10.743   4.353
  740    H4'    A  96           H4'        A  96   7.172 -13.725   3.622
  741    H3'    A  96           H3'        A  96   5.204 -12.016   4.968
  742    H2'    A  96           H2'        A  96   5.387 -12.748   7.172
  743   HO2'    A  96          HO2'        A  96   5.251 -15.015   6.523
  744    H1'    A  96           H1'        A  96   8.026 -13.240   7.410
  745    H8     A  96           H8         A  96   9.013 -10.559   5.497
  746    H61    A  96           H61        A  96   6.288  -6.439   9.255
  747    H62    A  96           H62        A  96   7.485  -6.649   7.988
  748    H2     A  96           H2         A  96   4.570 -10.431  10.119
  749   HO5'    A  96          H5T         A  96   8.585 -12.139   2.386
  750    H5'    U  97           H5'        U  97   2.831 -12.489   5.316
  751   H5''    U  97          H5''        U  97   1.532 -12.880   4.174
  752    H4'    U  97           H4'        U  97   1.660 -10.546   3.286
  753    H3'    U  97           H3'        U  97   4.030 -10.366   4.809
  754    H2'    U  97           H2'        U  97   3.408  -9.403   6.825
  755   HO2'    U  97          HO2'        U  97   3.092  -7.393   5.762
  756    H1'    U  97           H1'        U  97   0.651  -9.357   6.851
  757    H3     U  97           H3         U  97  -0.034 -12.823   9.641
  758    H5     U  97           H5         U  97   3.982 -13.212   8.501
  759    H6     U  97           H6         U  97   3.622 -11.462   6.839
  760    H5'    C  98           H5'        C  98   5.922  -7.481   1.182
  761   H5''    C  98          H5''        C  98   4.570  -8.591   0.931
  762    H4'    C  98           H4'        C  98   7.440  -9.538   1.276
  763    H3'    C  98           H3'        C  98   6.860  -7.911  -0.810
  764    H2'    C  98           H2'        C  98   4.747  -8.937  -1.291
  765   HO2'    C  98          HO2'        C  98   6.711 -10.138  -2.970
  766    H1'    C  98           H1'        C  98   5.976 -11.675  -1.299
  767    H41    C  98           H41        C  98  -0.317 -12.685  -1.544
  768    H42    C  98           H42        C  98  -0.540 -11.900   0.011
  769    H5     C  98           H5         C  98   1.297 -10.810   1.210
  770    H6     C  98           H6         C  98   3.682 -10.309   1.132
  771    H5'    A  99           H5'        A  99   9.783  -6.094  -0.922
  772   H5''    A  99          H5''        A  99   8.206  -6.520  -1.631
  773    H4'    A  99           H4'        A  99  10.662  -5.983  -3.336
  774    H3'    A  99           H3'        A  99   9.456  -3.993  -1.742
  775    H2'    A  99           H2'        A  99   7.385  -4.033  -2.960
  776   HO2'    A  99          HO2'        A  99   8.829  -1.999  -3.504
  777    H1'    A  99           H1'        A  99   9.091  -4.558  -5.398
  778    H8     A  99           H8         A  99   7.367  -3.665  -7.010
  779    H61    A  99           H61        A  99   1.899  -6.606  -6.543
  780    H62    A  99           H62        A  99   2.848  -5.510  -7.532
  781    H2     A  99           H2         A  99   4.386  -7.709  -3.050
  782    H5'    A 100           H5'        A 100  13.357  -3.586  -3.474
  783   H5''    A 100          H5''        A 100  14.288  -2.118  -3.236
  784    H4'    A 100           H4'        A 100  14.918  -3.478  -5.303
  785    H3'    A 100           H3'        A 100  14.942  -0.782  -4.842
  786    H2'    A 100           H2'        A 100  12.804  -0.382  -5.812
  787   HO2'    A 100          HO2'        A 100  14.687  -0.135  -7.945
  788    H1'    A 100           H1'        A 100  13.583  -2.231  -8.071
  789    H8     A 100           H8         A 100  10.527  -2.109  -5.712
  790    H61    A 100           H61        A 100   7.366  -0.314 -10.774
  791    H62    A 100           H62        A 100   7.215  -0.800  -9.091
  792    H2     A 100           H2         A 100  11.650  -0.580 -11.829
  793    H5'    A 101           H5'        A 101  16.550   0.904  -6.969
  794   H5''    A 101          H5''        A 101  18.115   0.349  -7.589
  795    H4'    A 101           H4'        A 101  18.123   2.747  -7.230
  796    H3'    A 101           H3'        A 101  20.146   1.067  -6.505
  797   HO3'    A 101          H3T         A 101  20.458   3.190  -7.307
  798    H2'    A 101           H2'        A 101  19.501   0.694  -4.284
  799   HO2'    A 101          HO2'        A 101  21.072   3.062  -4.235
  800    H1'    A 101           H1'        A 101  18.776   3.575  -3.827
  801    H8     A 101           H8         A 101  18.013  -0.157  -3.257
  802    H61    A 101           H61        A 101  14.784   1.798   1.680
  803    H62    A 101           H62        A 101  15.372   0.385   0.820
  804    H2     A 101           H2         A 101  16.130   5.364  -0.594
  Start of MODEL   14
    1    H1   MET   1           H1       MET   1   0.732   4.357  -0.769
    2    H2   MET   1           H2       MET   1   0.184   2.837  -0.483
    3    H3   MET   1           H3       MET   1  -0.789   3.934  -1.232
    4    HA   MET   1           HA       MET   1   0.656   4.011  -3.139
    5    HB2  MET   1           HB2      MET   1   2.662   3.442  -1.660
    6    HB3  MET   1           HB3      MET   1   2.204   1.746  -1.852
    7    HG2  MET   1           HG2      MET   1   2.864   3.749  -4.052
    8    HG3  MET   1           HG3      MET   1   3.917   2.456  -3.484
    9    HE1  MET   1           HE1      MET   1   2.048  -0.756  -4.755
   10    HE2  MET   1           HE2      MET   1   3.568  -0.142  -4.058
   11    HE3  MET   1           HE3      MET   1   2.044   0.012  -3.154
   12    H    VAL   2           H        VAL   2  -1.053   3.406  -4.257
   13    HA   VAL   2           HA       VAL   2  -1.510   0.506  -4.627
   14    HB   VAL   2           HB       VAL   2  -3.430   1.425  -3.422
   15   HG11  VAL   2          1HG1      VAL   2  -4.756   3.307  -4.356
   16   HG12  VAL   2          HG21      VAL   2  -3.116   3.824  -3.913
   17   HG13  VAL   2          HG31      VAL   2  -3.528   3.532  -5.621
   18   HG21  VAL   2          HG32      VAL   2  -4.243   1.365  -6.340
   19   HG22  VAL   2          1HG2      VAL   2  -3.831  -0.108  -5.411
   20   HG23  VAL   2          HG22      VAL   2  -5.211   0.913  -4.929
   21    H    GLU   3           H        GLU   3   0.284   2.645  -5.731
   22    HA   GLU   3           HA       GLU   3  -0.993   3.471  -8.190
   23    HB2  GLU   3           HB2      GLU   3   1.771   4.018  -6.995
   24    HB3  GLU   3           HB3      GLU   3   1.101   4.855  -8.405
   25    HG2  GLU   3           HG2      GLU   3  -0.061   4.892  -5.593
   26    HG3  GLU   3           HG3      GLU   3   0.858   6.195  -6.367
   27    H    ALA   4           H        ALA   4  -0.498   2.959 -10.198
   28    HA   ALA   4           HA       ALA   4   1.426   0.722 -10.641
   29    HB1  ALA   4           1HB      ALA   4  -1.228   1.374 -11.976
   30    HB2  ALA   4           HB2      ALA   4  -0.146   0.024 -12.417
   31    HB3  ALA   4           HB3      ALA   4  -0.923   0.074 -10.808
   32    H    ASP   5           H        ASP   5   3.170   1.634 -11.411
   33    HA   ASP   5           HA       ASP   5   3.381   4.282 -12.294
   34    HB2  ASP   5           HB2      ASP   5   5.199   3.043 -11.331
   35    HB3  ASP   5           HB3      ASP   5   5.184   1.879 -12.656
   36    H    ARG   6           H        ARG   6   3.222   1.302 -14.366
   37    HA   ARG   6           HA       ARG   6   1.916   2.866 -16.414
   38    HB2  ARG   6           HB2      ARG   6   3.581   2.463 -18.196
   39    HB3  ARG   6           HB3      ARG   6   4.188   3.571 -16.962
   40    HG2  ARG   6           HG2      ARG   6   5.591   1.887 -15.992
   41    HG3  ARG   6           HG3      ARG   6   4.807   0.582 -16.907
   42    HD2  ARG   6           2HD      ARG   6   6.340   2.857 -18.195
   43    HD3  ARG   6           3HD      ARG   6   7.037   1.266 -17.830
   44    HE   ARG   6           HE       ARG   6   4.784   0.634 -19.263
   45   HH11  ARG   6          1HH1      ARG   6   7.524   2.784 -19.891
   46   HH12  ARG   6          2HH1      ARG   6   7.437   2.568 -21.623
   47   HH21  ARG   6          1HH2      ARG   6   4.711   0.358 -21.507
   48   HH22  ARG   6          2HH2      ARG   6   5.850   1.197 -22.538
   49    HA   PRO   7           HA       PRO   7   0.548  -1.240 -17.627
   50    HB2  PRO   7           HB2      PRO   7   0.648  -0.042 -20.385
   51    HB3  PRO   7           HB3      PRO   7  -0.698  -0.962 -19.630
   52    HG2  PRO   7           HG2      PRO   7  -0.842   1.700 -19.910
   53    HG3  PRO   7           HG3      PRO   7  -1.329   0.950 -18.341
   54    HD2  PRO   7           2HD      PRO   7   1.310   2.277 -19.051
   55    HD3  PRO   7           3HD      PRO   7   0.306   2.497 -17.586
   56    H    GLY   8           H        GLY   8   1.623  -3.109 -18.447
   57    HA2  GLY   8           2HA      GLY   8   2.972  -4.226 -20.034
   58    HA3  GLY   8           3HA      GLY   8   3.780  -2.690 -20.431
   59    H    LYS   9           H        LYS   9   3.910  -2.155 -17.361
   60    HA   LYS   9           HA       LYS   9   6.434  -3.607 -17.009
   61    HB2  LYS   9           HB2      LYS   9   6.303  -1.212 -16.421
   62    HB3  LYS   9           HB3      LYS   9   5.107  -1.605 -15.160
   63    HG2  LYS   9           HG2      LYS   9   6.760  -3.187 -14.138
   64    HG3  LYS   9           HG3      LYS   9   7.946  -2.736 -15.366
   65    HD2  LYS   9           2HD      LYS   9   6.666  -0.771 -13.427
   66    HD3  LYS   9           3HD      LYS   9   8.217  -1.605 -13.146
   67    HE2  LYS   9           HE2      LYS   9   9.160  -0.616 -15.182
   68    HE3  LYS   9           HE3      LYS   9   7.618   0.163 -15.565
   69    HZ1  LYS   9           3HZ      LYS   9   7.837   1.520 -13.651
   70    HZ2  LYS   9           1HZ      LYS   9   9.170   0.706 -13.124
   71    HZ3  LYS   9           2HZ      LYS   9   9.241   1.626 -14.484
   72    H    LEU  10           H        LEU  10   6.681  -5.378 -15.811
   73    HA   LEU  10           HA       LEU  10   4.315  -6.380 -14.282
   74    HB2  LEU  10           HB2      LEU  10   6.449  -7.785 -15.892
   75    HB3  LEU  10           HB3      LEU  10   5.353  -8.661 -14.886
   76    HG   LEU  10           HG       LEU  10   4.555  -6.948 -17.283
   77   HD11  LEU  10          1HD1      LEU  10   4.345  -9.955 -16.775
   78   HD12  LEU  10          2HD1      LEU  10   4.159  -9.114 -18.331
   79   HD13  LEU  10          3HD1      LEU  10   5.759  -9.229 -17.548
   80   HD21  LEU  10          3HD2      LEU  10   2.863  -8.615 -15.394
   81   HD22  LEU  10          1HD2      LEU  10   2.752  -6.857 -15.695
   82   HD23  LEU  10          2HD2      LEU  10   2.321  -8.020 -16.973
   83    H    PHE  11           H        PHE  11   4.724  -7.492 -12.367
   84    HA   PHE  11           HA       PHE  11   7.405  -7.102 -11.142
   85    HB2  PHE  11           HB2      PHE  11   5.651  -6.083  -9.835
   86    HB3  PHE  11           HB3      PHE  11   4.614  -7.503 -10.017
   87    HD1  PHE  11           HD2      PHE  11   7.930  -6.460  -8.619
   88    HD2  PHE  11           HD1      PHE  11   4.603  -9.171  -8.377
   89    HE1  PHE  11           HE2      PHE  11   8.858  -7.420  -6.532
   90    HE2  PHE  11           HE1      PHE  11   5.544 -10.145  -6.298
   91    HZ   PHE  11           HZ       PHE  11   7.682  -9.261  -5.381
   92    H    ILE  12           H        ILE  12   8.627  -8.872 -10.763
   93    HA   ILE  12           HA       ILE  12   7.361 -11.529 -11.246
   94    HB   ILE  12           HB       ILE  12  10.244 -10.885 -11.850
   95   HG12  ILE  12          HG21      ILE  12   9.097  -9.258 -13.214
   96   HG13  ILE  12          HG31      ILE  12   9.773 -10.552 -14.190
   97   HG21  ILE  12          1HG2      ILE  12   8.230 -12.923 -12.870
   98   HG22  ILE  12          HG22      ILE  12   9.932 -12.808 -13.380
   99   HG23  ILE  12          HG32      ILE  12   9.527 -13.218 -11.691
  100   HD11  ILE  12          3HD1      ILE  12   7.629  -9.985 -15.080
  101   HD12  ILE  12          1HD1      ILE  12   7.465 -11.585 -14.324
  102   HD13  ILE  12          2HD1      ILE  12   6.840 -10.138 -13.497
  103    H    GLY  13           H        GLY  13   7.011 -11.717  -8.894
  104    HA2  GLY  13           2HA      GLY  13   9.477 -11.622  -7.241
  105    HA3  GLY  13           3HA      GLY  13   7.827 -11.687  -6.648
  106    H    GLY  14           H        GLY  14  10.301 -13.429  -6.112
  107    HA2  GLY  14           2HA      GLY  14  10.048 -15.558  -5.085
  108    HA3  GLY  14           3HA      GLY  14   8.772 -15.970  -6.250
  109    H    LEU  15           H        LEU  15  11.389 -14.390  -7.747
  110    HA   LEU  15           HA       LEU  15  12.048 -16.628  -9.387
  111    HB2  LEU  15           HB2      LEU  15  13.497 -14.007  -8.819
  112    HB3  LEU  15           HB3      LEU  15  13.877 -15.153 -10.140
  113    HG   LEU  15           HG       LEU  15  11.132 -13.909  -9.935
  114   HD11  LEU  15          1HD1      LEU  15  12.760 -12.061 -10.040
  115   HD12  LEU  15          2HD1      LEU  15  13.634 -12.878 -11.353
  116   HD13  LEU  15          3HD1      LEU  15  11.974 -12.281 -11.624
  117   HD21  LEU  15          3HD2      LEU  15  11.137 -14.521 -12.327
  118   HD22  LEU  15          1HD2      LEU  15  12.847 -14.991 -12.220
  119   HD23  LEU  15          2HD2      LEU  15  11.624 -15.945 -11.363
  120    H    ASN  16           H        ASN  16  14.228 -17.535  -9.691
  121    HA   ASN  16           HA       ASN  16  15.321 -18.530  -7.239
  122    HB2  ASN  16           HB2      ASN  16  15.110 -19.706  -9.431
  123    HB3  ASN  16           HB3      ASN  16  16.406 -18.662 -10.061
  124   HD21  ASN  16          2HD2      ASN  16  17.272 -20.861 -10.475
  125   HD22  ASN  16          1HD2      ASN  16  18.192 -21.625  -9.224
  126    H    THR  17           H        THR  17  17.598 -18.260  -6.583
  127    HA   THR  17           HA       THR  17  18.481 -15.503  -6.681
  128    HB   THR  17           HB       THR  17  20.358 -16.355  -5.319
  129    HG1  THR  17           1HG      THR  17  20.606 -18.395  -6.250
  130   HG21  THR  17          1HG2      THR  17  19.023 -17.151  -3.424
  131   HG22  THR  17          HG22      THR  17  18.139 -15.859  -4.280
  132   HG23  THR  17          HG32      THR  17  17.681 -17.568  -4.510
  133    H    GLU  18           H        GLU  18  18.590 -17.881  -8.937
  134    HA   GLU  18           HA       GLU  18  21.383 -17.419  -9.834
  135    HB2  GLU  18           HB2      GLU  18  19.480 -19.599 -10.708
  136    HB3  GLU  18           HB3      GLU  18  21.248 -19.593 -10.808
  137    HG2  GLU  18           HG2      GLU  18  19.596 -19.676  -8.237
  138    HG3  GLU  18           HG3      GLU  18  20.342 -21.061  -8.980
  139    H    THR  19           H        THR  19  18.211 -16.451 -10.437
  140    HA   THR  19           HA       THR  19  18.290 -16.447 -13.355
  141    HB   THR  19           HB       THR  19  16.396 -15.052 -11.422
  142    HG1  THR  19           1HG      THR  19  16.256 -17.575 -12.704
  143   HG21  THR  19          1HG2      THR  19  16.133 -15.802 -14.362
  144   HG22  THR  19          HG22      THR  19  14.819 -15.173 -13.345
  145   HG23  THR  19          HG32      THR  19  16.227 -14.153 -13.693
  146    H    ASN  20           H        ASN  20  18.651 -14.678 -14.686
  147    HA   ASN  20           HA       ASN  20  19.282 -12.096 -13.366
  148    HB2  ASN  20           HB2      ASN  20  20.868 -12.784 -15.773
  149    HB3  ASN  20           HB3      ASN  20  21.306 -11.795 -14.372
  150   HD21  ASN  20          2HD2      ASN  20  21.127 -15.007 -15.771
  151   HD22  ASN  20          1HD2      ASN  20  22.110 -15.815 -14.565
  152    H    GLU  21           H        GLU  21  19.894 -10.681 -15.596
  153    HA   GLU  21           HA       GLU  21  17.244 -10.035 -16.512
  154    HB2  GLU  21           HB2      GLU  21  20.017  -9.092 -17.312
  155    HB3  GLU  21           HB3      GLU  21  18.515  -8.385 -17.949
  156    HG2  GLU  21           HG2      GLU  21  17.793  -7.727 -15.735
  157    HG3  GLU  21           HG3      GLU  21  19.076  -8.667 -14.982
  158    H    LYS  22           H        LYS  22  19.988 -11.843 -17.939
  159    HA   LYS  22           HA       LYS  22  18.988 -11.807 -20.611
  160    HB2  LYS  22           HB2      LYS  22  21.314 -12.290 -20.045
  161    HB3  LYS  22           HB3      LYS  22  20.838 -13.726 -19.131
  162    HG2  LYS  22           HG2      LYS  22  21.728 -14.254 -21.412
  163    HG3  LYS  22           HG3      LYS  22  20.094 -14.860 -21.140
  164    HD2  LYS  22           2HD      LYS  22  20.264 -13.862 -23.366
  165    HD3  LYS  22           3HD      LYS  22  19.137 -12.952 -22.352
  166    HE2  LYS  22           HE2      LYS  22  20.529 -11.397 -23.605
  167    HE3  LYS  22           HE3      LYS  22  20.929 -11.275 -21.886
  168    HZ1  LYS  22           3HZ      LYS  22  22.897 -11.358 -23.242
  169    HZ2  LYS  22           1HZ      LYS  22  22.824 -12.711 -22.309
  170    HZ3  LYS  22           2HZ      LYS  22  22.445 -12.793 -23.903
  171    H    ALA  23           H        ALA  23  18.248 -13.796 -17.803
  172    HA   ALA  23           HA       ALA  23  16.914 -15.859 -19.441
  173    HB1  ALA  23           1HB      ALA  23  18.210 -16.504 -17.440
  174    HB2  ALA  23           HB2      ALA  23  17.168 -15.477 -16.424
  175    HB3  ALA  23           HB3      ALA  23  16.493 -16.908 -17.229
  176    H    LEU  24           H        LEU  24  16.255 -12.866 -17.898
  177    HA   LEU  24           HA       LEU  24  13.406 -13.354 -17.439
  178    HB2  LEU  24           HB2      LEU  24  15.622 -11.560 -16.631
  179    HB3  LEU  24           HB3      LEU  24  14.176 -10.643 -16.913
  180    HG   LEU  24           HG       LEU  24  14.223 -13.205 -15.282
  181   HD11  LEU  24          1HD1      LEU  24  15.825 -11.647 -14.240
  182   HD12  LEU  24          2HD1      LEU  24  14.595 -10.357 -14.250
  183   HD13  LEU  24          3HD1      LEU  24  14.365 -11.807 -13.239
  184   HD21  LEU  24          3HD2      LEU  24  12.364 -10.779 -15.219
  185   HD22  LEU  24          1HD2      LEU  24  12.034 -12.303 -16.065
  186   HD23  LEU  24          2HD2      LEU  24  12.156 -12.279 -14.283
  187    H    GLU  25           H        GLU  25  15.593 -11.750 -19.695
  188    HA   GLU  25           HA       GLU  25  13.393 -10.462 -21.124
  189    HB2  GLU  25           HB2      GLU  25  16.334 -10.978 -21.834
  190    HB3  GLU  25           HB3      GLU  25  15.197 -10.101 -22.886
  191    HG2  GLU  25           HG2      GLU  25  14.725  -8.540 -21.067
  192    HG3  GLU  25           HG3      GLU  25  15.958  -9.314 -20.055
  193    H    ALA  26           H        ALA  26  15.128 -13.455 -21.111
  194    HA   ALA  26           HA       ALA  26  14.413 -14.308 -23.804
  195    HB1  ALA  26           1HB      ALA  26  15.607 -15.740 -21.404
  196    HB2  ALA  26           HB2      ALA  26  15.516 -16.417 -23.047
  197    HB3  ALA  26           HB3      ALA  26  16.515 -14.974 -22.730
  198    H    VAL  27           H        VAL  27  13.025 -14.523 -20.592
  199    HA   VAL  27           HA       VAL  27  11.322 -16.802 -21.385
  200    HB   VAL  27           HB       VAL  27  12.690 -16.676 -19.317
  201   HG11  VAL  27          1HG1      VAL  27  10.468 -14.904 -18.307
  202   HG12  VAL  27          HG21      VAL  27  11.934 -15.419 -17.427
  203   HG13  VAL  27          HG31      VAL  27  12.089 -14.298 -18.795
  204   HG21  VAL  27          HG32      VAL  27   9.676 -17.018 -18.993
  205   HG22  VAL  27          1HG2      VAL  27  10.821 -18.271 -19.555
  206   HG23  VAL  27          HG22      VAL  27  10.923 -17.640 -17.879
  207    H    PHE  28           H        PHE  28  11.107 -13.413 -20.298
  208    HA   PHE  28           HA       PHE  28   8.175 -13.472 -20.656
  209    HB2  PHE  28           HB2      PHE  28  10.048 -11.285 -19.729
  210    HB3  PHE  28           HB3      PHE  28   8.309 -11.080 -19.982
  211    HD1  PHE  28           HD1      PHE  28   6.651 -12.326 -18.617
  212    HD2  PHE  28           HD2      PHE  28  10.863 -12.455 -17.778
  213    HE1  PHE  28           HE1      PHE  28   6.179 -13.261 -16.366
  214    HE2  PHE  28           HE2      PHE  28  10.401 -13.410 -15.548
  215    HZ   PHE  28           HZ       PHE  28   8.046 -13.813 -14.836
  216    H    GLY  29           H        GLY  29  10.925 -12.965 -22.612
  217    HA2  GLY  29           2HA      GLY  29   9.707 -11.079 -24.460
  218    HA3  GLY  29           3HA      GLY  29  11.144 -12.079 -24.757
  219    H    LYS  30           H        LYS  30   8.985 -14.222 -23.631
  220    HA   LYS  30           HA       LYS  30   8.382 -15.338 -26.236
  221    HB2  LYS  30           HB2      LYS  30   7.653 -16.125 -23.362
  222    HB3  LYS  30           HB3      LYS  30   7.421 -17.153 -24.794
  223    HG2  LYS  30           HG2      LYS  30   9.793 -17.172 -25.231
  224    HG3  LYS  30           HG3      LYS  30  10.127 -16.037 -23.920
  225    HD2  LYS  30           2HD      LYS  30  10.593 -18.511 -23.424
  226    HD3  LYS  30           3HD      LYS  30   9.674 -17.598 -22.221
  227    HE2  LYS  30           HE2      LYS  30   7.590 -18.507 -22.973
  228    HE3  LYS  30           HE3      LYS  30   8.384 -19.336 -24.341
  229    HZ1  LYS  30           3HZ      LYS  30   9.594 -20.650 -22.728
  230    HZ2  LYS  30           1HZ      LYS  30   8.851 -19.875 -21.480
  231    HZ3  LYS  30           2HZ      LYS  30   7.978 -20.822 -22.498
  232    H    TYR  31           H        TYR  31   6.893 -13.159 -24.145
  233    HA   TYR  31           HA       TYR  31   4.159 -13.768 -25.190
  234    HB2  TYR  31           HB2      TYR  31   5.090 -12.239 -22.740
  235    HB3  TYR  31           HB3      TYR  31   3.406 -12.519 -23.198
  236    HD1  TYR  31           HD1      TYR  31   2.689 -15.018 -23.386
  237    HD2  TYR  31           HD2      TYR  31   6.288 -13.721 -21.424
  238    HE1  TYR  31           HE1      TYR  31   2.825 -17.198 -22.196
  239    HE2  TYR  31           HE2      TYR  31   6.413 -15.893 -20.201
  240    HH   TYR  31           HH       TYR  31   4.032 -18.523 -20.795
  241    H    GLY  32           H        GLY  32   6.727 -11.386 -25.276
  242    HA2  GLY  32           2HA      GLY  32   5.445  -9.803 -27.268
  243    HA3  GLY  32           3HA      GLY  32   5.275  -9.011 -25.675
  244    H    ARG  33           H        ARG  33   6.627  -7.863 -27.843
  245    HA   ARG  33           HA       ARG  33   9.451  -8.365 -27.409
  246    HB2  ARG  33           HB2      ARG  33   9.901  -6.614 -28.942
  247    HB3  ARG  33           HB3      ARG  33   8.581  -7.594 -29.592
  248    HG2  ARG  33           HG2      ARG  33   6.948  -5.869 -28.791
  249    HG3  ARG  33           HG3      ARG  33   8.317  -4.928 -28.141
  250    HD2  ARG  33           2HD      ARG  33   7.707  -4.005 -30.284
  251    HD3  ARG  33           3HD      ARG  33   9.298  -4.784 -30.390
  252    HE   ARG  33           HE       ARG  33   7.592  -6.779 -31.191
  253   HH11  ARG  33          1HH1      ARG  33   8.001  -3.412 -32.183
  254   HH12  ARG  33          2HH1      ARG  33   7.493  -3.713 -33.826
  255   HH21  ARG  33          1HH2      ARG  33   6.914  -7.137 -33.343
  256   HH22  ARG  33          2HH2      ARG  33   6.869  -5.806 -34.477
  257    H    ILE  34           H        ILE  34  10.632  -7.659 -25.970
  258    HA   ILE  34           HA       ILE  34   9.605  -5.985 -23.791
  259    HB   ILE  34           HB       ILE  34  12.189  -7.506 -24.250
  260   HG12  ILE  34          HG21      ILE  34   9.771  -7.894 -22.435
  261   HG13  ILE  34          HG31      ILE  34  10.165  -8.843 -23.878
  262   HG21  ILE  34          1HG2      ILE  34  11.339  -5.995 -21.753
  263   HG22  ILE  34          HG22      ILE  34  12.801  -7.001 -21.945
  264   HG23  ILE  34          HG32      ILE  34  12.648  -5.501 -22.857
  265   HD11  ILE  34          3HD1      ILE  34  11.786  -8.740 -21.305
  266   HD12  ILE  34          1HD1      ILE  34  10.800 -10.083 -21.888
  267   HD13  ILE  34          2HD1      ILE  34  12.263  -9.606 -22.790
  268    H    VAL  35           H        VAL  35  10.322  -4.022 -23.126
  269    HA   VAL  35           HA       VAL  35  12.057  -2.527 -25.040
  270    HB   VAL  35           HB       VAL  35  10.542  -0.786 -23.317
  271   HG11  VAL  35          1HG1      VAL  35  10.402  -1.341 -26.304
  272   HG12  VAL  35          HG21      VAL  35   9.776   0.101 -25.480
  273   HG13  VAL  35          HG31      VAL  35  11.526  -0.213 -25.503
  274   HG21  VAL  35          HG32      VAL  35   8.272  -1.211 -24.166
  275   HG22  VAL  35          1HG2      VAL  35   8.821  -2.721 -24.916
  276   HG23  VAL  35          HG22      VAL  35   8.843  -2.540 -23.139
  277    H    GLU  36           H        GLU  36  11.538  -3.574 -21.741
  278    HA   GLU  36           HA       GLU  36  14.251  -2.793 -21.043
  279    HB2  GLU  36           HB2      GLU  36  13.040  -0.675 -20.619
  280    HB3  GLU  36           HB3      GLU  36  11.871  -1.538 -19.604
  281    HG2  GLU  36           HG2      GLU  36  13.602  -2.099 -17.990
  282    HG3  GLU  36           HG3      GLU  36  14.860  -1.451 -19.061
  283    H    VAL  37           H        VAL  37  14.997  -3.977 -19.209
  284    HA   VAL  37           HA       VAL  37  12.965  -5.503 -17.712
  285    HB   VAL  37           HB       VAL  37  15.167  -6.688 -19.350
  286   HG11  VAL  37          1HG1      VAL  37  14.407  -7.815 -16.621
  287   HG12  VAL  37          HG21      VAL  37  15.363  -8.644 -17.863
  288   HG13  VAL  37          HG31      VAL  37  16.011  -7.191 -17.089
  289   HG21  VAL  37          HG32      VAL  37  12.765  -7.026 -19.847
  290   HG22  VAL  37          1HG2      VAL  37  13.508  -8.572 -19.349
  291   HG23  VAL  37          HG22      VAL  37  12.505  -7.675 -18.212
  292    H    LEU  38           H        LEU  38  13.445  -5.926 -15.629
  293    HA   LEU  38           HA       LEU  38  15.902  -4.638 -14.462
  294    HB2  LEU  38           HB2      LEU  38  13.022  -4.513 -13.894
  295    HB3  LEU  38           HB3      LEU  38  14.006  -4.703 -12.453
  296    HG   LEU  38           HG       LEU  38  14.483  -2.498 -14.509
  297   HD11  LEU  38          1HD1      LEU  38  13.086  -2.451 -11.801
  298   HD12  LEU  38          2HD1      LEU  38  13.483  -1.018 -12.775
  299   HD13  LEU  38          3HD1      LEU  38  12.306  -2.209 -13.383
  300   HD21  LEU  38          3HD2      LEU  38  15.476  -2.935 -11.667
  301   HD22  LEU  38          1HD2      LEU  38  16.470  -3.109 -13.139
  302   HD23  LEU  38          2HD2      LEU  38  15.828  -1.513 -12.677
  303    H    LEU  39           H        LEU  39  16.771  -5.694 -12.661
  304    HA   LEU  39           HA       LEU  39  15.501  -8.115 -11.735
  305    HB2  LEU  39           HB2      LEU  39  16.756  -8.899 -13.688
  306    HB3  LEU  39           HB3      LEU  39  18.209  -8.060 -13.149
  307    HG   LEU  39           HG       LEU  39  18.062 -10.588 -12.931
  308   HD11  LEU  39          1HD1      LEU  39  18.826  -9.026 -10.448
  309   HD12  LEU  39          2HD1      LEU  39  19.430 -10.629 -10.941
  310   HD13  LEU  39          3HD1      LEU  39  19.826  -9.203 -11.920
  311   HD21  LEU  39          3HD2      LEU  39  15.838 -10.714 -11.849
  312   HD22  LEU  39          1HD2      LEU  39  17.119 -11.520 -10.919
  313   HD23  LEU  39          2HD2      LEU  39  16.526  -9.924 -10.401
  314    H    MET  40           H        MET  40  15.755  -8.004  -9.523
  315    HA   MET  40           HA       MET  40  17.606  -5.920  -8.548
  316    HB2  MET  40           HB2      MET  40  15.566  -7.554  -6.998
  317    HB3  MET  40           HB3      MET  40  16.436  -6.153  -6.418
  318    HG2  MET  40           HG2      MET  40  13.945  -6.334  -7.870
  319    HG3  MET  40           HG3      MET  40  14.637  -4.943  -7.060
  320    HE1  MET  40           HE3      MET  40  15.780  -2.873  -8.412
  321    HE2  MET  40           HE1      MET  40  17.082  -4.073  -8.520
  322    HE3  MET  40           HE2      MET  40  16.566  -3.180  -9.982
  323    H    LYS  41           H        LYS  41  19.408  -6.284  -7.315
  324    HA   LYS  41           HA       LYS  41  19.687  -8.877  -6.030
  325    HB2  LYS  41           HB2      LYS  41  22.186  -8.851  -7.045
  326    HB3  LYS  41           HB3      LYS  41  20.854  -9.756  -7.754
  327    HG2  LYS  41           HG2      LYS  41  20.438  -8.096  -9.402
  328    HG3  LYS  41           HG3      LYS  41  21.561  -6.937  -8.638
  329    HD2  LYS  41           2HD      LYS  41  23.443  -8.485  -9.104
  330    HD3  LYS  41           3HD      LYS  41  22.310  -9.631  -9.855
  331    HE2  LYS  41           HE2      LYS  41  21.674  -7.909 -11.521
  332    HE3  LYS  41           HE3      LYS  41  22.805  -6.767 -10.779
  333    HZ1  LYS  41           3HZ      LYS  41  23.554  -9.337 -12.008
  334    HZ2  LYS  41           1HZ      LYS  41  23.745  -7.859 -12.697
  335    HZ3  LYS  41           2HZ      LYS  41  24.596  -8.248 -11.345
  336    H    ASP  42           H        ASP  42  21.335  -9.030  -4.507
  337    HA   ASP  42           HA       ASP  42  21.727  -6.758  -2.873
  338    HB2  ASP  42           HB2      ASP  42  21.736  -9.289  -2.366
  339    HB3  ASP  42           HB3      ASP  42  23.419  -9.262  -2.907
  340    H    ARG  43           H        ARG  43  23.790  -5.811  -2.189
  341    HA   ARG  43           HA       ARG  43  25.462  -5.242  -4.567
  342    HB2  ARG  43           HB2      ARG  43  24.225  -3.428  -3.365
  343    HB3  ARG  43           HB3      ARG  43  25.238  -3.724  -1.942
  344    HG2  ARG  43           HG2      ARG  43  27.255  -3.138  -3.233
  345    HG3  ARG  43           HG3      ARG  43  26.280  -2.967  -4.710
  346    HD2  ARG  43           2HD      ARG  43  25.001  -1.131  -3.638
  347    HD3  ARG  43           3HD      ARG  43  25.969  -1.319  -2.167
  348    HE   ARG  43           HE       ARG  43  27.779  -0.275  -3.196
  349   HH11  ARG  43          1HH1      ARG  43  25.224  -0.876  -5.572
  350   HH12  ARG  43          2HH1      ARG  43  25.959   0.147  -6.788
  351   HH21  ARG  43          1HH2      ARG  43  28.704   1.048  -4.799
  352   HH22  ARG  43          2HH2      ARG  43  27.922   1.229  -6.354
  353    H    GLU  44           H        GLU  44  25.569  -7.168  -1.783
  354    HA   GLU  44           HA       GLU  44  28.552  -7.043  -1.695
  355    HB2  GLU  44           HB2      GLU  44  26.555  -7.893   0.427
  356    HB3  GLU  44           HB3      GLU  44  28.319  -7.980   0.582
  357    HG2  GLU  44           HG2      GLU  44  28.460  -5.523   0.225
  358    HG3  GLU  44           HG3      GLU  44  26.694  -5.438   0.143
  359    H    THR  45           H        THR  45  25.848  -8.984  -2.601
  360    HA   THR  45           HA       THR  45  27.708 -11.301  -2.926
  361    HB   THR  45           HB       THR  45  25.870 -12.830  -2.595
  362    HG1  THR  45           1HG      THR  45  23.819 -11.982  -2.012
  363   HG21  THR  45          1HG2      THR  45  27.030 -11.948  -0.571
  364   HG22  THR  45          HG22      THR  45  25.719 -10.737  -0.409
  365   HG23  THR  45          HG32      THR  45  25.349 -12.479  -0.270
  366    H    ASN  46           H        ASN  46  25.595  -9.002  -4.384
  367    HA   ASN  46           HA       ASN  46  24.807  -8.775  -6.498
  368    HB2  ASN  46           HB2      ASN  46  27.116 -10.663  -6.996
  369    HB3  ASN  46           HB3      ASN  46  26.193  -9.899  -8.308
  370   HD21  ASN  46          2HD2      ASN  46  28.755  -9.360  -8.433
  371   HD22  ASN  46          1HD2      ASN  46  29.135  -7.757  -7.823
  372    H    LYS  47           H        LYS  47  24.009 -11.258  -4.696
  373    HA   LYS  47           HA       LYS  47  22.793 -12.996  -6.714
  374    HB2  LYS  47           HB2      LYS  47  22.730 -12.857  -3.682
  375    HB3  LYS  47           HB3      LYS  47  21.682 -13.958  -4.582
  376    HG2  LYS  47           HG2      LYS  47  24.674 -13.876  -5.033
  377    HG3  LYS  47           HG3      LYS  47  23.931 -14.908  -3.779
  378    HD2  LYS  47           2HD      LYS  47  22.515 -15.951  -5.576
  379    HD3  LYS  47           3HD      LYS  47  23.430 -15.013  -6.782
  380    HE2  LYS  47           HE2      LYS  47  25.535 -16.048  -5.966
  381    HE3  LYS  47           HE3      LYS  47  24.605 -16.988  -4.789
  382    HZ1  LYS  47           3HZ      LYS  47  23.430 -17.990  -6.667
  383    HZ2  LYS  47           1HZ      LYS  47  24.360 -17.151  -7.724
  384    HZ3  LYS  47           2HZ      LYS  47  25.044 -18.284  -6.743
  385    H    SER  48           H        SER  48  20.695 -13.129  -7.226
  386    HA   SER  48           HA       SER  48  19.192 -10.770  -7.370
  387    HB2  SER  48           HB2      SER  48  18.170 -13.622  -7.499
  388    HB3  SER  48           HB3      SER  48  17.373 -12.170  -8.163
  389    HG   SER  48           HG       SER  48  18.651 -13.307  -9.732
  390    H    ARG  49           H        ARG  49  17.535  -9.863  -6.218
  391    HA   ARG  49           HA       ARG  49  17.364 -10.594  -3.413
  392    HB2  ARG  49           HB2      ARG  49  15.827  -8.485  -4.977
  393    HB3  ARG  49           HB3      ARG  49  15.936  -8.625  -3.205
  394    HG2  ARG  49           HG2      ARG  49  18.602  -8.549  -4.041
  395    HG3  ARG  49           HG3      ARG  49  17.801  -7.453  -5.167
  396    HD2  ARG  49           2HD      ARG  49  17.607  -7.291  -2.141
  397    HD3  ARG  49           3HD      ARG  49  18.680  -6.312  -3.156
  398    HE   ARG  49           HE       ARG  49  16.695  -5.304  -4.202
  399   HH11  ARG  49          1HH1      ARG  49  16.163  -6.994  -1.130
  400   HH12  ARG  49          2HH1      ARG  49  14.739  -6.053  -0.746
  401   HH21  ARG  49          1HH2      ARG  49  14.951  -4.088  -3.654
  402   HH22  ARG  49          2HH2      ARG  49  14.014  -4.405  -2.205
  403    H    GLY  50           H        GLY  50  16.072 -12.001  -6.032
  404    HA2  GLY  50           2HA      GLY  50  14.560 -13.755  -6.038
  405    HA3  GLY  50           3HA      GLY  50  13.899 -13.221  -4.483
  406    H    PHE  51           H        PHE  51  14.011 -10.455  -6.420
  407    HA   PHE  51           HA       PHE  51  11.555 -11.136  -7.910
  408    HB2  PHE  51           HB2      PHE  51  10.280  -9.346  -7.103
  409    HB3  PHE  51           HB3      PHE  51  10.849 -10.238  -5.704
  410    HD1  PHE  51           HD2      PHE  51  12.786  -9.260  -4.333
  411    HD2  PHE  51           HD1      PHE  51  10.747  -7.066  -7.420
  412    HE1  PHE  51           HE2      PHE  51  13.580  -7.127  -3.351
  413    HE2  PHE  51           HE1      PHE  51  11.503  -4.932  -6.399
  414    HZ   PHE  51           HZ       PHE  51  12.925  -4.957  -4.395
  415    H    ALA  52           H        ALA  52  11.008  -9.533  -9.548
  416    HA   ALA  52           HA       ALA  52  13.148  -7.697 -10.394
  417    HB1  ALA  52           1HB      ALA  52  12.317 -10.151 -12.009
  418    HB2  ALA  52           HB2      ALA  52  13.462  -8.901 -12.531
  419    HB3  ALA  52           HB3      ALA  52  13.874  -9.961 -11.161
  420    H    PHE  53           H        PHE  53  12.487  -6.968 -12.796
  421    HA   PHE  53           HA       PHE  53   9.548  -6.788 -13.047
  422    HB2  PHE  53           HB2      PHE  53  11.379  -4.344 -13.041
  423    HB3  PHE  53           HB3      PHE  53   9.672  -4.332 -13.389
  424    HD1  PHE  53           HD1      PHE  53  12.233  -5.023 -10.792
  425    HD2  PHE  53           HD2      PHE  53   8.100  -4.170 -11.591
  426    HE1  PHE  53           HE1      PHE  53  11.837  -4.747  -8.374
  427    HE2  PHE  53           HE2      PHE  53   7.683  -3.907  -9.156
  428    HZ   PHE  53           HZ       PHE  53   9.546  -4.232  -7.539
  429    H    VAL  54           H        VAL  54   8.898  -5.970 -15.214
  430    HA   VAL  54           HA       VAL  54  10.985  -5.875 -17.273
  431    HB   VAL  54           HB       VAL  54  10.598  -8.305 -17.125
  432   HG11  VAL  54          1HG1      VAL  54   7.707  -7.805 -17.438
  433   HG12  VAL  54          HG21      VAL  54   8.604  -9.365 -17.385
  434   HG13  VAL  54          HG31      VAL  54   8.612  -8.299 -15.952
  435   HG21  VAL  54          HG32      VAL  54   9.852  -8.765 -19.393
  436   HG22  VAL  54          1HG2      VAL  54   8.932  -7.247 -19.465
  437   HG23  VAL  54          HG22      VAL  54  10.701  -7.203 -19.463
  438    H    THR  55           H        THR  55  10.353  -4.621 -18.984
  439    HA   THR  55           HA       THR  55   7.532  -3.652 -18.924
  440    HB   THR  55           HB       THR  55   9.963  -2.233 -20.061
  441    HG1  THR  55           1HG      THR  55  10.026  -2.346 -17.795
  442   HG21  THR  55          1HG2      THR  55   7.851  -1.592 -21.136
  443   HG22  THR  55          HG22      THR  55   7.063  -1.409 -19.557
  444   HG23  THR  55          HG32      THR  55   8.367  -0.297 -20.036
  445    H    PHE  56           H        PHE  56   6.299  -4.362 -20.461
  446    HA   PHE  56           HA       PHE  56   7.407  -5.383 -22.993
  447    HB2  PHE  56           HB2      PHE  56   4.655  -5.307 -21.712
  448    HB3  PHE  56           HB3      PHE  56   4.934  -5.887 -23.349
  449    HD1  PHE  56           HD1      PHE  56   6.359  -6.523 -19.867
  450    HD2  PHE  56           HD2      PHE  56   5.161  -8.093 -23.694
  451    HE1  PHE  56           HE1      PHE  56   6.890  -8.804 -19.099
  452    HE2  PHE  56           HE2      PHE  56   5.621 -10.380 -22.896
  453    HZ   PHE  56           HZ       PHE  56   6.436 -10.754 -20.585
  454    H    GLU  57           H        GLU  57   6.663  -4.596 -25.065
  455    HA   GLU  57           HA       GLU  57   6.194  -1.722 -25.116
  456    HB2  GLU  57           HB2      GLU  57   7.126  -3.739 -26.899
  457    HB3  GLU  57           HB3      GLU  57   5.700  -3.031 -27.650
  458    HG2  GLU  57           HG2      GLU  57   6.611  -0.748 -27.321
  459    HG3  GLU  57           HG3      GLU  57   8.071  -1.433 -26.594
  460    H    SER  58           H        SER  58   4.189  -4.658 -25.168
  461    HA   SER  58           HA       SER  58   1.874  -2.867 -25.686
  462    HB2  SER  58           HB2      SER  58   2.036  -4.565 -27.389
  463    HB3  SER  58           HB3      SER  58   2.266  -5.830 -26.167
  464    HG   SER  58           HG       SER  58   0.077  -5.670 -26.940
  465    HA   PRO  59           HA       PRO  59   1.027  -3.617 -21.437
  466    HB2  PRO  59           HB2      PRO  59  -1.410  -2.491 -21.204
  467    HB3  PRO  59           HB3      PRO  59   0.014  -1.484 -21.662
  468    HG2  PRO  59           HG2      PRO  59  -1.992  -2.825 -23.506
  469    HG3  PRO  59           HG3      PRO  59  -1.584  -1.079 -23.448
  470    HD2  PRO  59           2HD      PRO  59  -0.328  -2.743 -25.199
  471    HD3  PRO  59           3HD      PRO  59   0.614  -1.493 -24.327
  472    H    ALA  60           H        ALA  60  -0.320  -5.277 -24.029
  473    HA   ALA  60           HA       ALA  60  -1.932  -6.979 -22.189
  474    HB1  ALA  60           1HB      ALA  60  -3.338  -5.842 -23.819
  475    HB2  ALA  60           HB2      ALA  60  -2.343  -6.477 -25.158
  476    HB3  ALA  60           HB3      ALA  60  -3.293  -7.587 -24.140
  477    H    ASP  61           H        ASP  61   0.822  -6.820 -24.331
  478    HA   ASP  61           HA       ASP  61   1.090  -9.698 -24.627
  479    HB2  ASP  61           HB2      ASP  61   3.094  -7.390 -24.681
  480    HB3  ASP  61           HB3      ASP  61   3.548  -9.017 -24.916
  481    H    ALA  62           H        ALA  62   1.755  -7.241 -22.197
  482    HA   ALA  62           HA       ALA  62   3.272  -8.968 -20.435
  483    HB1  ALA  62           1HB      ALA  62   3.521  -6.550 -20.366
  484    HB2  ALA  62           HB2      ALA  62   1.789  -6.337 -20.028
  485    HB3  ALA  62           HB3      ALA  62   2.830  -7.119 -18.816
  486    H    LYS  63           H        LYS  63  -0.175  -8.181 -20.947
  487    HA   LYS  63           HA       LYS  63  -1.093  -9.421 -18.502
  488    HB2  LYS  63           HB2      LYS  63  -2.478  -8.864 -21.156
  489    HB3  LYS  63           HB3      LYS  63  -3.301  -9.437 -19.690
  490    HG2  LYS  63           HG2      LYS  63  -2.616  -7.440 -18.457
  491    HG3  LYS  63           HG3      LYS  63  -1.645  -6.898 -19.834
  492    HD2  LYS  63           2HD      LYS  63  -3.747  -5.640 -19.737
  493    HD3  LYS  63           3HD      LYS  63  -3.705  -6.623 -21.197
  494    HE2  LYS  63           HE2      LYS  63  -5.091  -8.358 -20.079
  495    HE3  LYS  63           HE3      LYS  63  -5.104  -7.393 -18.598
  496    HZ1  LYS  63           3HZ      LYS  63  -6.234  -5.658 -19.808
  497    HZ2  LYS  63           1HZ      LYS  63  -6.211  -6.545 -21.192
  498    HZ3  LYS  63           2HZ      LYS  63  -7.092  -7.053 -19.897
  499    H    ASP  64           H        ASP  64  -0.454 -10.512 -21.849
  500    HA   ASP  64           HA       ASP  64  -1.656 -13.091 -21.502
  501    HB2  ASP  64           HB2      ASP  64  -1.083 -11.853 -23.658
  502    HB3  ASP  64           HB3      ASP  64   0.611 -12.237 -23.345
  503    H    ALA  65           H        ALA  65   1.550 -11.738 -20.854
  504    HA   ALA  65           HA       ALA  65   2.733 -14.307 -20.176
  505    HB1  ALA  65           1HB      ALA  65   3.596 -11.521 -19.292
  506    HB2  ALA  65           HB2      ALA  65   4.584 -13.005 -19.333
  507    HB3  ALA  65           HB3      ALA  65   4.041 -12.245 -20.847
  508    H    ALA  66           H        ALA  66   1.248 -11.588 -18.346
  509    HA   ALA  66           HA       ALA  66   1.796 -12.777 -15.794
  510    HB1  ALA  66           1HB      ALA  66   1.509 -10.318 -16.258
  511    HB2  ALA  66           HB2      ALA  66  -0.198 -10.606 -16.615
  512    HB3  ALA  66           HB3      ALA  66   0.422 -10.893 -14.968
  513    H    ARG  67           H        ARG  67  -0.531 -13.470 -18.191
  514    HA   ARG  67           HA       ARG  67  -2.321 -14.862 -16.276
  515    HB2  ARG  67           HB2      ARG  67  -2.483 -14.244 -19.244
  516    HB3  ARG  67           HB3      ARG  67  -3.660 -15.257 -18.391
  517    HG2  ARG  67           HG2      ARG  67  -4.226 -13.446 -16.874
  518    HG3  ARG  67           HG3      ARG  67  -3.019 -12.378 -17.584
  519    HD2  ARG  67           2HD      ARG  67  -5.409 -13.574 -19.039
  520    HD3  ARG  67           3HD      ARG  67  -5.288 -11.902 -18.428
  521    HE   ARG  67           HE       ARG  67  -3.081 -12.331 -20.109
  522   HH11  ARG  67          1HH1      ARG  67  -6.603 -12.208 -20.374
  523   HH12  ARG  67          2HH1      ARG  67  -6.578 -11.628 -22.024
  524   HH21  ARG  67          1HH2      ARG  67  -3.086 -11.562 -22.282
  525   HH22  ARG  67          2HH2      ARG  67  -4.606 -11.278 -23.095
  526    H    ASP  68           H        ASP  68   0.641 -15.686 -17.557
  527    HA   ASP  68           HA       ASP  68  -0.225 -18.478 -18.183
  528    HB2  ASP  68           HB2      ASP  68   1.414 -16.416 -19.593
  529    HB3  ASP  68           HB3      ASP  68   2.198 -17.942 -19.410
  530    H    MET  69           H        MET  69   2.405 -16.262 -17.379
  531    HA   MET  69           HA       MET  69   4.090 -18.311 -16.207
  532    HB2  MET  69           HB2      MET  69   4.203 -15.411 -17.028
  533    HB3  MET  69           HB3      MET  69   5.283 -15.926 -15.783
  534    HG2  MET  69           HG2      MET  69   5.579 -17.994 -17.601
  535    HG3  MET  69           HG3      MET  69   5.151 -16.645 -18.663
  536    HE1  MET  69           HE3      MET  69   8.706 -16.846 -15.754
  537    HE2  MET  69           HE1      MET  69   6.968 -16.998 -15.358
  538    HE3  MET  69           HE2      MET  69   7.775 -18.267 -16.302
  539    H    ASN  70           H        ASN  70   1.549 -16.308 -14.980
  540    HA   ASN  70           HA       ASN  70   2.748 -15.836 -12.390
  541    HB2  ASN  70           HB2      ASN  70   0.923 -14.442 -13.322
  542    HB3  ASN  70           HB3      ASN  70  -0.165 -15.830 -13.267
  543   HD21  ASN  70          2HD2      ASN  70  -1.471 -14.320 -11.906
  544   HD22  ASN  70          1HD2      ASN  70  -1.112 -14.235 -10.192
  545    H    GLY  71           H        GLY  71   3.271 -17.422 -11.035
  546    HA2  GLY  71           2HA      GLY  71   2.607 -19.062  -9.445
  547    HA3  GLY  71           3HA      GLY  71   1.310 -19.592 -10.533
  548    H    LYS  72           H        LYS  72   3.807 -19.231 -12.656
  549    HA   LYS  72           HA       LYS  72   4.634 -22.017 -12.631
  550    HB2  LYS  72           HB2      LYS  72   5.526 -19.636 -14.266
  551    HB3  LYS  72           HB3      LYS  72   5.747 -21.344 -14.646
  552    HG2  LYS  72           HG2      LYS  72   3.062 -19.917 -14.548
  553    HG3  LYS  72           HG3      LYS  72   3.937 -20.450 -15.996
  554    HD2  LYS  72           2HD      LYS  72   3.777 -22.813 -15.193
  555    HD3  LYS  72           3HD      LYS  72   2.829 -22.244 -13.794
  556    HE2  LYS  72           HE2      LYS  72   1.130 -21.308 -15.327
  557    HE3  LYS  72           HE3      LYS  72   2.072 -21.879 -16.717
  558    HZ1  LYS  72           3HZ      LYS  72   1.763 -24.118 -15.930
  559    HZ2  LYS  72           1HZ      LYS  72   0.910 -23.597 -14.625
  560    HZ3  LYS  72           2HZ      LYS  72   0.302 -23.394 -16.138
  561    H    SER  73           H        SER  73   7.242 -21.360 -13.645
  562    HA   SER  73           HA       SER  73   8.697 -20.497 -11.181
  563    HB2  SER  73           HB2      SER  73   8.150 -22.915 -11.118
  564    HB3  SER  73           HB3      SER  73   8.995 -23.146 -12.658
  565    HG   SER  73           HG       SER  73  10.314 -23.614 -10.834
  566    H    LEU  74           H        LEU  74  10.878 -20.190 -11.393
  567    HA   LEU  74           HA       LEU  74  11.876 -19.826 -14.170
  568    HB2  LEU  74           HB2      LEU  74  11.165 -17.668 -12.490
  569    HB3  LEU  74           HB3      LEU  74  12.841 -17.877 -12.170
  570    HG   LEU  74           HG       LEU  74  12.711 -16.305 -13.909
  571   HD11  LEU  74          1HD1      LEU  74  14.503 -17.950 -14.304
  572   HD12  LEU  74          2HD1      LEU  74  13.395 -18.901 -15.337
  573   HD13  LEU  74          3HD1      LEU  74  13.865 -17.261 -15.811
  574   HD21  LEU  74          3HD2      LEU  74  11.436 -16.706 -15.986
  575   HD22  LEU  74          1HD2      LEU  74  10.999 -18.337 -15.417
  576   HD23  LEU  74          2HD2      LEU  74  10.382 -16.896 -14.567
  577    H    ASP  75           H        ASP  75  13.788 -20.766 -14.407
  578    HA   ASP  75           HA       ASP  75  15.681 -21.864 -14.000
  579    HB2  ASP  75           HB2      ASP  75  16.050 -19.423 -12.864
  580    HB3  ASP  75           HB3      ASP  75  15.914 -20.288 -11.418
  581    H    GLY  76           H        GLY  76  13.273 -21.992 -11.544
  582    HA2  GLY  76           2HA      GLY  76  13.225 -24.591 -11.156
  583    HA3  GLY  76           3HA      GLY  76  14.632 -24.178 -10.148
  584    H    LYS  77           H        LYS  77  12.788 -21.448  -9.940
  585    HA   LYS  77           HA       LYS  77  11.545 -22.402  -7.412
  586    HB2  LYS  77           HB2      LYS  77  12.757 -19.676  -7.937
  587    HB3  LYS  77           HB3      LYS  77  12.130 -20.293  -6.400
  588    HG2  LYS  77           HG2      LYS  77  14.530 -21.371  -7.941
  589    HG3  LYS  77           HG3      LYS  77  14.604 -20.364  -6.485
  590    HD2  LYS  77           2HD      LYS  77  13.637 -22.107  -5.122
  591    HD3  LYS  77           3HD      LYS  77  13.258 -23.098  -6.539
  592    HE2  LYS  77           HE2      LYS  77  15.260 -23.965  -5.468
  593    HE3  LYS  77           HE3      LYS  77  15.632 -23.339  -7.078
  594    HZ1  LYS  77           3HZ      LYS  77  16.495 -21.354  -6.056
  595    HZ2  LYS  77           1HZ      LYS  77  16.090 -21.895  -4.554
  596    HZ3  LYS  77           2HZ      LYS  77  17.247 -22.670  -5.427
  597    H    ALA  78           H        ALA  78   9.474 -21.822  -7.007
  598    HA   ALA  78           HA       ALA  78   7.931 -21.003  -9.290
  599    HB1  ALA  78           1HB      ALA  78   7.102 -21.433  -6.404
  600    HB2  ALA  78           HB2      ALA  78   6.007 -21.286  -7.802
  601    HB3  ALA  78           HB3      ALA  78   7.129 -22.662  -7.695
  602    H    ILE  79           H        ILE  79   6.885 -19.134  -9.744
  603    HA   ILE  79           HA       ILE  79   7.657 -16.772  -8.094
  604    HB   ILE  79           HB       ILE  79   7.895 -15.519 -10.107
  605   HG12  ILE  79          HG21      ILE  79   7.023 -17.984 -11.671
  606   HG13  ILE  79          HG31      ILE  79   5.996 -16.584 -11.348
  607   HG21  ILE  79          1HG2      ILE  79   9.803 -16.969  -9.423
  608   HG22  ILE  79          HG22      ILE  79   9.220 -18.226 -10.543
  609   HG23  ILE  79          HG32      ILE  79   9.753 -16.653 -11.177
  610   HD11  ILE  79          3HD1      ILE  79   7.720 -15.129 -12.476
  611   HD12  ILE  79          1HD1      ILE  79   8.560 -16.613 -12.985
  612   HD13  ILE  79          2HD1      ILE  79   6.894 -16.285 -13.529
  613    H    LYS  80           H        LYS  80   6.459 -14.809  -8.767
  614    HA   LYS  80           HA       LYS  80   3.552 -15.225  -9.228
  615    HB2  LYS  80           HB2      LYS  80   4.197 -14.390  -6.895
  616    HB3  LYS  80           HB3      LYS  80   4.961 -13.004  -7.676
  617    HG2  LYS  80           HG2      LYS  80   2.716 -12.488  -8.771
  618    HG3  LYS  80           HG3      LYS  80   2.003 -13.734  -7.731
  619    HD2  LYS  80           2HD      LYS  80   2.804 -12.473  -5.733
  620    HD3  LYS  80           3HD      LYS  80   3.515 -11.250  -6.813
  621    HE2  LYS  80           HE2      LYS  80   1.223 -10.873  -7.787
  622    HE3  LYS  80           HE3      LYS  80   0.564 -11.976  -6.569
  623    HZ1  LYS  80           3HZ      LYS  80   1.427 -10.478  -4.873
  624    HZ2  LYS  80           1HZ      LYS  80   1.988  -9.456  -6.034
  625    HZ3  LYS  80           2HZ      LYS  80   0.376  -9.705  -5.873
  626    H    VAL  81           H        VAL  81   2.686 -13.859 -10.860
  627    HA   VAL  81           HA       VAL  81   4.486 -11.749 -11.910
  628    HB   VAL  81           HB       VAL  81   2.907 -13.663 -13.673
  629   HG11  VAL  81          1HG1      VAL  81   4.828 -11.376 -14.311
  630   HG12  VAL  81          HG21      VAL  81   4.064 -12.465 -15.501
  631   HG13  VAL  81          HG31      VAL  81   3.070 -11.347 -14.558
  632   HG21  VAL  81          HG32      VAL  81   5.906 -13.357 -13.184
  633   HG22  VAL  81          1HG2      VAL  81   4.903 -14.766 -12.760
  634   HG23  VAL  81          HG22      VAL  81   5.177 -14.342 -14.466
  635    H    GLU  82           H        GLU  82   3.500  -9.838 -12.204
  636    HA   GLU  82           HA       GLU  82   0.582  -9.621 -12.348
  637    HB2  GLU  82           HB2      GLU  82   1.106 -10.130  -9.933
  638    HB3  GLU  82           HB3      GLU  82   2.114  -8.678  -9.879
  639    HG2  GLU  82           HG2      GLU  82   0.149  -7.269 -10.298
  640    HG3  GLU  82           HG3      GLU  82  -0.856  -8.709 -10.547
  641    H    GLN  83           H        GLN  83  -0.042  -7.235 -12.509
  642    HA   GLN  83           HA       GLN  83   1.936  -5.728 -13.968
  643    HB2  GLN  83           HB2      GLN  83  -0.559  -5.607 -14.225
  644    HB3  GLN  83           HB3      GLN  83  -0.653  -4.774 -12.665
  645    HG2  GLN  83           HG2      GLN  83   0.979  -3.802 -15.063
  646    HG3  GLN  83           HG3      GLN  83  -0.692  -3.318 -14.755
  647   HE21  GLN  83          HE22      GLN  83   1.886  -1.748 -14.828
  648   HE22  GLN  83          HE12      GLN  83   1.949  -0.946 -13.279
  649    H    ALA  84           H        ALA  84   3.396  -4.196 -13.222
  650    HA   ALA  84           HA       ALA  84   4.095  -4.581 -10.437
  651    HB1  ALA  84           1HB      ALA  84   5.342  -2.824 -12.573
  652    HB2  ALA  84           HB2      ALA  84   6.082  -3.264 -11.015
  653    HB3  ALA  84           HB3      ALA  84   5.783  -4.518 -12.236
  654    H    THR  85           H        THR  85   4.288  -3.101  -8.781
  655    HA   THR  85           HA       THR  85   3.021  -0.440  -9.253
  656    HB   THR  85           HB       THR  85   2.532  -0.415  -6.863
  657    HG1  THR  85           1HG      THR  85   2.653  -2.453  -5.762
  658   HG21  THR  85          1HG2      THR  85   1.397  -2.862  -8.310
  659   HG22  THR  85          HG22      THR  85   0.644  -2.019  -6.935
  660   HG23  THR  85          HG32      THR  85   0.822  -1.193  -8.502
  661    H    LYS  86           H        LYS  86   3.803   1.172  -7.580
  662    HA   LYS  86           HA       LYS  86   6.588   1.573  -8.061
  663    HB2  LYS  86           HB2      LYS  86   4.585   2.973  -6.243
  664    HB3  LYS  86           HB3      LYS  86   6.210   3.586  -6.611
  665    HG2  LYS  86           HG2      LYS  86   5.625   3.429  -9.071
  666    HG3  LYS  86           HG3      LYS  86   3.967   3.021  -8.608
  667    HD2  LYS  86           2HD      LYS  86   3.816   5.209  -7.381
  668    HD3  LYS  86           3HD      LYS  86   5.447   5.609  -7.973
  669    HE2  LYS  86           HE2      LYS  86   4.617   5.242 -10.320
  670    HE3  LYS  86           HE3      LYS  86   2.995   4.985  -9.673
  671    HZ1  LYS  86           3HZ      LYS  86   4.575   7.456  -9.373
  672    HZ2  LYS  86           1HZ      LYS  86   3.309   7.242 -10.400
  673    HZ3  LYS  86           2HZ      LYS  86   3.060   7.216  -8.775
  674    HA   PRO  87           HA       PRO  87   8.576  -0.443  -4.741
  675    HB2  PRO  87           HB2      PRO  87  10.635   1.236  -4.091
  676    HB3  PRO  87           HB3      PRO  87  10.578   0.319  -5.616
  677    HG2  PRO  87           HG2      PRO  87   9.713   3.190  -5.162
  678    HG3  PRO  87           HG3      PRO  87  10.785   2.549  -6.457
  679    HD2  PRO  87           2HD      PRO  87   8.158   2.982  -6.918
  680    HD3  PRO  87           3HD      PRO  87   8.955   1.516  -7.570
  681    H    SER  88           H        SER  88   9.350  -0.105  -2.369
  682    HA   SER  88           HA       SER  88   7.147   1.438  -1.111
  683    HB2  SER  88           HB2      SER  88   8.530  -1.108  -0.183
  684    HB3  SER  88           HB3      SER  88   7.224  -0.270   0.680
  685    HG   SER  88           HG       SER  88   6.446  -1.962  -0.657
  686    H    PHE  89           H        PHE  89  10.424   1.890  -1.442
  687    HA   PHE  89           HA       PHE  89  11.165   2.539   1.244
  688    HB2  PHE  89           HB2      PHE  89  12.050   4.100  -1.187
  689    HB3  PHE  89           HB3      PHE  89  12.968   3.740   0.280
  690    HD1  PHE  89           HD1      PHE  89  11.814   2.570  -3.002
  691    HD2  PHE  89           HD2      PHE  89  14.095   1.533   0.509
  692    HE1  PHE  89           HE1      PHE  89  12.713   0.666  -4.177
  693    HE2  PHE  89           HE2      PHE  89  15.115  -0.367  -0.760
  694    HZ   PHE  89           HZ       PHE  89  14.331  -0.884  -3.030
  695    H    GLU  90           H        GLU  90   8.612   3.628  -0.421
  696    HA   GLU  90           HA       GLU  90   8.643   6.451   0.553
  697    HB2  GLU  90           HB2      GLU  90   7.263   6.832  -1.549
  698    HB3  GLU  90           HB3      GLU  90   8.989   6.476  -1.798
  699    HG2  GLU  90           HG2      GLU  90   8.557   4.211  -2.450
  700    HG3  GLU  90           HG3      GLU  90   6.859   4.331  -1.963
  701    H    SER  91           H        SER  91   7.275   3.509   1.230
  702    HA   SER  91           HA       SER  91   4.932   4.818   2.337
  703    HB2  SER  91           HB2      SER  91   4.706   4.668  -0.182
  704    HB3  SER  91           HB3      SER  91   4.453   2.920   0.019
  705    HG   SER  91           HG       SER  91   2.915   5.001   1.199
  706    H    GLY  92           H        GLY  92   7.057   2.155   2.213
  707    HA2  GLY  92           2HA      GLY  92   5.558   0.866   4.381
  708    HA3  GLY  92           3HA      GLY  92   5.704  -0.099   2.904
  709    H    ARG  93           H        ARG  93   8.467   1.859   3.198
  710    HA   ARG  93           HA       ARG  93   9.981   0.048   4.948
  711    HB2  ARG  93           HB2      ARG  93   9.999  -1.075   2.747
  712    HB3  ARG  93           HB3      ARG  93  10.570   0.415   1.979
  713    HG2  ARG  93           HG2      ARG  93  12.659   0.315   3.286
  714    HG3  ARG  93           HG3      ARG  93  12.078  -1.147   4.114
  715    HD2  ARG  93           2HD      ARG  93  12.017  -2.356   1.970
  716    HD3  ARG  93           3HD      ARG  93  12.471  -0.875   1.105
  717    HE   ARG  93           HE       ARG  93  14.416  -1.455   3.127
  718   HH11  ARG  93          1HH1      ARG  93  13.309  -2.671  -0.016
  719   HH12  ARG  93          2HH1      ARG  93  14.900  -3.235  -0.471
  720   HH21  ARG  93          1HH2      ARG  93  16.451  -2.244   2.504
  721   HH22  ARG  93          2HH2      ARG  93  16.663  -3.016   0.950
  722    H    ARG  94           H        ARG  94  11.919   1.015   5.671
  723    HA   ARG  94           HA       ARG  94  13.083   2.771   6.485
  724    HB2  ARG  94           HB2      ARG  94  14.012   2.371   4.171
  725    HB3  ARG  94           HB3      ARG  94  13.092   3.788   3.629
  726    HG2  ARG  94           HG2      ARG  94  14.347   5.220   5.193
  727    HG3  ARG  94           HG3      ARG  94  15.144   3.789   5.889
  728    HD2  ARG  94           2HD      ARG  94  16.631   4.935   4.309
  729    HD3  ARG  94           3HD      ARG  94  16.203   3.318   3.729
  730    HE   ARG  94           HE       ARG  94  14.523   5.528   2.737
  731   HH11  ARG  94          1HH1      ARG  94  17.327   3.457   2.165
  732   HH12  ARG  94          2HH1      ARG  94  17.302   3.689   0.432
  733   HH21  ARG  94          1HH2      ARG  94  14.531   5.851   0.472
  734   HH22  ARG  94          2HH2      ARG  94  15.727   5.045  -0.520
  735    H    GLY  95           H        GLY  95  10.223   3.044   6.672
  736    HA2  GLY  95           2HA      GLY  95   9.382   5.718   6.058
  737    HA3  GLY  95           3HA      GLY  95   8.604   4.590   7.191
  738    H5'    A  96           H5'        A  96   2.550 -10.583  -1.235
  739   H5''    A  96          H5''        A  96   2.533 -12.187  -1.970
  740    H4'    A  96           H4'        A  96   0.245 -10.151  -1.938
  741    H3'    A  96           H3'        A  96   1.041 -12.475  -0.283
  742    H2'    A  96           H2'        A  96  -0.891 -13.807  -0.613
  743   HO2'    A  96          HO2'        A  96  -2.418 -12.112  -0.294
  744    H1'    A  96           H1'        A  96  -1.303 -13.424  -3.232
  745    H8     A  96           H8         A  96   2.259 -13.227  -3.648
  746    H61    A  96           H61        A  96   2.796 -19.188  -2.004
  747    H62    A  96           H62        A  96   3.625 -17.823  -2.731
  748    H2     A  96           H2         A  96  -1.280 -17.820  -0.921
  749   HO5'    A  96          H5T         A  96   3.501 -10.551  -3.309
  750    H5'    U  97           H5'        U  97  -0.164 -13.810   3.485
  751   H5''    U  97          H5''        U  97   0.582 -12.385   4.204
  752    H4'    U  97           H4'        U  97   2.511 -13.423   4.412
  753    H3'    U  97           H3'        U  97   2.758 -12.958   1.727
  754    H2'    U  97           H2'        U  97   1.767 -14.810   0.762
  755   HO2'    U  97          HO2'        U  97   3.995 -15.220   0.384
  756    H1'    U  97           H1'        U  97   2.290 -16.884   2.745
  757    H3     U  97           H3         U  97  -1.853 -18.679   2.611
  758    H5     U  97           H5         U  97  -2.325 -14.961   0.712
  759    H6     U  97           H6         U  97  -0.025 -14.439   1.294
  760    H5'    C  98           H5'        C  98   4.534 -10.772   1.536
  761   H5''    C  98          H5''        C  98   4.764 -12.205   0.518
  762    H4'    C  98           H4'        C  98   6.836 -10.015   1.017
  763    H3'    C  98           H3'        C  98   4.634  -9.574  -0.486
  764    H2'    C  98           H2'        C  98   4.695 -11.733  -1.555
  765   HO2'    C  98          HO2'        C  98   5.987  -9.858  -3.265
  766    H1'    C  98           H1'        C  98   7.581 -11.353  -2.302
  767    H41    C  98           H41        C  98   6.548 -17.499  -3.634
  768    H42    C  98           H42        C  98   6.079 -17.817  -1.972
  769    H5     C  98           H5         C  98   5.887 -16.060  -0.295
  770    H6     C  98           H6         C  98   6.132 -13.669   0.102
  771    H5'    A  99           H5'        A  99   8.754  -8.059  -2.200
  772   H5''    A  99          H5''        A  99   9.433  -6.900  -1.046
  773    H4'    A  99           H4'        A  99  10.270  -6.466  -3.316
  774    H3'    A  99           H3'        A  99   9.052  -4.464  -1.692
  775    H2'    A  99           H2'        A  99   7.213  -4.137  -3.130
  776   HO2'    A  99          HO2'        A  99   8.840  -2.307  -3.397
  777    H1'    A  99           H1'        A  99   8.995  -4.873  -5.461
  778    H8     A  99           H8         A  99   7.368  -3.608  -7.022
  779    H61    A  99           H61        A  99   1.892  -6.542  -7.314
  780    H62    A  99           H62        A  99   2.886  -5.302  -8.053
  781    H2     A  99           H2         A  99   4.104  -8.068  -3.786
  782    H5'    A 100           H5'        A 100  11.890  -1.252  -4.721
  783   H5''    A 100          H5''        A 100  11.362  -2.914  -5.038
  784    H4'    A 100           H4'        A 100  13.964  -3.402  -5.167
  785    H3'    A 100           H3'        A 100  14.479  -0.798  -4.911
  786    H2'    A 100           H2'        A 100  12.560  -0.112  -6.129
  787   HO2'    A 100          HO2'        A 100  14.362   1.068  -6.941
  788    H1'    A 100           H1'        A 100  13.326  -1.785  -8.504
  789    H8     A 100           H8         A 100  10.173  -1.850  -6.152
  790    H61    A 100           H61        A 100   7.167  -0.020 -11.261
  791    H62    A 100           H62        A 100   6.995  -0.498  -9.579
  792    H2     A 100           H2         A 100  11.499  -0.323 -12.228
  793    H5'    A 101           H5'        A 101  16.342   0.135  -4.796
  794   H5''    A 101          H5''        A 101  17.900  -0.262  -5.585
  795    H4'    A 101           H4'        A 101  18.897  -0.475  -3.305
  796    H3'    A 101           H3'        A 101  16.272  -0.343  -2.490
  797   HO3'    A 101          H3T         A 101  18.606   0.208  -0.945
  798    H2'    A 101           H2'        A 101  15.810   1.895  -2.023
  799   HO2'    A 101          HO2'        A 101  17.223   1.636  -0.140
  800    H1'    A 101           H1'        A 101  17.944   3.330  -2.934
  801    H8     A 101           H8         A 101  16.869   1.570  -5.978
  802    H61    A 101           H61        A 101  11.839   5.211  -6.043
  803    H62    A 101           H62        A 101  12.817   4.112  -7.004
  804    H2     A 101           H2         A 101  13.713   5.519  -2.048
  Start of MODEL   15
    1    H1   MET   1           H1       MET   1   2.573   5.928  -3.500
    2    H2   MET   1           H2       MET   1   3.669   6.222  -2.311
    3    H3   MET   1           H3       MET   1   2.061   6.170  -1.956
    4    HA   MET   1           HA       MET   1   3.675   3.930  -2.930
    5    HB2  MET   1           HB2      MET   1   3.344   2.980  -0.630
    6    HB3  MET   1           HB3      MET   1   4.284   4.479  -0.636
    7    HG2  MET   1           HG2      MET   1   2.796   4.767   1.140
    8    HG3  MET   1           HG3      MET   1   2.090   5.707  -0.178
    9    HE1  MET   1           HE1      MET   1  -0.252   5.962   0.738
   10    HE2  MET   1           HE2      MET   1  -0.288   5.484  -0.979
   11    HE3  MET   1           HE3      MET   1  -1.438   4.765   0.170
   12    H    VAL   2           H        VAL   2   2.543   1.782  -2.488
   13    HA   VAL   2           HA       VAL   2   1.175   0.493  -3.643
   14    HB   VAL   2           HB       VAL   2  -0.033   0.657  -1.504
   15   HG11  VAL   2          1HG1      VAL   2  -0.903   2.975  -1.537
   16   HG12  VAL   2          HG21      VAL   2  -1.889   2.594  -2.972
   17   HG13  VAL   2          HG31      VAL   2  -2.215   1.794  -1.424
   18   HG21  VAL   2          HG32      VAL   2  -2.040  -0.411  -2.459
   19   HG22  VAL   2          1HG2      VAL   2  -1.667   0.323  -4.044
   20   HG23  VAL   2          HG22      VAL   2  -0.558  -0.872  -3.349
   21    H    GLU   3           H        GLU   3   2.200   2.352  -5.175
   22    HA   GLU   3           HA       GLU   3  -0.085   3.493  -6.611
   23    HB2  GLU   3           HB2      GLU   3   2.915   4.057  -6.757
   24    HB3  GLU   3           HB3      GLU   3   1.749   4.858  -7.811
   25    HG2  GLU   3           HG2      GLU   3   1.727   5.040  -4.773
   26    HG3  GLU   3           HG3      GLU   3   2.506   6.197  -5.851
   27    H    ALA   4           H        ALA   4  -0.619   2.819  -8.660
   28    HA   ALA   4           HA       ALA   4   0.998   0.576  -9.781
   29    HB1  ALA   4           1HB      ALA   4  -1.923   1.347 -10.150
   30    HB2  ALA   4           HB2      ALA   4  -1.111  -0.072 -10.864
   31    HB3  ALA   4           HB3      ALA   4  -1.299   0.060  -9.099
   32    H    ASP   5           H        ASP   5   2.451   1.424 -11.054
   33    HA   ASP   5           HA       ASP   5   2.104   3.798 -12.619
   34    HB2  ASP   5           HB2      ASP   5   4.254   2.981 -11.732
   35    HB3  ASP   5           HB3      ASP   5   4.158   1.564 -12.776
   36    H    ARG   6           H        ARG   6   2.661   3.636 -15.098
   37    HA   ARG   6           HA       ARG   6   0.326   2.800 -16.338
   38    HB2  ARG   6           HB2      ARG   6   1.470   3.281 -18.448
   39    HB3  ARG   6           HB3      ARG   6   1.861   4.492 -17.215
   40    HG2  ARG   6           HG2      ARG   6   4.015   3.315 -16.761
   41    HG3  ARG   6           HG3      ARG   6   3.613   2.121 -18.016
   42    HD2  ARG   6           2HD      ARG   6   5.121   3.797 -18.934
   43    HD3  ARG   6           3HD      ARG   6   3.533   3.912 -19.707
   44    HE   ARG   6           HE       ARG   6   3.223   6.015 -18.785
   45   HH11  ARG   6          1HH1      ARG   6   6.013   4.469 -17.241
   46   HH12  ARG   6          2HH1      ARG   6   6.516   5.932 -16.427
   47   HH21  ARG   6          1HH2      ARG   6   3.920   7.902 -17.723
   48   HH22  ARG   6          2HH2      ARG   6   5.336   7.867 -16.697
   49    HA   PRO   7           HA       PRO   7   0.316  -1.488 -17.299
   50    HB2  PRO   7           HB2      PRO   7  -0.110  -0.431 -20.093
   51    HB3  PRO   7           HB3      PRO   7  -0.979  -1.794 -19.314
   52    HG2  PRO   7           HG2      PRO   7  -2.129   0.607 -19.488
   53    HG3  PRO   7           HG3      PRO   7  -2.148  -0.216 -17.879
   54    HD2  PRO   7           2HD      PRO   7  -0.306   1.981 -18.864
   55    HD3  PRO   7           3HD      PRO   7  -1.116   1.809 -17.275
   56    H    GLY   8           H        GLY   8   1.593  -3.162 -18.285
   57    HA2  GLY   8           2HA      GLY   8   2.999  -3.934 -20.043
   58    HA3  GLY   8           3HA      GLY   8   3.655  -2.292 -20.229
   59    H    LYS   9           H        LYS   9   3.631  -2.281 -17.022
   60    HA   LYS   9           HA       LYS   9   6.322  -3.530 -16.918
   61    HB2  LYS   9           HB2      LYS   9   6.229  -1.182 -16.264
   62    HB3  LYS   9           HB3      LYS   9   5.062  -1.585 -14.974
   63    HG2  LYS   9           HG2      LYS   9   6.679  -3.154 -13.970
   64    HG3  LYS   9           HG3      LYS   9   7.825  -2.865 -15.296
   65    HD2  LYS   9           2HD      LYS   9   6.865  -0.749 -13.336
   66    HD3  LYS   9           3HD      LYS   9   8.381  -1.659 -13.183
   67    HE2  LYS   9           HE2      LYS   9   7.622   0.085 -15.569
   68    HE3  LYS   9           HE3      LYS   9   8.651   0.612 -14.234
   69    HZ1  LYS   9           3HZ      LYS   9   9.250  -1.589 -16.100
   70    HZ2  LYS   9           1HZ      LYS   9   9.989  -0.129 -16.045
   71    HZ3  LYS   9           2HZ      LYS   9  10.174  -1.178 -14.798
   72    H    LEU  10           H        LEU  10   6.658  -5.351 -15.825
   73    HA   LEU  10           HA       LEU  10   4.387  -6.402 -14.187
   74    HB2  LEU  10           HB2      LEU  10   6.512  -7.777 -15.834
   75    HB3  LEU  10           HB3      LEU  10   5.419  -8.658 -14.818
   76    HG   LEU  10           HG       LEU  10   4.634  -6.966 -17.236
   77   HD11  LEU  10          1HD1      LEU  10   4.396  -9.959 -16.669
   78   HD12  LEU  10          2HD1      LEU  10   4.155  -9.140 -18.230
   79   HD13  LEU  10          3HD1      LEU  10   5.783  -9.246 -17.503
   80   HD21  LEU  10          3HD2      LEU  10   2.904  -8.566 -15.310
   81   HD22  LEU  10          1HD2      LEU  10   2.829  -6.809 -15.635
   82   HD23  LEU  10          2HD2      LEU  10   2.376  -7.978 -16.900
   83    H    PHE  11           H        PHE  11   4.860  -7.527 -12.307
   84    HA   PHE  11           HA       PHE  11   7.561  -7.099 -11.121
   85    HB2  PHE  11           HB2      PHE  11   5.829  -6.069  -9.791
   86    HB3  PHE  11           HB3      PHE  11   4.794  -7.499  -9.930
   87    HD1  PHE  11           HD1      PHE  11   8.118  -6.396  -8.606
   88    HD2  PHE  11           HD2      PHE  11   4.871  -9.200  -8.320
   89    HE1  PHE  11           HE1      PHE  11   9.101  -7.325  -6.529
   90    HE2  PHE  11           HE2      PHE  11   5.879 -10.146  -6.250
   91    HZ   PHE  11           HZ       PHE  11   7.998  -9.196  -5.362
   92    H    ILE  12           H        ILE  12   8.773  -8.886 -10.763
   93    HA   ILE  12           HA       ILE  12   7.471 -11.527 -11.233
   94    HB   ILE  12           HB       ILE  12  10.347 -10.911 -11.909
   95   HG12  ILE  12          HG21      ILE  12   9.182  -9.261 -13.238
   96   HG13  ILE  12          HG31      ILE  12   9.821 -10.560 -14.236
   97   HG21  ILE  12          1HG2      ILE  12   8.303 -12.921 -12.928
   98   HG22  ILE  12          HG22      ILE  12  10.000 -12.817 -13.439
   99   HG23  ILE  12          HG32      ILE  12   9.594 -13.247 -11.754
  100   HD11  ILE  12          3HD1      ILE  12   7.673  -9.958 -15.068
  101   HD12  ILE  12          1HD1      ILE  12   7.507 -11.562 -14.329
  102   HD13  ILE  12          2HD1      ILE  12   6.909 -10.122 -13.474
  103    H    GLY  13           H        GLY  13   7.175 -11.689  -8.882
  104    HA2  GLY  13           2HA      GLY  13   9.662 -11.622  -7.268
  105    HA3  GLY  13           3HA      GLY  13   8.023 -11.703  -6.650
  106    H    GLY  14           H        GLY  14  10.562 -13.425  -6.231
  107    HA2  GLY  14           2HA      GLY  14  10.332 -15.536  -5.157
  108    HA3  GLY  14           3HA      GLY  14   9.034 -15.974  -6.285
  109    H    LEU  15           H        LEU  15  11.664 -14.370  -7.799
  110    HA   LEU  15           HA       LEU  15  12.247 -16.630  -9.461
  111    HB2  LEU  15           HB2      LEU  15  13.708 -13.998  -9.029
  112    HB3  LEU  15           HB3      LEU  15  14.014 -15.161 -10.346
  113    HG   LEU  15           HG       LEU  15  11.267 -13.956 -10.005
  114   HD11  LEU  15          1HD1      LEU  15  13.687 -12.895 -11.538
  115   HD12  LEU  15          2HD1      LEU  15  12.014 -12.337 -11.771
  116   HD13  LEU  15          3HD1      LEU  15  12.831 -12.077 -10.209
  117   HD21  LEU  15          3HD2      LEU  15  12.864 -15.008 -12.384
  118   HD22  LEU  15          1HD2      LEU  15  11.744 -16.006 -11.435
  119   HD23  LEU  15          2HD2      LEU  15  11.134 -14.608 -12.366
  120    H    ASN  16           H        ASN  16  14.378 -17.557  -9.855
  121    HA   ASN  16           HA       ASN  16  15.633 -18.479  -7.451
  122    HB2  ASN  16           HB2      ASN  16  15.172 -19.736  -9.579
  123    HB3  ASN  16           HB3      ASN  16  16.491 -18.811 -10.328
  124   HD21  ASN  16          2HD2      ASN  16  17.150 -21.122 -10.650
  125   HD22  ASN  16          1HD2      ASN  16  18.110 -21.860  -9.413
  126    H    THR  17           H        THR  17  17.908 -18.195  -6.908
  127    HA   THR  17           HA       THR  17  18.991 -15.563  -7.268
  128    HB   THR  17           HB       THR  17  20.932 -16.508  -6.075
  129    HG1  THR  17           1HG      THR  17  20.996 -18.551  -7.031
  130   HG21  THR  17          1HG2      THR  17  18.333 -17.645  -4.970
  131   HG22  THR  17          HG22      THR  17  19.801 -17.253  -4.049
  132   HG23  THR  17          HG32      THR  17  18.846 -15.944  -4.800
  133    H    GLU  18           H        GLU  18  18.828 -18.244  -9.288
  134    HA   GLU  18           HA       GLU  18  21.457 -17.883 -10.570
  135    HB2  GLU  18           HB2      GLU  18  19.299 -19.923 -11.178
  136    HB3  GLU  18           HB3      GLU  18  21.040 -20.050 -11.504
  137    HG2  GLU  18           HG2      GLU  18  19.716 -20.006  -8.753
  138    HG3  GLU  18           HG3      GLU  18  20.291 -21.444  -9.553
  139    H    THR  19           H        THR  19  18.228 -16.832 -10.851
  140    HA   THR  19           HA       THR  19  18.152 -16.623 -13.764
  141    HB   THR  19           HB       THR  19  16.379 -15.339 -11.647
  142    HG1  THR  19           1HG      THR  19  15.037 -17.128 -12.113
  143   HG21  THR  19          1HG2      THR  19  14.731 -15.288 -13.505
  144   HG22  THR  19          HG22      THR  19  16.164 -14.301 -13.853
  145   HG23  THR  19          HG32      THR  19  15.972 -15.903 -14.614
  146    H    ASN  20           H        ASN  20  18.451 -14.762 -14.964
  147    HA   ASN  20           HA       ASN  20  19.222 -12.298 -13.512
  148    HB2  ASN  20           HB2      ASN  20  20.762 -12.869 -15.954
  149    HB3  ASN  20           HB3      ASN  20  21.261 -12.048 -14.473
  150   HD21  ASN  20          2HD2      ASN  20  21.022 -15.092 -16.183
  151   HD22  ASN  20          1HD2      ASN  20  21.944 -16.044 -15.033
  152    H    GLU  21           H        GLU  21  19.916 -10.864 -15.789
  153    HA   GLU  21           HA       GLU  21  17.272 -10.021 -16.546
  154    HB2  GLU  21           HB2      GLU  21  19.972  -9.104 -17.650
  155    HB3  GLU  21           HB3      GLU  21  18.426  -8.236 -17.679
  156    HG2  GLU  21           HG2      GLU  21  19.418  -7.263 -15.797
  157    HG3  GLU  21           HG3      GLU  21  18.451  -8.567 -15.115
  158    H    LYS  22           H        LYS  22  19.922 -11.753 -18.197
  159    HA   LYS  22           HA       LYS  22  18.729 -11.611 -20.799
  160    HB2  LYS  22           HB2      LYS  22  21.113 -11.991 -20.438
  161    HB3  LYS  22           HB3      LYS  22  20.795 -13.493 -19.570
  162    HG2  LYS  22           HG2      LYS  22  21.539 -13.831 -21.937
  163    HG3  LYS  22           HG3      LYS  22  19.973 -14.576 -21.575
  164    HD2  LYS  22           2HD      LYS  22  18.796 -12.706 -22.645
  165    HD3  LYS  22           3HD      LYS  22  20.338 -11.858 -22.904
  166    HE2  LYS  22           HE2      LYS  22  21.110 -13.740 -24.331
  167    HE3  LYS  22           HE3      LYS  22  19.568 -14.571 -24.072
  168    HZ1  LYS  22           3HZ      LYS  22  18.465 -12.720 -25.127
  169    HZ2  LYS  22           1HZ      LYS  22  19.900 -11.951 -25.372
  170    HZ3  LYS  22           2HZ      LYS  22  19.588 -13.369 -26.137
  171    H    ALA  23           H        ALA  23  18.130 -13.656 -18.024
  172    HA   ALA  23           HA       ALA  23  16.961 -15.799 -19.683
  173    HB1  ALA  23           1HB      ALA  23  17.171 -15.442 -16.662
  174    HB2  ALA  23           HB2      ALA  23  16.585 -16.898 -17.496
  175    HB3  ALA  23           HB3      ALA  23  18.284 -16.387 -17.675
  176    H    LEU  24           H        LEU  24  16.167 -12.872 -18.095
  177    HA   LEU  24           HA       LEU  24  13.343 -13.505 -17.703
  178    HB2  LEU  24           HB2      LEU  24  15.404 -11.482 -16.907
  179    HB3  LEU  24           HB3      LEU  24  13.769 -10.864 -17.020
  180    HG   LEU  24           HG       LEU  24  14.591 -13.361 -15.470
  181   HD11  LEU  24          1HD1      LEU  24  14.289 -12.001 -13.447
  182   HD12  LEU  24          2HD1      LEU  24  15.593 -11.346 -14.469
  183   HD13  LEU  24          3HD1      LEU  24  13.993 -10.552 -14.443
  184   HD21  LEU  24          3HD2      LEU  24  12.349 -13.018 -14.376
  185   HD22  LEU  24          1HD2      LEU  24  12.029 -11.708 -15.543
  186   HD23  LEU  24          2HD2      LEU  24  12.236 -13.381 -16.109
  187    H    GLU  25           H        GLU  25  15.510 -11.721 -19.880
  188    HA   GLU  25           HA       GLU  25  13.285 -10.536 -21.311
  189    HB2  GLU  25           HB2      GLU  25  16.219 -11.009 -22.046
  190    HB3  GLU  25           HB3      GLU  25  15.069 -10.164 -23.109
  191    HG2  GLU  25           HG2      GLU  25  14.568  -8.610 -21.261
  192    HG3  GLU  25           HG3      GLU  25  15.860  -9.349 -20.297
  193    H    ALA  26           H        ALA  26  15.005 -13.524 -21.245
  194    HA   ALA  26           HA       ALA  26  14.307 -14.419 -23.931
  195    HB1  ALA  26           1HB      ALA  26  15.413 -16.512 -23.134
  196    HB2  ALA  26           HB2      ALA  26  16.405 -15.057 -22.854
  197    HB3  ALA  26           HB3      ALA  26  15.506 -15.804 -21.507
  198    H    VAL  27           H        VAL  27  12.919 -14.584 -20.714
  199    HA   VAL  27           HA       VAL  27  11.182 -16.851 -21.479
  200    HB   VAL  27           HB       VAL  27  12.610 -16.735 -19.433
  201   HG11  VAL  27          1HG1      VAL  27  12.003 -14.382 -18.879
  202   HG12  VAL  27          HG21      VAL  27  10.411 -14.998 -18.328
  203   HG13  VAL  27          HG31      VAL  27  11.914 -15.532 -17.517
  204   HG21  VAL  27          HG32      VAL  27   9.607 -17.118 -19.068
  205   HG22  VAL  27          1HG2      VAL  27  10.758 -18.341 -19.678
  206   HG23  VAL  27          HG22      VAL  27  10.878 -17.771 -17.991
  207    H    PHE  28           H        PHE  28  11.041 -13.459 -20.397
  208    HA   PHE  28           HA       PHE  28   8.104 -13.491 -20.708
  209    HB2  PHE  28           HB2      PHE  28  10.019 -11.341 -19.777
  210    HB3  PHE  28           HB3      PHE  28   8.286 -11.093 -20.041
  211    HD1  PHE  28           HD2      PHE  28   6.601 -12.282 -18.688
  212    HD2  PHE  28           HD1      PHE  28  10.804 -12.542 -17.821
  213    HE1  PHE  28           HE2      PHE  28   6.081 -13.203 -16.442
  214    HE2  PHE  28           HE1      PHE  28  10.290 -13.488 -15.604
  215    HZ   PHE  28           HZ       PHE  28   7.926 -13.789 -14.892
  216    H    GLY  29           H        GLY  29  10.850 -12.977 -22.672
  217    HA2  GLY  29           2HA      GLY  29   9.613 -11.077 -24.488
  218    HA3  GLY  29           3HA      GLY  29  11.053 -12.065 -24.814
  219    H    LYS  30           H        LYS  30   8.859 -14.210 -23.687
  220    HA   LYS  30           HA       LYS  30   8.278 -15.295 -26.316
  221    HB2  LYS  30           HB2      LYS  30   7.516 -16.189 -23.485
  222    HB3  LYS  30           HB3      LYS  30   7.424 -17.180 -24.958
  223    HG2  LYS  30           HG2      LYS  30   9.839 -17.013 -25.262
  224    HG3  LYS  30           HG3      LYS  30   9.992 -15.941 -23.867
  225    HD2  LYS  30           2HD      LYS  30  10.654 -18.251 -23.297
  226    HD3  LYS  30           3HD      LYS  30   9.322 -17.649 -22.315
  227    HE2  LYS  30           HE2      LYS  30   8.900 -19.938 -22.945
  228    HE3  LYS  30           HE3      LYS  30   7.700 -18.882 -23.706
  229    HZ1  LYS  30           3HZ      LYS  30   8.999 -19.010 -25.742
  230    HZ2  LYS  30           1HZ      LYS  30  10.099 -19.991 -25.013
  231    HZ3  LYS  30           2HZ      LYS  30   8.558 -20.513 -25.246
  232    H    TYR  31           H        TYR  31   6.802 -13.132 -24.220
  233    HA   TYR  31           HA       TYR  31   4.059 -13.748 -25.230
  234    HB2  TYR  31           HB2      TYR  31   5.007 -12.228 -22.791
  235    HB3  TYR  31           HB3      TYR  31   3.319 -12.515 -23.213
  236    HD1  TYR  31           HD2      TYR  31   2.630 -15.048 -23.437
  237    HD2  TYR  31           HD1      TYR  31   6.207 -13.697 -21.471
  238    HE1  TYR  31           HE2      TYR  31   2.827 -17.241 -22.299
  239    HE2  TYR  31           HE1      TYR  31   6.402 -15.889 -20.298
  240    HH   TYR  31           HH       TYR  31   5.569 -18.050 -20.159
  241    H    GLY  32           H        GLY  32   6.628 -11.371 -25.287
  242    HA2  GLY  32           2HA      GLY  32   5.371  -9.755 -27.266
  243    HA3  GLY  32           3HA      GLY  32   5.209  -8.975 -25.666
  244    H    ARG  33           H        ARG  33   6.608  -7.849 -27.845
  245    HA   ARG  33           HA       ARG  33   9.410  -8.417 -27.368
  246    HB2  ARG  33           HB2      ARG  33   9.926  -6.708 -28.908
  247    HB3  ARG  33           HB3      ARG  33   8.536  -7.584 -29.561
  248    HG2  ARG  33           HG2      ARG  33   7.028  -5.769 -28.747
  249    HG3  ARG  33           HG3      ARG  33   8.456  -4.923 -28.089
  250    HD2  ARG  33           2HD      ARG  33   7.931  -3.950 -30.235
  251    HD3  ARG  33           3HD      ARG  33   9.457  -4.845 -30.331
  252    HE   ARG  33           HE       ARG  33   7.311  -6.567 -31.101
  253   HH11  ARG  33          1HH1      ARG  33   9.090  -3.746 -32.271
  254   HH12  ARG  33          2HH1      ARG  33   8.794  -4.111 -33.958
  255   HH21  ARG  33          1HH2      ARG  33   6.926  -7.009 -33.314
  256   HH22  ARG  33          2HH2      ARG  33   7.573  -5.949 -34.542
  257    H    ILE  34           H        ILE  34  10.586  -7.770 -25.908
  258    HA   ILE  34           HA       ILE  34   9.569  -6.051 -23.756
  259    HB   ILE  34           HB       ILE  34  12.070  -7.716 -24.150
  260   HG12  ILE  34          HG21      ILE  34   9.614  -7.877 -22.345
  261   HG13  ILE  34          HG31      ILE  34   9.947  -8.892 -23.751
  262   HG21  ILE  34          1HG2      ILE  34  11.317  -6.093 -21.686
  263   HG22  ILE  34          HG22      ILE  34  12.729  -7.180 -21.883
  264   HG23  ILE  34          HG32      ILE  34  12.643  -5.691 -22.811
  265   HD11  ILE  34          3HD1      ILE  34  10.470 -10.099 -21.686
  266   HD12  ILE  34          1HD1      ILE  34  11.950  -9.811 -22.630
  267   HD13  ILE  34          2HD1      ILE  34  11.596  -8.837 -21.180
  268    H    VAL  35           H        VAL  35  10.302  -4.091 -23.115
  269    HA   VAL  35           HA       VAL  35  12.128  -2.679 -24.997
  270    HB   VAL  35           HB       VAL  35  10.607  -0.836 -23.415
  271   HG11  VAL  35          1HG1      VAL  35  10.470  -1.599 -26.355
  272   HG12  VAL  35          HG21      VAL  35   9.873  -0.085 -25.637
  273   HG13  VAL  35          HG31      VAL  35  11.618  -0.444 -25.629
  274   HG21  VAL  35          HG32      VAL  35   8.861  -2.846 -24.900
  275   HG22  VAL  35          1HG2      VAL  35   8.874  -2.560 -23.138
  276   HG23  VAL  35          HG22      VAL  35   8.333  -1.287 -24.242
  277    H    GLU  36           H        GLU  36  11.566  -3.690 -21.718
  278    HA   GLU  36           HA       GLU  36  14.241  -2.828 -20.973
  279    HB2  GLU  36           HB2      GLU  36  12.925  -0.757 -20.549
  280    HB3  GLU  36           HB3      GLU  36  11.790  -1.676 -19.557
  281    HG2  GLU  36           HG2      GLU  36  13.599  -2.215 -17.960
  282    HG3  GLU  36           HG3      GLU  36  14.749  -1.317 -18.973
  283    H    VAL  37           H        VAL  37  15.016  -4.033 -19.186
  284    HA   VAL  37           HA       VAL  37  13.031  -5.624 -17.689
  285    HB   VAL  37           HB       VAL  37  15.183  -6.741 -19.423
  286   HG11  VAL  37          1HG1      VAL  37  14.540  -7.942 -16.693
  287   HG12  VAL  37          HG21      VAL  37  15.467  -8.728 -17.989
  288   HG13  VAL  37          HG31      VAL  37  16.124  -7.291 -17.198
  289   HG21  VAL  37          HG32      VAL  37  12.778  -7.092 -19.832
  290   HG22  VAL  37          1HG2      VAL  37  13.547  -8.640 -19.399
  291   HG23  VAL  37          HG22      VAL  37  12.581  -7.775 -18.198
  292    H    LEU  38           H        LEU  38  13.460  -5.954 -15.640
  293    HA   LEU  38           HA       LEU  38  15.985  -4.816 -14.455
  294    HB2  LEU  38           HB2      LEU  38  13.104  -4.641 -13.838
  295    HB3  LEU  38           HB3      LEU  38  14.119  -4.858 -12.439
  296    HG   LEU  38           HG       LEU  38  14.416  -2.589 -14.473
  297   HD11  LEU  38          1HD1      LEU  38  13.717  -1.189 -12.550
  298   HD12  LEU  38          2HD1      LEU  38  12.454  -2.370 -12.982
  299   HD13  LEU  38          3HD1      LEU  38  13.491  -2.653 -11.569
  300   HD21  LEU  38          3HD2      LEU  38  15.999  -1.650 -12.800
  301   HD22  LEU  38          1HD2      LEU  38  15.925  -3.181 -11.897
  302   HD23  LEU  38          2HD2      LEU  38  16.616  -3.142 -13.541
  303    H    LEU  39           H        LEU  39  16.841  -5.964 -12.721
  304    HA   LEU  39           HA       LEU  39  15.473  -8.327 -11.776
  305    HB2  LEU  39           HB2      LEU  39  16.702  -9.148 -13.762
  306    HB3  LEU  39           HB3      LEU  39  18.196  -8.424 -13.147
  307    HG   LEU  39           HG       LEU  39  17.893 -10.926 -12.998
  308   HD11  LEU  39          1HD1      LEU  39  18.584  -9.464 -10.429
  309   HD12  LEU  39          2HD1      LEU  39  19.133 -11.080 -10.908
  310   HD13  LEU  39          3HD1      LEU  39  19.635  -9.654 -11.866
  311   HD21  LEU  39          3HD2      LEU  39  16.216 -10.262 -10.561
  312   HD22  LEU  39          1HD2      LEU  39  15.619 -10.991 -12.086
  313   HD23  LEU  39          2HD2      LEU  39  16.793 -11.869 -11.082
  314    H    MET  40           H        MET  40  15.756  -8.180  -9.570
  315    HA   MET  40           HA       MET  40  17.647  -6.060  -8.761
  316    HB2  MET  40           HB2      MET  40  15.563  -7.352  -6.993
  317    HB3  MET  40           HB3      MET  40  16.340  -5.773  -6.824
  318    HG2  MET  40           HG2      MET  40  14.092  -6.651  -8.584
  319    HG3  MET  40           HG3      MET  40  14.242  -5.204  -7.596
  320    HE1  MET  40           HE3      MET  40  15.800  -3.010  -8.457
  321    HE2  MET  40           HE1      MET  40  17.128  -4.180  -8.615
  322    HE3  MET  40           HE2      MET  40  16.716  -3.121  -9.992
  323    H    LYS  41           H        LYS  41  19.321  -6.323  -7.227
  324    HA   LYS  41           HA       LYS  41  19.559  -9.023  -6.105
  325    HB2  LYS  41           HB2      LYS  41  22.149  -7.967  -7.062
  326    HB3  LYS  41           HB3      LYS  41  21.457  -9.604  -7.004
  327    HG2  LYS  41           HG2      LYS  41  20.253  -9.259  -9.057
  328    HG3  LYS  41           HG3      LYS  41  20.672  -7.524  -9.081
  329    HD2  LYS  41           2HD      LYS  41  23.053  -8.074  -9.282
  330    HD3  LYS  41           3HD      LYS  41  22.677  -9.813  -9.254
  331    HE2  LYS  41           HE2      LYS  41  21.390  -9.608 -11.307
  332    HE3  LYS  41           HE3      LYS  41  21.606  -7.844 -11.316
  333    HZ1  LYS  41           3HZ      LYS  41  23.754  -9.842 -11.560
  334    HZ2  LYS  41           1HZ      LYS  41  23.135  -8.939 -12.788
  335    HZ3  LYS  41           2HZ      LYS  41  23.961  -8.208 -11.568
  336    H    ASP  42           H        ASP  42  21.030  -9.262  -4.378
  337    HA   ASP  42           HA       ASP  42  20.951  -7.214  -2.438
  338    HB2  ASP  42           HB2      ASP  42  21.244  -9.771  -2.218
  339    HB3  ASP  42           HB3      ASP  42  22.951  -9.482  -2.557
  340    H    ARG  43           H        ARG  43  22.499  -5.715  -1.717
  341    HA   ARG  43           HA       ARG  43  24.398  -4.900  -3.775
  342    HB2  ARG  43           HB2      ARG  43  24.525  -2.848  -2.677
  343    HB3  ARG  43           HB3      ARG  43  22.834  -3.348  -2.566
  344    HG2  ARG  43           HG2      ARG  43  24.944  -3.509  -0.371
  345    HG3  ARG  43           HG3      ARG  43  23.631  -2.339  -0.469
  346    HD2  ARG  43           2HD      ARG  43  23.299  -5.342  -0.097
  347    HD3  ARG  43           3HD      ARG  43  23.121  -4.106   1.152
  348    HE   ARG  43           HE       ARG  43  21.351  -3.299  -0.803
  349   HH11  ARG  43          1HH1      ARG  43  21.838  -6.285   1.026
  350   HH12  ARG  43          2HH1      ARG  43  20.142  -6.703   1.024
  351   HH21  ARG  43          1HH2      ARG  43  19.141  -3.883  -0.807
  352   HH22  ARG  43          2HH2      ARG  43  18.622  -5.349  -0.013
  353    H    GLU  44           H        GLU  44  24.622  -7.043  -1.246
  354    HA   GLU  44           HA       GLU  44  27.532  -6.458  -0.852
  355    HB2  GLU  44           HB2      GLU  44  25.504  -7.745   0.997
  356    HB3  GLU  44           HB3      GLU  44  27.251  -7.669   1.315
  357    HG2  GLU  44           HG2      GLU  44  27.150  -5.185   1.220
  358    HG3  GLU  44           HG3      GLU  44  25.399  -5.278   0.964
  359    H    THR  45           H        THR  45  25.247  -8.735  -2.127
  360    HA   THR  45           HA       THR  45  27.459 -10.737  -2.280
  361    HB   THR  45           HB       THR  45  25.952 -12.539  -1.931
  362    HG1  THR  45           1HG      THR  45  23.722 -12.147  -1.648
  363   HG21  THR  45          1HG2      THR  45  25.137 -10.362   0.033
  364   HG22  THR  45          HG22      THR  45  25.116 -12.122   0.318
  365   HG23  THR  45          HG32      THR  45  26.671 -11.268   0.111
  366    H    ASN  46           H        ASN  46  25.054  -8.875  -3.895
  367    HA   ASN  46           HA       ASN  46  24.510  -8.669  -6.059
  368    HB2  ASN  46           HB2      ASN  46  27.130  -8.622  -5.891
  369    HB3  ASN  46           HB3      ASN  46  27.029 -10.115  -6.827
  370   HD21  ASN  46          2HD2      ASN  46  28.340  -8.525  -8.281
  371   HD22  ASN  46          1HD2      ASN  46  27.393  -7.638  -9.456
  372    H    LYS  47           H        LYS  47  23.851 -11.259  -4.632
  373    HA   LYS  47           HA       LYS  47  23.592 -13.338  -6.635
  374    HB2  LYS  47           HB2      LYS  47  22.334 -12.767  -3.930
  375    HB3  LYS  47           HB3      LYS  47  21.924 -14.199  -4.880
  376    HG2  LYS  47           HG2      LYS  47  24.754 -13.507  -3.996
  377    HG3  LYS  47           HG3      LYS  47  23.655 -14.597  -3.129
  378    HD2  LYS  47           2HD      LYS  47  23.481 -16.018  -5.177
  379    HD3  LYS  47           3HD      LYS  47  24.661 -14.966  -5.985
  380    HE2  LYS  47           HE2      LYS  47  25.801 -16.916  -5.114
  381    HE3  LYS  47           HE3      LYS  47  26.320 -15.486  -4.204
  382    HZ1  LYS  47           3HZ      LYS  47  24.793 -16.126  -2.465
  383    HZ2  LYS  47           1HZ      LYS  47  24.303 -17.443  -3.319
  384    HZ3  LYS  47           2HZ      LYS  47  25.848 -17.349  -2.770
  385    H    SER  48           H        SER  48  20.658 -12.878  -5.165
  386    HA   SER  48           HA       SER  48  19.560 -10.889  -7.022
  387    HB2  SER  48           HB2      SER  48  19.279 -13.089  -8.240
  388    HB3  SER  48           HB3      SER  48  18.339 -13.669  -6.858
  389    HG   SER  48           HG       SER  48  17.742 -11.402  -8.452
  390    H    ARG  49           H        ARG  49  17.751  -9.865  -6.098
  391    HA   ARG  49           HA       ARG  49  17.238 -10.247  -3.263
  392    HB2  ARG  49           HB2      ARG  49  15.719  -8.743  -5.423
  393    HB3  ARG  49           HB3      ARG  49  15.427  -8.588  -3.683
  394    HG2  ARG  49           HG2      ARG  49  18.158  -8.020  -4.846
  395    HG3  ARG  49           HG3      ARG  49  16.892  -6.797  -4.945
  396    HD2  ARG  49           2HD      ARG  49  17.907  -8.047  -2.377
  397    HD3  ARG  49           3HD      ARG  49  18.348  -6.451  -3.043
  398    HE   ARG  49           HE       ARG  49  15.957  -5.808  -2.814
  399   HH11  ARG  49          1HH1      ARG  49  17.189  -8.461  -0.812
  400   HH12  ARG  49          2HH1      ARG  49  15.983  -8.230   0.431
  401   HH21  ARG  49          1HH2      ARG  49  14.404  -5.544  -1.171
  402   HH22  ARG  49          2HH2      ARG  49  14.420  -6.591   0.228
  403    H    GLY  50           H        GLY  50  16.331 -11.874  -6.084
  404    HA2  GLY  50           2HA      GLY  50  14.936 -13.717  -6.302
  405    HA3  GLY  50           3HA      GLY  50  14.226 -13.382  -4.713
  406    H    PHE  51           H        PHE  51  14.193 -10.459  -6.461
  407    HA   PHE  51           HA       PHE  51  11.721 -11.175  -7.922
  408    HB2  PHE  51           HB2      PHE  51  10.484  -9.349  -7.079
  409    HB3  PHE  51           HB3      PHE  51  11.064 -10.289  -5.710
  410    HD1  PHE  51           HD2      PHE  51  12.940  -9.390  -4.297
  411    HD2  PHE  51           HD1      PHE  51  11.088  -7.066  -7.404
  412    HE1  PHE  51           HE2      PHE  51  13.849  -7.302  -3.286
  413    HE2  PHE  51           HE1      PHE  51  11.973  -4.989  -6.367
  414    HZ   PHE  51           HZ       PHE  51  13.404  -5.112  -4.371
  415    H    ALA  52           H        ALA  52  11.101  -9.501  -9.510
  416    HA   ALA  52           HA       ALA  52  13.269  -7.751 -10.464
  417    HB1  ALA  52           1HB      ALA  52  12.301 -10.198 -12.004
  418    HB2  ALA  52           HB2      ALA  52  13.444  -8.982 -12.605
  419    HB3  ALA  52           HB3      ALA  52  13.892 -10.026 -11.229
  420    H    PHE  53           H        PHE  53  12.533  -7.022 -12.852
  421    HA   PHE  53           HA       PHE  53   9.603  -6.808 -13.026
  422    HB2  PHE  53           HB2      PHE  53  11.453  -4.375 -13.034
  423    HB3  PHE  53           HB3      PHE  53   9.758  -4.345 -13.401
  424    HD1  PHE  53           HD1      PHE  53  12.279  -5.024 -10.783
  425    HD2  PHE  53           HD2      PHE  53   8.147  -4.191 -11.612
  426    HE1  PHE  53           HE1      PHE  53  11.865  -4.709  -8.363
  427    HE2  PHE  53           HE2      PHE  53   7.723  -3.881  -9.188
  428    HZ   PHE  53           HZ       PHE  53   9.575  -4.161  -7.559
  429    H    VAL  54           H        VAL  54   8.926  -5.937 -15.178
  430    HA   VAL  54           HA       VAL  54  10.991  -5.827 -17.263
  431    HB   VAL  54           HB       VAL  54  10.614  -8.245 -17.127
  432   HG11  VAL  54          1HG1      VAL  54   8.616  -9.316 -17.465
  433   HG12  VAL  54          HG21      VAL  54   8.647  -8.333 -15.980
  434   HG13  VAL  54          HG31      VAL  54   7.722  -7.752 -17.424
  435   HG21  VAL  54          HG32      VAL  54   9.918  -8.678 -19.416
  436   HG22  VAL  54          1HG2      VAL  54   8.968  -7.180 -19.471
  437   HG23  VAL  54          HG22      VAL  54  10.735  -7.092 -19.447
  438    H    THR  55           H        THR  55  10.356  -4.615 -18.987
  439    HA   THR  55           HA       THR  55   7.552  -3.605 -18.921
  440    HB   THR  55           HB       THR  55   9.969  -2.244 -20.129
  441    HG1  THR  55           1HG      THR  55   9.824  -0.933 -18.325
  442   HG21  THR  55          1HG2      THR  55   7.873  -1.607 -21.214
  443   HG22  THR  55          HG22      THR  55   7.079  -1.401 -19.640
  444   HG23  THR  55          HG32      THR  55   8.389  -0.295 -20.145
  445    H    PHE  56           H        PHE  56   6.292  -4.311 -20.460
  446    HA   PHE  56           HA       PHE  56   7.370  -5.388 -22.991
  447    HB2  PHE  56           HB2      PHE  56   4.628  -5.267 -21.693
  448    HB3  PHE  56           HB3      PHE  56   4.902  -5.871 -23.327
  449    HD1  PHE  56           HD2      PHE  56   6.347  -6.456 -19.853
  450    HD2  PHE  56           HD1      PHE  56   5.075  -8.102 -23.626
  451    HE1  PHE  56           HE2      PHE  56   6.887  -8.723 -19.047
  452    HE2  PHE  56           HE1      PHE  56   5.523 -10.372 -22.780
  453    HZ   PHE  56           HZ       PHE  56   6.378 -10.701 -20.474
  454    H    GLU  57           H        GLU  57   6.591  -4.645 -25.053
  455    HA   GLU  57           HA       GLU  57   6.155  -1.766 -25.157
  456    HB2  GLU  57           HB2      GLU  57   7.016  -3.881 -26.916
  457    HB3  GLU  57           HB3      GLU  57   5.679  -3.033 -27.686
  458    HG2  GLU  57           HG2      GLU  57   8.115  -1.634 -26.528
  459    HG3  GLU  57           HG3      GLU  57   7.911  -2.066 -28.236
  460    H    SER  58           H        SER  58   4.140  -4.698 -25.173
  461    HA   SER  58           HA       SER  58   1.819  -2.908 -25.667
  462    HB2  SER  58           HB2      SER  58   1.943  -4.589 -27.387
  463    HB3  SER  58           HB3      SER  58   2.211  -5.869 -26.180
  464    HG   SER  58           HG       SER  58   0.014  -5.722 -26.906
  465    HA   PRO  59           HA       PRO  59   1.003  -3.605 -21.431
  466    HB2  PRO  59           HB2      PRO  59  -1.525  -2.653 -21.226
  467    HB3  PRO  59           HB3      PRO  59  -0.168  -1.558 -21.693
  468    HG2  PRO  59           HG2      PRO  59  -2.065  -3.066 -23.503
  469    HG3  PRO  59           HG3      PRO  59  -1.783  -1.294 -23.486
  470    HD2  PRO  59           2HD      PRO  59  -0.403  -2.888 -25.208
  471    HD3  PRO  59           3HD      PRO  59   0.464  -1.584 -24.327
  472    H    ALA  60           H        ALA  60  -0.464  -5.324 -24.010
  473    HA   ALA  60           HA       ALA  60  -1.960  -7.035 -22.096
  474    HB1  ALA  60           1HB      ALA  60  -2.418  -6.605 -25.067
  475    HB2  ALA  60           HB2      ALA  60  -3.366  -7.673 -23.994
  476    HB3  ALA  60           HB3      ALA  60  -3.380  -5.913 -23.735
  477    H    ASP  61           H        ASP  61   0.753  -6.872 -24.280
  478    HA   ASP  61           HA       ASP  61   1.063  -9.746 -24.535
  479    HB2  ASP  61           HB2      ASP  61   3.010  -7.391 -24.654
  480    HB3  ASP  61           HB3      ASP  61   3.505  -9.023 -24.846
  481    H    ALA  62           H        ALA  62   1.675  -7.245 -22.144
  482    HA   ALA  62           HA       ALA  62   3.228  -8.925 -20.357
  483    HB1  ALA  62           1HB      ALA  62   3.467  -6.501 -20.365
  484    HB2  ALA  62           HB2      ALA  62   1.746  -6.298 -19.962
  485    HB3  ALA  62           HB3      ALA  62   2.840  -7.057 -18.779
  486    H    LYS  63           H        LYS  63  -0.231  -8.130 -20.848
  487    HA   LYS  63           HA       LYS  63  -1.153  -9.371 -18.404
  488    HB2  LYS  63           HB2      LYS  63  -2.496  -8.856 -21.093
  489    HB3  LYS  63           HB3      LYS  63  -3.335  -9.525 -19.686
  490    HG2  LYS  63           HG2      LYS  63  -2.896  -7.539 -18.370
  491    HG3  LYS  63           HG3      LYS  63  -1.869  -6.873 -19.656
  492    HD2  LYS  63           2HD      LYS  63  -4.091  -5.808 -19.657
  493    HD3  LYS  63           3HD      LYS  63  -3.814  -6.701 -21.155
  494    HE2  LYS  63           HE2      LYS  63  -5.092  -8.636 -20.237
  495    HE3  LYS  63           HE3      LYS  63  -5.373  -7.737 -18.744
  496    HZ1  LYS  63           3HZ      LYS  63  -6.566  -6.094 -20.021
  497    HZ2  LYS  63           1HZ      LYS  63  -6.312  -6.925 -21.416
  498    HZ3  LYS  63           2HZ      LYS  63  -7.239  -7.577 -20.233
  499    H    ASP  64           H        ASP  64  -0.475 -10.493 -21.723
  500    HA   ASP  64           HA       ASP  64  -1.670 -13.074 -21.359
  501    HB2  ASP  64           HB2      ASP  64  -1.121 -11.859 -23.527
  502    HB3  ASP  64           HB3      ASP  64   0.579 -12.240 -23.236
  503    H    ALA  65           H        ALA  65   1.568 -11.738 -20.795
  504    HA   ALA  65           HA       ALA  65   2.737 -14.301 -20.090
  505    HB1  ALA  65           1HB      ALA  65   4.042 -12.262 -20.830
  506    HB2  ALA  65           HB2      ALA  65   3.650 -11.513 -19.269
  507    HB3  ALA  65           HB3      ALA  65   4.621 -13.001 -19.321
  508    H    ALA  66           H        ALA  66   1.316 -11.537 -18.270
  509    HA   ALA  66           HA       ALA  66   1.869 -12.713 -15.715
  510    HB1  ALA  66           1HB      ALA  66   1.575 -10.256 -16.189
  511    HB2  ALA  66           HB2      ALA  66  -0.129 -10.548 -16.538
  512    HB3  ALA  66           HB3      ALA  66   0.493 -10.831 -14.890
  513    H    ARG  67           H        ARG  67  -0.388 -13.495 -18.094
  514    HA   ARG  67           HA       ARG  67  -2.213 -14.824 -16.161
  515    HB2  ARG  67           HB2      ARG  67  -2.402 -14.137 -19.109
  516    HB3  ARG  67           HB3      ARG  67  -3.569 -15.197 -18.296
  517    HG2  ARG  67           HG2      ARG  67  -4.236 -13.454 -16.778
  518    HG3  ARG  67           HG3      ARG  67  -2.913 -12.396 -17.286
  519    HD2  ARG  67           2HD      ARG  67  -4.992 -11.665 -18.293
  520    HD3  ARG  67           3HD      ARG  67  -3.903 -12.242 -19.556
  521    HE   ARG  67           HE       ARG  67  -5.798 -14.242 -18.515
  522   HH11  ARG  67          1HH1      ARG  67  -5.157 -11.807 -20.999
  523   HH12  ARG  67          2HH1      ARG  67  -6.312 -12.483 -22.125
  524   HH21  ARG  67          1HH2      ARG  67  -7.297 -15.098 -20.003
  525   HH22  ARG  67          2HH2      ARG  67  -7.513 -14.344 -21.564
  526    H    ASP  68           H        ASP  68   0.720 -15.654 -17.518
  527    HA   ASP  68           HA       ASP  68  -0.159 -18.445 -18.106
  528    HB2  ASP  68           HB2      ASP  68   1.436 -16.397 -19.585
  529    HB3  ASP  68           HB3      ASP  68   2.210 -17.932 -19.419
  530    H    MET  69           H        MET  69   2.514 -16.237 -17.414
  531    HA   MET  69           HA       MET  69   4.229 -18.264 -16.270
  532    HB2  MET  69           HB2      MET  69   4.273 -15.408 -17.170
  533    HB3  MET  69           HB3      MET  69   5.384 -15.808 -15.898
  534    HG2  MET  69           HG2      MET  69   5.075 -17.195 -18.598
  535    HG3  MET  69           HG3      MET  69   6.379 -16.082 -18.157
  536    HE1  MET  69           HE3      MET  69   8.050 -16.514 -16.283
  537    HE2  MET  69           HE1      MET  69   6.858 -17.168 -15.128
  538    HE3  MET  69           HE2      MET  69   8.355 -18.074 -15.471
  539    H    ASN  70           H        ASN  70   1.708 -16.281 -15.012
  540    HA   ASN  70           HA       ASN  70   2.919 -15.799 -12.431
  541    HB2  ASN  70           HB2      ASN  70   1.060 -14.432 -13.368
  542    HB3  ASN  70           HB3      ASN  70  -0.001 -15.844 -13.270
  543   HD21  ASN  70          2HD2      ASN  70  -1.323 -14.358 -11.907
  544   HD22  ASN  70          1HD2      ASN  70  -0.933 -14.226 -10.201
  545    H    GLY  71           H        GLY  71   3.198 -17.200 -10.816
  546    HA2  GLY  71           2HA      GLY  71   2.612 -18.887  -9.307
  547    HA3  GLY  71           3HA      GLY  71   1.311 -19.414 -10.387
  548    H    LYS  72           H        LYS  72   3.784 -19.172 -12.539
  549    HA   LYS  72           HA       LYS  72   4.559 -21.969 -12.446
  550    HB2  LYS  72           HB2      LYS  72   5.511 -19.657 -14.138
  551    HB3  LYS  72           HB3      LYS  72   5.650 -21.381 -14.485
  552    HG2  LYS  72           HG2      LYS  72   3.037 -19.824 -14.392
  553    HG3  LYS  72           HG3      LYS  72   3.854 -20.441 -15.836
  554    HD2  LYS  72           2HD      LYS  72   3.590 -22.771 -14.979
  555    HD3  LYS  72           3HD      LYS  72   2.705 -22.134 -13.575
  556    HE2  LYS  72           HE2      LYS  72   1.022 -21.140 -15.087
  557    HE3  LYS  72           HE3      LYS  72   1.896 -21.775 -16.487
  558    HZ1  LYS  72           3HZ      LYS  72   0.691 -23.398 -14.343
  559    HZ2  LYS  72           1HZ      LYS  72   0.082 -23.204 -15.856
  560    HZ3  LYS  72           2HZ      LYS  72   1.509 -23.990 -15.638
  561    H    SER  73           H        SER  73   7.164 -21.389 -13.514
  562    HA   SER  73           HA       SER  73   8.689 -20.486 -11.111
  563    HB2  SER  73           HB2      SER  73   8.115 -22.897 -10.958
  564    HB3  SER  73           HB3      SER  73   8.906 -23.179 -12.518
  565    HG   SER  73           HG       SER  73  10.300 -23.618 -10.763
  566    H    LEU  74           H        LEU  74  10.867 -20.211 -11.396
  567    HA   LEU  74           HA       LEU  74  11.772 -19.905 -14.211
  568    HB2  LEU  74           HB2      LEU  74  11.173 -17.713 -12.519
  569    HB3  LEU  74           HB3      LEU  74  12.856 -17.961 -12.266
  570    HG   LEU  74           HG       LEU  74  12.664 -16.389 -13.999
  571   HD11  LEU  74          1HD1      LEU  74  13.288 -18.982 -15.447
  572   HD12  LEU  74          2HD1      LEU  74  13.759 -17.340 -15.919
  573   HD13  LEU  74          3HD1      LEU  74  14.429 -18.055 -14.433
  574   HD21  LEU  74          3HD2      LEU  74  10.914 -18.413 -15.475
  575   HD22  LEU  74          1HD2      LEU  74  10.303 -16.975 -14.611
  576   HD23  LEU  74          2HD2      LEU  74  11.334 -16.786 -16.047
  577    H    ASP  75           H        ASP  75  13.631 -20.904 -14.516
  578    HA   ASP  75           HA       ASP  75  15.502 -22.068 -14.182
  579    HB2  ASP  75           HB2      ASP  75  16.037 -19.647 -13.086
  580    HB3  ASP  75           HB3      ASP  75  15.875 -20.464 -11.626
  581    H    GLY  76           H        GLY  76  13.209 -22.078 -11.611
  582    HA2  GLY  76           2HA      GLY  76  13.094 -24.677 -11.180
  583    HA3  GLY  76           3HA      GLY  76  14.551 -24.282 -10.237
  584    H    LYS  77           H        LYS  77  12.814 -21.490 -10.007
  585    HA   LYS  77           HA       LYS  77  11.637 -22.345  -7.413
  586    HB2  LYS  77           HB2      LYS  77  12.903 -19.669  -8.069
  587    HB3  LYS  77           HB3      LYS  77  12.334 -20.226  -6.486
  588    HG2  LYS  77           HG2      LYS  77  14.630 -21.416  -8.099
  589    HG3  LYS  77           HG3      LYS  77  14.797 -20.367  -6.678
  590    HD2  LYS  77           2HD      LYS  77  13.839 -22.048  -5.227
  591    HD3  LYS  77           3HD      LYS  77  13.368 -23.058  -6.604
  592    HE2  LYS  77           HE2      LYS  77  15.381 -23.953  -5.587
  593    HE3  LYS  77           HE3      LYS  77  15.702 -23.389  -7.233
  594    HZ1  LYS  77           3HZ      LYS  77  16.674 -21.410  -6.311
  595    HZ2  LYS  77           1HZ      LYS  77  16.318 -21.882  -4.770
  596    HZ3  LYS  77           2HZ      LYS  77  17.410 -22.722  -5.665
  597    H    ALA  78           H        ALA  78   9.604 -21.736  -6.960
  598    HA   ALA  78           HA       ALA  78   7.985 -20.954  -9.202
  599    HB1  ALA  78           1HB      ALA  78   7.252 -21.277  -6.273
  600    HB2  ALA  78           HB2      ALA  78   6.111 -21.177  -7.644
  601    HB3  ALA  78           HB3      ALA  78   7.222 -22.553  -7.516
  602    H    ILE  79           H        ILE  79   6.931 -19.073  -9.672
  603    HA   ILE  79           HA       ILE  79   7.751 -16.688  -8.068
  604    HB   ILE  79           HB       ILE  79   7.999 -15.459 -10.080
  605   HG12  ILE  79          HG21      ILE  79   7.099 -17.909 -11.655
  606   HG13  ILE  79          HG31      ILE  79   6.072 -16.497 -11.304
  607   HG21  ILE  79          1HG2      ILE  79   9.891 -16.949  -9.416
  608   HG22  ILE  79          HG22      ILE  79   9.285 -18.180 -10.547
  609   HG23  ILE  79          HG32      ILE  79   9.832 -16.608 -11.168
  610   HD11  ILE  79          3HD1      ILE  79   8.606 -16.537 -12.971
  611   HD12  ILE  79          1HD1      ILE  79   6.945 -16.129 -13.475
  612   HD13  ILE  79          2HD1      ILE  79   7.822 -15.044 -12.390
  613    H    LYS  80           H        LYS  80   6.577 -14.729  -8.770
  614    HA   LYS  80           HA       LYS  80   3.655 -15.121  -9.195
  615    HB2  LYS  80           HB2      LYS  80   4.292 -14.274  -6.885
  616    HB3  LYS  80           HB3      LYS  80   5.123 -12.927  -7.661
  617    HG2  LYS  80           HG2      LYS  80   2.897 -12.359  -8.813
  618    HG3  LYS  80           HG3      LYS  80   2.134 -13.507  -7.694
  619    HD2  LYS  80           2HD      LYS  80   2.985 -12.179  -5.780
  620    HD3  LYS  80           3HD      LYS  80   3.844 -11.108  -6.916
  621    HE2  LYS  80           HE2      LYS  80   1.663 -10.533  -7.983
  622    HE3  LYS  80           HE3      LYS  80   0.830 -11.481  -6.741
  623    HZ1  LYS  80           3HZ      LYS  80   0.958  -9.108  -6.256
  624    HZ2  LYS  80           1HZ      LYS  80   1.715  -9.995  -5.089
  625    HZ3  LYS  80           2HZ      LYS  80   2.590  -9.170  -6.202
  626    H    VAL  81           H        VAL  81   2.809 -13.804 -10.867
  627    HA   VAL  81           HA       VAL  81   4.591 -11.667 -11.910
  628    HB   VAL  81           HB       VAL  81   3.015 -13.594 -13.669
  629   HG11  VAL  81          1HG1      VAL  81   4.902 -11.290 -14.330
  630   HG12  VAL  81          HG21      VAL  81   4.132 -12.379 -15.504
  631   HG13  VAL  81          HG31      VAL  81   3.135 -11.274 -14.545
  632   HG21  VAL  81          HG32      VAL  81   5.031 -14.669 -12.758
  633   HG22  VAL  81          1HG2      VAL  81   5.273 -14.266 -14.469
  634   HG23  VAL  81          HG22      VAL  81   6.010 -13.249 -13.204
  635    H    GLU  82           H        GLU  82   3.592  -9.755 -12.123
  636    HA   GLU  82           HA       GLU  82   0.680  -9.545 -12.375
  637    HB2  GLU  82           HB2      GLU  82   1.137 -10.089  -9.946
  638    HB3  GLU  82           HB3      GLU  82   2.112  -8.621  -9.844
  639    HG2  GLU  82           HG2      GLU  82   0.140  -7.237 -10.336
  640    HG3  GLU  82           HG3      GLU  82  -0.830  -8.692 -10.617
  641    H    GLN  83           H        GLN  83   0.053  -7.184 -12.597
  642    HA   GLN  83           HA       GLN  83   2.065  -5.570 -13.863
  643    HB2  GLN  83           HB2      GLN  83  -0.236  -5.148 -14.393
  644    HB3  GLN  83           HB3      GLN  83  -0.679  -5.058 -12.685
  645    HG2  GLN  83           HG2      GLN  83  -0.729  -2.849 -13.593
  646    HG3  GLN  83           HG3      GLN  83   0.596  -2.961 -12.430
  647   HE21  GLN  83          HE22      GLN  83   1.817  -1.296 -13.198
  648   HE22  GLN  83          HE12      GLN  83   2.537  -1.253 -14.791
  649    H    ALA  84           H        ALA  84   3.461  -4.083 -13.004
  650    HA   ALA  84           HA       ALA  84   4.120  -4.541 -10.221
  651    HB1  ALA  84           1HB      ALA  84   5.329  -2.663 -12.279
  652    HB2  ALA  84           HB2      ALA  84   6.060  -3.127 -10.729
  653    HB3  ALA  84           HB3      ALA  84   5.822  -4.354 -11.999
  654    H    THR  85           H        THR  85   4.472  -2.976  -8.608
  655    HA   THR  85           HA       THR  85   3.070  -0.376  -8.999
  656    HB   THR  85           HB       THR  85   2.940  -0.301  -6.508
  657    HG1  THR  85           1HG      THR  85   3.117  -2.296  -5.427
  658   HG21  THR  85          1HG2      THR  85   0.964  -0.913  -7.890
  659   HG22  THR  85          HG22      THR  85   1.456  -2.622  -7.841
  660   HG23  THR  85          HG32      THR  85   0.954  -1.795  -6.350
  661    H    LYS  86           H        LYS  86   4.040   1.410  -7.812
  662    HA   LYS  86           HA       LYS  86   6.826   1.641  -8.342
  663    HB2  LYS  86           HB2      LYS  86   4.931   3.289  -6.621
  664    HB3  LYS  86           HB3      LYS  86   6.553   3.805  -7.111
  665    HG2  LYS  86           HG2      LYS  86   5.805   3.446  -9.531
  666    HG3  LYS  86           HG3      LYS  86   4.164   3.186  -8.908
  667    HD2  LYS  86           2HD      LYS  86   4.356   5.481  -7.795
  668    HD3  LYS  86           3HD      LYS  86   5.852   5.704  -8.735
  669    HE2  LYS  86           HE2      LYS  86   4.516   5.173 -10.821
  670    HE3  LYS  86           HE3      LYS  86   3.054   5.152  -9.816
  671    HZ1  LYS  86           3HZ      LYS  86   3.489   7.437  -9.240
  672    HZ2  LYS  86           1HZ      LYS  86   4.854   7.457 -10.165
  673    HZ3  LYS  86           2HZ      LYS  86   3.382   7.280 -10.872
  674    HA   PRO  87           HA       PRO  87   8.757  -0.131  -4.868
  675    HB2  PRO  87           HB2      PRO  87  10.860   1.558  -4.298
  676    HB3  PRO  87           HB3      PRO  87  10.809   0.517  -5.735
  677    HG2  PRO  87           HG2      PRO  87   9.987   3.433  -5.556
  678    HG3  PRO  87           HG3      PRO  87  11.074   2.655  -6.761
  679    HD2  PRO  87           2HD      PRO  87   8.481   3.089  -7.345
  680    HD3  PRO  87           3HD      PRO  87   9.244   1.534  -7.808
  681    H    SER  88           H        SER  88   8.762  -0.132  -2.658
  682    HA   SER  88           HA       SER  88   7.072   1.938  -1.416
  683    HB2  SER  88           HB2      SER  88   7.948  -0.819  -0.491
  684    HB3  SER  88           HB3      SER  88   6.857   0.260   0.411
  685    HG   SER  88           HG       SER  88   5.745  -1.261  -0.906
  686    H    PHE  89           H        PHE  89  10.279   1.760  -1.930
  687    HA   PHE  89           HA       PHE  89  11.206   2.168   0.793
  688    HB2  PHE  89           HB2      PHE  89  13.392   2.471  -0.207
  689    HB3  PHE  89           HB3      PHE  89  12.615   0.981  -0.716
  690    HD1  PHE  89           HD1      PHE  89  11.487   4.038  -2.469
  691    HD2  PHE  89           HD2      PHE  89  14.342   0.815  -2.431
  692    HE1  PHE  89           HE1      PHE  89  12.129   4.574  -4.781
  693    HE2  PHE  89           HE2      PHE  89  15.001   1.382  -4.744
  694    HZ   PHE  89           HZ       PHE  89  13.883   3.246  -5.935
  695    H    GLU  90           H        GLU  90   9.320   4.085  -0.916
  696    HA   GLU  90           HA       GLU  90  10.700   6.646  -0.583
  697    HB2  GLU  90           HB2      GLU  90   8.573   7.572  -1.399
  698    HB3  GLU  90           HB3      GLU  90   9.184   6.301  -2.468
  699    HG2  GLU  90           HG2      GLU  90   7.620   4.680  -1.513
  700    HG3  GLU  90           HG3      GLU  90   7.076   5.859  -0.311
  701    H    SER  91           H        SER  91   9.340   8.422   0.463
  702    HA   SER  91           HA       SER  91   9.306   7.712   3.279
  703    HB2  SER  91           HB2      SER  91  10.452   9.669   2.190
  704    HB3  SER  91           HB3      SER  91   8.853  10.422   1.998
  705    HG   SER  91           HG       SER  91   9.902  11.047   3.950
  706    H    GLY  92           H        GLY  92   6.995   7.182   1.121
  707    HA2  GLY  92           2HA      GLY  92   4.773   6.683   1.450
  708    HA3  GLY  92           3HA      GLY  92   4.866   7.355   3.088
  709    H    ARG  93           H        ARG  93   6.094   9.612   0.929
  710    HA   ARG  93           HA       ARG  93   5.430  11.598   0.127
  711    HB2  ARG  93           HB2      ARG  93   4.080  10.099  -1.332
  712    HB3  ARG  93           HB3      ARG  93   2.709  10.307  -0.228
  713    HG2  ARG  93           HG2      ARG  93   2.780  12.771  -0.653
  714    HG3  ARG  93           HG3      ARG  93   4.096  12.503  -1.824
  715    HD2  ARG  93           2HD      ARG  93   1.300  11.307  -1.933
  716    HD3  ARG  93           3HD      ARG  93   1.861  12.677  -2.903
  717    HE   ARG  93           HE       ARG  93   3.653  10.956  -3.722
  718   HH11  ARG  93          1HH1      ARG  93   0.241  10.234  -3.033
  719   HH12  ARG  93          2HH1      ARG  93   0.208   8.900  -4.173
  720   HH21  ARG  93          1HH2      ARG  93   3.513   9.214  -5.196
  721   HH22  ARG  93          2HH2      ARG  93   1.989   8.358  -5.373
  722    H    ARG  94           H        ARG  94   3.783  10.333   2.903
  723    HA   ARG  94           HA       ARG  94   3.403  13.058   3.915
  724    HB2  ARG  94           HB2      ARG  94   1.030  12.788   4.357
  725    HB3  ARG  94           HB3      ARG  94   1.338  12.573   2.622
  726    HG2  ARG  94           HG2      ARG  94   1.278  10.114   2.914
  727    HG3  ARG  94           HG3      ARG  94   0.934  10.329   4.648
  728    HD2  ARG  94           2HD      ARG  94  -1.121  11.570   4.086
  729    HD3  ARG  94           3HD      ARG  94  -0.783  11.354   2.355
  730    HE   ARG  94           HE       ARG  94  -0.797   8.805   3.643
  731   HH11  ARG  94          1HH1      ARG  94  -3.004  11.389   2.654
  732   HH12  ARG  94          2HH1      ARG  94  -4.365  10.306   2.459
  733   HH21  ARG  94          1HH2      ARG  94  -2.591   7.427   3.391
  734   HH22  ARG  94          2HH2      ARG  94  -4.133   8.074   2.882
  735    H    GLY  95           H        GLY  95   2.694  13.038   6.217
  736    HA2  GLY  95           2HA      GLY  95   2.628  10.727   7.835
  737    HA3  GLY  95           3HA      GLY  95   4.312  11.289   7.769
  738    H5'    A  96           H5'        A  96   0.452  -4.949  -0.773
  739   H5''    A  96          H5''        A  96   0.795  -6.407  -1.708
  740    H4'    A  96           H4'        A  96  -1.436  -4.383  -2.272
  741    H3'    A  96           H3'        A  96  -1.263  -6.832  -0.630
  742    H2'    A  96           H2'        A  96  -2.730  -8.219  -1.820
  743   HO2'    A  96          HO2'        A  96  -4.369  -6.518  -2.010
  744    H1'    A  96           H1'        A  96  -2.139  -7.580  -4.357
  745    H8     A  96           H8         A  96   1.271  -7.201  -3.590
  746    H61    A  96           H61        A  96   1.741 -13.195  -2.079
  747    H62    A  96           H62        A  96   2.635 -11.754  -2.524
  748    H2     A  96           H2         A  96  -2.553 -12.098  -2.017
  749   HO5'    A  96          H5T         A  96   2.107  -4.608  -2.310
  750    H5'    U  97           H5'        U  97  -2.890  -7.587   1.024
  751   H5''    U  97          H5''        U  97  -3.392  -6.890   2.575
  752    H4'    U  97           H4'        U  97  -1.046  -7.476   3.432
  753    H3'    U  97           H3'        U  97  -0.652  -8.361   0.741
  754    H2'    U  97           H2'        U  97  -1.071 -10.634   0.788
  755   HO2'    U  97          HO2'        U  97   0.799 -10.761   2.312
  756    H1'    U  97           H1'        U  97  -2.413 -11.120   3.123
  757    H3     U  97           H3         U  97  -6.656 -11.074   1.586
  758    H5     U  97           H5         U  97  -4.395  -9.380  -1.520
  759    H6     U  97           H6         U  97  -2.486  -9.309  -0.017
  760    H5'    C  98           H5'        C  98   3.599  -6.939   0.311
  761   H5''    C  98          H5''        C  98   3.142  -8.650   0.357
  762    H4'    C  98           H4'        C  98   5.558  -7.513   1.818
  763    H3'    C  98           H3'        C  98   5.514  -7.428  -0.896
  764    H2'    C  98           H2'        C  98   4.544  -9.614  -1.143
  765   HO2'    C  98          HO2'        C  98   6.478  -9.450  -2.446
  766    H1'    C  98           H1'        C  98   6.614 -10.784   0.703
  767    H41    C  98           H41        C  98   2.507 -15.585  -0.066
  768    H42    C  98           H42        C  98   1.168 -14.597   0.492
  769    H5     C  98           H5         C  98   1.431 -12.240   1.079
  770    H6     C  98           H6         C  98   3.031 -10.395   1.212
  771    H5'    A  99           H5'        A  99   9.189  -7.609  -2.097
  772   H5''    A  99          H5''        A  99  10.249  -6.468  -1.252
  773    H4'    A  99           H4'        A  99  10.567  -6.013  -3.550
  774    H3'    A  99           H3'        A  99   9.407  -4.026  -1.876
  775    H2'    A  99           H2'        A  99   7.320  -4.066  -3.062
  776   HO2'    A  99          HO2'        A  99   8.744  -2.045  -3.669
  777    H1'    A  99           H1'        A  99   9.020  -4.652  -5.492
  778    H8     A  99           H8         A  99   7.302  -3.589  -7.064
  779    H61    A  99           H61        A  99   2.017  -6.845  -7.177
  780    H62    A  99           H62        A  99   2.955  -5.599  -7.978
  781    H2     A  99           H2         A  99   4.371  -8.138  -3.632
  782    H5'    A 100           H5'        A 100  13.382  -3.505  -3.547
  783   H5''    A 100          H5''        A 100  14.215  -1.975  -3.326
  784    H4'    A 100           H4'        A 100  14.911  -3.401  -5.363
  785    H3'    A 100           H3'        A 100  15.000  -0.720  -4.908
  786    H2'    A 100           H2'        A 100  12.833  -0.288  -5.854
  787   HO2'    A 100          HO2'        A 100  14.370   1.074  -6.929
  788    H1'    A 100           H1'        A 100  13.639  -2.085  -8.153
  789    H8     A 100           H8         A 100  10.548  -1.925  -5.834
  790    H61    A 100           H61        A 100   7.473  -0.240 -10.987
  791    H62    A 100           H62        A 100   7.282  -0.684  -9.302
  792    H2     A 100           H2         A 100  11.766  -0.544 -11.975
  793    H5'    A 101           H5'        A 101  16.627   0.853  -7.198
  794   H5''    A 101          H5''        A 101  18.262   0.402  -7.702
  795    H4'    A 101           H4'        A 101  18.017   2.823  -7.317
  796    H3'    A 101           H3'        A 101  20.165   1.304  -6.602
  797   HO3'    A 101          H3T         A 101  21.143   3.374  -6.123
  798    H2'    A 101           H2'        A 101  19.548   0.847  -4.402
  799   HO2'    A 101          HO2'        A 101  21.526   1.984  -4.227
  800    H1'    A 101           H1'        A 101  18.543   3.650  -3.934
  801    H8     A 101           H8         A 101  18.127  -0.147  -3.382
  802    H61    A 101           H61        A 101  15.200   1.551   1.836
  803    H62    A 101           H62        A 101  15.864   0.190   0.950
  804    H2     A 101           H2         A 101  15.884   5.180  -0.617
  Start of MODEL   16
    1    H1   MET   1           H1       MET   1  -3.898   3.788  -0.038
    2    H2   MET   1           H2       MET   1  -3.326   2.245   0.037
    3    H3   MET   1           H3       MET   1  -4.532   2.628  -1.015
    4    HA   MET   1           HA       MET   1  -3.085   4.037  -2.287
    5    HB2  MET   1           HB2      MET   1  -1.624   4.845  -0.584
    6    HB3  MET   1           HB3      MET   1  -1.071   3.219  -0.176
    7    HG2  MET   1           HG2      MET   1   0.480   4.675  -1.611
    8    HG3  MET   1           HG3      MET   1   0.205   3.018  -2.126
    9    HE1  MET   1           HE1      MET   1  -2.496   5.863  -2.659
   10    HE2  MET   1           HE2      MET   1  -0.957   6.769  -2.770
   11    HE3  MET   1           HE3      MET   1  -1.977   6.536  -4.213
   12    H    VAL   2           H        VAL   2  -3.426   2.954  -3.992
   13    HA   VAL   2           HA       VAL   2  -1.625   0.677  -4.518
   14    HB   VAL   2           HB       VAL   2  -3.715  -0.414  -4.210
   15   HG11  VAL   2          1HG1      VAL   2  -5.009   1.641  -6.052
   16   HG12  VAL   2          HG21      VAL   2  -5.790   0.215  -5.346
   17   HG13  VAL   2          HG31      VAL   2  -5.247   1.528  -4.291
   18   HG21  VAL   2          HG32      VAL   2  -3.373   0.175  -7.174
   19   HG22  VAL   2          1HG2      VAL   2  -2.388  -0.981  -6.246
   20   HG23  VAL   2          HG22      VAL   2  -4.138  -1.273  -6.472
   21    H    GLU   3           H        GLU   3  -0.318   1.246  -6.095
   22    HA   GLU   3           HA       GLU   3  -1.282   3.102  -8.211
   23    HB2  GLU   3           HB2      GLU   3   0.886   4.310  -8.044
   24    HB3  GLU   3           HB3      GLU   3  -0.166   4.523  -6.634
   25    HG2  GLU   3           HG2      GLU   3   1.166   2.681  -5.484
   26    HG3  GLU   3           HG3      GLU   3   2.316   2.790  -6.825
   27    H    ALA   4           H        ALA   4  -0.914   2.398 -10.155
   28    HA   ALA   4           HA       ALA   4   1.257   0.410 -10.623
   29    HB1  ALA   4           1HB      ALA   4  -1.396   0.843 -12.067
   30    HB2  ALA   4           HB2      ALA   4  -0.144  -0.327 -12.534
   31    HB3  ALA   4           HB3      ALA   4  -0.997  -0.510 -10.986
   32    H    ASP   5           H        ASP   5   2.937   1.481 -11.378
   33    HA   ASP   5           HA       ASP   5   2.862   4.161 -12.163
   34    HB2  ASP   5           HB2      ASP   5   4.817   2.958 -11.265
   35    HB3  ASP   5           HB3      ASP   5   4.975   2.061 -12.772
   36    H    ARG   6           H        ARG   6   3.054   1.290 -14.351
   37    HA   ARG   6           HA       ARG   6   1.702   2.838 -16.400
   38    HB2  ARG   6           HB2      ARG   6   3.468   2.761 -18.079
   39    HB3  ARG   6           HB3      ARG   6   4.032   3.643 -16.655
   40    HG2  ARG   6           HG2      ARG   6   5.137   1.479 -15.875
   41    HG3  ARG   6           HG3      ARG   6   4.732   0.796 -17.471
   42    HD2  ARG   6           2HD      ARG   6   6.986   1.634 -17.591
   43    HD3  ARG   6           3HD      ARG   6   5.949   2.725 -18.533
   44    HE   ARG   6           HE       ARG   6   6.328   3.512 -15.735
   45   HH11  ARG   6          1HH1      ARG   6   7.638   3.793 -19.012
   46   HH12  ARG   6          2HH1      ARG   6   8.481   5.282 -18.660
   47   HH21  ARG   6          1HH2      ARG   6   7.411   5.419 -15.316
   48   HH22  ARG   6          2HH2      ARG   6   8.354   6.211 -16.562
   49    HA   PRO   7           HA       PRO   7   0.378  -1.316 -17.390
   50    HB2  PRO   7           HB2      PRO   7   0.259  -0.101 -20.151
   51    HB3  PRO   7           HB3      PRO   7  -0.977  -1.130 -19.347
   52    HG2  PRO   7           HG2      PRO   7  -1.318   1.513 -19.537
   53    HG3  PRO   7           HG3      PRO   7  -1.640   0.708 -17.957
   54    HD2  PRO   7           2HD      PRO   7   0.833   2.252 -18.808
   55    HD3  PRO   7           3HD      PRO   7  -0.058   2.316 -17.251
   56    H    GLY   8           H        GLY   8   1.533  -3.154 -18.088
   57    HA2  GLY   8           2HA      GLY   8   2.813  -4.300 -19.722
   58    HA3  GLY   8           3HA      GLY   8   3.528  -2.757 -20.242
   59    H    LYS   9           H        LYS   9   3.690  -2.268 -17.026
   60    HA   LYS   9           HA       LYS   9   6.353  -3.547 -16.908
   61    HB2  LYS   9           HB2      LYS   9   6.275  -1.187 -16.308
   62    HB3  LYS   9           HB3      LYS   9   5.135  -1.552 -14.981
   63    HG2  LYS   9           HG2      LYS   9   6.754  -3.126 -13.991
   64    HG3  LYS   9           HG3      LYS   9   7.870  -2.877 -15.339
   65    HD2  LYS   9           2HD      LYS   9   6.969  -0.692 -13.425
   66    HD3  LYS   9           3HD      LYS   9   8.443  -1.665 -13.224
   67    HE2  LYS   9           HE2      LYS   9   7.831   0.019 -15.693
   68    HE3  LYS   9           HE3      LYS   9   8.809   0.575 -14.321
   69    HZ1  LYS   9           3HZ      LYS   9   9.410  -1.707 -16.084
   70    HZ2  LYS   9           1HZ      LYS   9  10.227  -0.296 -16.021
   71    HZ3  LYS   9           2HZ      LYS   9  10.282  -1.314 -14.741
   72    H    LEU  10           H        LEU  10   6.684  -5.364 -15.829
   73    HA   LEU  10           HA       LEU  10   4.413  -6.417 -14.210
   74    HB2  LEU  10           HB2      LEU  10   6.572  -7.736 -15.859
   75    HB3  LEU  10           HB3      LEU  10   5.522  -8.663 -14.834
   76    HG   LEU  10           HG       LEU  10   4.642  -6.957 -17.209
   77   HD11  LEU  10          1HD1      LEU  10   4.506  -9.969 -16.717
   78   HD12  LEU  10          2HD1      LEU  10   4.254  -9.117 -18.257
   79   HD13  LEU  10          3HD1      LEU  10   5.880  -9.201 -17.519
   80   HD21  LEU  10          3HD2      LEU  10   3.025  -8.674 -15.290
   81   HD22  LEU  10          1HD2      LEU  10   2.848  -6.918 -15.600
   82   HD23  LEU  10          2HD2      LEU  10   2.439  -8.103 -16.867
   83    H    PHE  11           H        PHE  11   4.821  -7.446 -12.290
   84    HA   PHE  11           HA       PHE  11   7.507  -7.065 -11.061
   85    HB2  PHE  11           HB2      PHE  11   5.777  -6.031  -9.754
   86    HB3  PHE  11           HB3      PHE  11   4.712  -7.433  -9.934
   87    HD1  PHE  11           HD2      PHE  11   7.984  -6.363  -8.481
   88    HD2  PHE  11           HD1      PHE  11   4.745  -9.188  -8.358
   89    HE1  PHE  11           HE2      PHE  11   8.911  -7.333  -6.398
   90    HE2  PHE  11           HE1      PHE  11   5.684 -10.166  -6.275
   91    HZ   PHE  11           HZ       PHE  11   7.783  -9.237  -5.314
   92    H    ILE  12           H        ILE  12   8.703  -8.843 -10.673
   93    HA   ILE  12           HA       ILE  12   7.431 -11.470 -11.288
   94    HB   ILE  12           HB       ILE  12  10.337 -10.788 -11.775
   95   HG12  ILE  12          HG21      ILE  12   9.209  -9.145 -13.132
   96   HG13  ILE  12          HG31      ILE  12   9.906 -10.414 -14.127
   97   HG21  ILE  12          1HG2      ILE  12   8.397 -12.816 -12.940
   98   HG22  ILE  12          HG22      ILE  12  10.121 -12.665 -13.368
   99   HG23  ILE  12          HG32      ILE  12   9.643 -13.153 -11.721
  100   HD11  ILE  12          3HD1      ILE  12   7.616 -11.462 -14.309
  101   HD12  ILE  12          1HD1      ILE  12   6.968 -10.037 -13.457
  102   HD13  ILE  12          2HD1      ILE  12   7.766  -9.846 -15.031
  103    H    GLY  13           H        GLY  13   7.006 -11.693  -8.914
  104    HA2  GLY  13           2HA      GLY  13   9.428 -11.677  -7.207
  105    HA3  GLY  13           3HA      GLY  13   7.765 -11.745  -6.655
  106    H    GLY  14           H        GLY  14  10.289 -13.475  -6.207
  107    HA2  GLY  14           2HA      GLY  14  10.027 -15.602  -5.138
  108    HA3  GLY  14           3HA      GLY  14   8.772 -16.035  -6.309
  109    H    LEU  15           H        LEU  15  11.320 -14.436  -7.868
  110    HA   LEU  15           HA       LEU  15  12.001 -16.651  -9.495
  111    HB2  LEU  15           HB2      LEU  15  13.501 -14.077  -8.880
  112    HB3  LEU  15           HB3      LEU  15  13.862 -15.211 -10.218
  113    HG   LEU  15           HG       LEU  15  11.124 -13.982 -10.058
  114   HD11  LEU  15          1HD1      LEU  15  13.661 -12.788 -11.270
  115   HD12  LEU  15          2HD1      LEU  15  12.010 -12.202 -11.572
  116   HD13  LEU  15          3HD1      LEU  15  12.702 -12.088  -9.939
  117   HD21  LEU  15          3HD2      LEU  15  11.808 -15.897 -11.608
  118   HD22  LEU  15          1HD2      LEU  15  11.242 -14.442 -12.468
  119   HD23  LEU  15          2HD2      LEU  15  12.979 -14.792 -12.348
  120    H    ASN  16           H        ASN  16  14.122 -17.638  -9.801
  121    HA   ASN  16           HA       ASN  16  15.250 -18.674  -7.394
  122    HB2  ASN  16           HB2      ASN  16  15.009 -19.803  -9.602
  123    HB3  ASN  16           HB3      ASN  16  16.305 -18.751 -10.224
  124   HD21  ASN  16          2HD2      ASN  16  17.232 -20.893 -10.701
  125   HD22  ASN  16          1HD2      ASN  16  18.127 -21.699  -9.460
  126    H    THR  17           H        THR  17  17.566 -18.466  -6.801
  127    HA   THR  17           HA       THR  17  18.462 -15.703  -6.820
  128    HB   THR  17           HB       THR  17  20.304 -16.598  -5.438
  129    HG1  THR  17           1HG      THR  17  20.539 -18.619  -6.406
  130   HG21  THR  17          1HG2      THR  17  17.609 -17.801  -4.689
  131   HG22  THR  17          HG22      THR  17  18.936 -17.395  -3.572
  132   HG23  THR  17          HG32      THR  17  18.069 -16.097  -4.434
  133    H    GLU  18           H        GLU  18  18.549 -17.992  -9.139
  134    HA   GLU  18           HA       GLU  18  21.379 -17.589  -9.957
  135    HB2  GLU  18           HB2      GLU  18  19.447 -19.710 -10.915
  136    HB3  GLU  18           HB3      GLU  18  21.217 -19.742 -10.983
  137    HG2  GLU  18           HG2      GLU  18  19.516 -19.847  -8.444
  138    HG3  GLU  18           HG3      GLU  18  20.260 -21.232  -9.194
  139    H    THR  19           H        THR  19  18.267 -16.510 -10.606
  140    HA   THR  19           HA       THR  19  18.420 -16.481 -13.530
  141    HB   THR  19           HB       THR  19  16.470 -15.096 -11.650
  142    HG1  THR  19           1HG      THR  19  15.213 -16.956 -12.025
  143   HG21  THR  19          1HG2      THR  19  16.373 -14.281 -13.977
  144   HG22  THR  19          HG22      THR  19  16.260 -15.956 -14.566
  145   HG23  THR  19          HG32      THR  19  14.939 -15.255 -13.599
  146    H    ASN  20           H        ASN  20  18.779 -14.684 -14.822
  147    HA   ASN  20           HA       ASN  20  19.402 -12.127 -13.438
  148    HB2  ASN  20           HB2      ASN  20  20.918 -12.710 -15.909
  149    HB3  ASN  20           HB3      ASN  20  21.390 -11.789 -14.481
  150   HD21  ASN  20          2HD2      ASN  20  21.329 -14.866 -16.098
  151   HD22  ASN  20          1HD2      ASN  20  22.310 -15.746 -14.943
  152    H    GLU  21           H        GLU  21  19.929 -10.629 -15.657
  153    HA   GLU  21           HA       GLU  21  17.244 -10.014 -16.493
  154    HB2  GLU  21           HB2      GLU  21  19.981  -9.031 -17.378
  155    HB3  GLU  21           HB3      GLU  21  18.444  -8.315 -17.930
  156    HG2  GLU  21           HG2      GLU  21  17.823  -7.710 -15.690
  157    HG3  GLU  21           HG3      GLU  21  19.152  -8.653 -15.006
  158    H    LYS  22           H        LYS  22  19.988 -11.741 -18.031
  159    HA   LYS  22           HA       LYS  22  18.878 -11.603 -20.663
  160    HB2  LYS  22           HB2      LYS  22  21.262 -11.979 -20.188
  161    HB3  LYS  22           HB3      LYS  22  20.892 -13.529 -19.420
  162    HG2  LYS  22           HG2      LYS  22  21.726 -13.712 -21.796
  163    HG3  LYS  22           HG3      LYS  22  20.169 -14.500 -21.493
  164    HD2  LYS  22           2HD      LYS  22  20.115 -13.252 -23.617
  165    HD3  LYS  22           3HD      LYS  22  18.986 -12.553 -22.444
  166    HE2  LYS  22           HE2      LYS  22  20.770 -10.863 -21.842
  167    HE3  LYS  22           HE3      LYS  22  21.758 -11.517 -23.165
  168    HZ1  LYS  22           3HZ      LYS  22  19.925 -10.938 -24.657
  169    HZ2  LYS  22           1HZ      LYS  22  19.120 -10.235 -23.400
  170    HZ3  LYS  22           2HZ      LYS  22  20.552  -9.625 -23.899
  171    H    ALA  23           H        ALA  23  18.288 -13.711 -17.934
  172    HA   ALA  23           HA       ALA  23  16.979 -15.769 -19.597
  173    HB1  ALA  23           1HB      ALA  23  17.241 -15.436 -16.572
  174    HB2  ALA  23           HB2      ALA  23  16.585 -16.864 -17.401
  175    HB3  ALA  23           HB3      ALA  23  18.296 -16.423 -17.600
  176    H    LEU  24           H        LEU  24  16.297 -12.839 -17.932
  177    HA   LEU  24           HA       LEU  24  13.458 -13.332 -17.490
  178    HB2  LEU  24           HB2      LEU  24  15.670 -11.573 -16.667
  179    HB3  LEU  24           HB3      LEU  24  14.256 -10.605 -16.994
  180    HG   LEU  24           HG       LEU  24  14.190 -13.154 -15.352
  181   HD11  LEU  24          1HD1      LEU  24  15.818 -11.662 -14.276
  182   HD12  LEU  24          2HD1      LEU  24  14.654 -10.314 -14.334
  183   HD13  LEU  24          3HD1      LEU  24  14.335 -11.734 -13.307
  184   HD21  LEU  24          3HD2      LEU  24  12.152 -12.144 -14.371
  185   HD22  LEU  24          1HD2      LEU  24  12.424 -10.655 -15.304
  186   HD23  LEU  24          2HD2      LEU  24  12.034 -12.167 -16.151
  187    H    GLU  25           H        GLU  25  15.628 -11.769 -19.773
  188    HA   GLU  25           HA       GLU  25  13.483 -10.442 -21.218
  189    HB2  GLU  25           HB2      GLU  25  16.384 -11.149 -21.910
  190    HB3  GLU  25           HB3      GLU  25  15.304 -10.286 -23.027
  191    HG2  GLU  25           HG2      GLU  25  14.937  -8.561 -21.342
  192    HG3  GLU  25           HG3      GLU  25  16.101  -9.335 -20.256
  193    H    ALA  26           H        ALA  26  15.165 -13.483 -21.221
  194    HA   ALA  26           HA       ALA  26  14.381 -14.318 -23.899
  195    HB1  ALA  26           1HB      ALA  26  15.601 -15.788 -21.532
  196    HB2  ALA  26           HB2      ALA  26  15.508 -16.429 -23.192
  197    HB3  ALA  26           HB3      ALA  26  16.505 -14.991 -22.849
  198    H    VAL  27           H        VAL  27  13.008 -14.480 -20.702
  199    HA   VAL  27           HA       VAL  27  11.292 -16.773 -21.450
  200    HB   VAL  27           HB       VAL  27  12.753 -16.644 -19.432
  201   HG11  VAL  27          1HG1      VAL  27  10.548 -14.913 -18.318
  202   HG12  VAL  27          HG21      VAL  27  12.031 -15.462 -17.483
  203   HG13  VAL  27          HG31      VAL  27  12.156 -14.303 -18.831
  204   HG21  VAL  27          HG32      VAL  27  11.072 -17.672 -17.943
  205   HG22  VAL  27          1HG2      VAL  27   9.763 -17.032 -18.971
  206   HG23  VAL  27          HG22      VAL  27  10.891 -18.263 -19.626
  207    H    PHE  28           H        PHE  28  11.169 -13.381 -20.413
  208    HA   PHE  28           HA       PHE  28   8.218 -13.417 -20.669
  209    HB2  PHE  28           HB2      PHE  28  10.138 -11.260 -19.787
  210    HB3  PHE  28           HB3      PHE  28   8.406 -11.009 -20.024
  211    HD1  PHE  28           HD2      PHE  28   6.732 -12.110 -18.610
  212    HD2  PHE  28           HD1      PHE  28  10.940 -12.531 -17.865
  213    HE1  PHE  28           HE2      PHE  28   6.243 -13.021 -16.359
  214    HE2  PHE  28           HE1      PHE  28  10.464 -13.449 -15.623
  215    HZ   PHE  28           HZ       PHE  28   8.108 -13.687 -14.857
  216    H    GLY  29           H        GLY  29  10.947 -12.893 -22.682
  217    HA2  GLY  29           2HA      GLY  29   9.677 -10.993 -24.485
  218    HA3  GLY  29           3HA      GLY  29  11.127 -11.955 -24.813
  219    H    LYS  30           H        LYS  30   8.964 -14.143 -23.681
  220    HA   LYS  30           HA       LYS  30   8.396 -15.224 -26.313
  221    HB2  LYS  30           HB2      LYS  30   7.640 -16.119 -23.484
  222    HB3  LYS  30           HB3      LYS  30   7.560 -17.123 -24.948
  223    HG2  LYS  30           HG2      LYS  30   9.984 -16.938 -25.236
  224    HG3  LYS  30           HG3      LYS  30  10.109 -15.854 -23.855
  225    HD2  LYS  30           2HD      LYS  30  10.789 -18.164 -23.268
  226    HD3  LYS  30           3HD      LYS  30   9.451 -17.572 -22.293
  227    HE2  LYS  30           HE2      LYS  30   9.029 -19.856 -22.903
  228    HE3  LYS  30           HE3      LYS  30   7.842 -18.810 -23.690
  229    HZ1  LYS  30           3HZ      LYS  30   8.734 -20.462 -25.202
  230    HZ2  LYS  30           1HZ      LYS  30   9.150 -18.955 -25.706
  231    HZ3  LYS  30           2HZ      LYS  30  10.262 -19.918 -24.969
  232    H    TYR  31           H        TYR  31   6.891 -13.106 -24.167
  233    HA   TYR  31           HA       TYR  31   4.161 -13.755 -25.187
  234    HB2  TYR  31           HB2      TYR  31   5.085 -12.227 -22.742
  235    HB3  TYR  31           HB3      TYR  31   3.404 -12.559 -23.161
  236    HD1  TYR  31           HD1      TYR  31   2.798 -15.128 -23.363
  237    HD2  TYR  31           HD2      TYR  31   6.326 -13.630 -21.419
  238    HE1  TYR  31           HE1      TYR  31   3.045 -17.286 -22.170
  239    HE2  TYR  31           HE2      TYR  31   6.566 -15.794 -20.190
  240    HH   TYR  31           HH       TYR  31   4.316 -18.530 -20.750
  241    H    GLY  32           H        GLY  32   6.686 -11.315 -25.280
  242    HA2  GLY  32           2HA      GLY  32   5.312  -9.738 -27.206
  243    HA3  GLY  32           3HA      GLY  32   5.155  -8.966 -25.609
  244    H    ARG  33           H        ARG  33   6.410  -7.657 -27.697
  245    HA   ARG  33           HA       ARG  33   9.239  -8.043 -27.546
  246    HB2  ARG  33           HB2      ARG  33   7.787  -6.987 -29.412
  247    HB3  ARG  33           HB3      ARG  33   7.795  -5.511 -28.407
  248    HG2  ARG  33           HG2      ARG  33  10.280  -5.567 -28.386
  249    HG3  ARG  33           HG3      ARG  33  10.215  -7.088 -29.311
  250    HD2  ARG  33           2HD      ARG  33   9.119  -4.412 -30.283
  251    HD3  ARG  33           3HD      ARG  33  10.711  -5.047 -30.709
  252    HE   ARG  33           HE       ARG  33   9.685  -6.828 -31.947
  253   HH11  ARG  33          1HH1      ARG  33   7.355  -4.403 -30.795
  254   HH12  ARG  33          2HH1      ARG  33   6.143  -4.871 -31.965
  255   HH21  ARG  33          1HH2      ARG  33   8.081  -7.390 -33.438
  256   HH22  ARG  33          2HH2      ARG  33   6.543  -6.555 -33.439
  257    H    ILE  34           H        ILE  34  10.409  -7.617 -25.906
  258    HA   ILE  34           HA       ILE  34   9.544  -5.976 -23.670
  259    HB   ILE  34           HB       ILE  34  12.153  -7.375 -24.358
  260   HG12  ILE  34          HG21      ILE  34   9.793  -7.991 -22.532
  261   HG13  ILE  34          HG31      ILE  34  10.255  -8.858 -23.998
  262   HG21  ILE  34          1HG2      ILE  34  12.583  -5.437 -22.858
  263   HG22  ILE  34          HG22      ILE  34  11.339  -6.049 -21.736
  264   HG23  ILE  34          HG32      ILE  34  12.835  -6.974 -22.049
  265   HD11  ILE  34          3HD1      ILE  34  10.990 -10.138 -22.077
  266   HD12  ILE  34          1HD1      ILE  34  12.416  -9.499 -22.928
  267   HD13  ILE  34          2HD1      ILE  34  11.850  -8.743 -21.411
  268    H    VAL  35           H        VAL  35  10.220  -3.987 -23.021
  269    HA   VAL  35           HA       VAL  35  11.961  -2.483 -24.906
  270    HB   VAL  35           HB       VAL  35  10.434  -0.665 -23.311
  271   HG11  VAL  35          1HG1      VAL  35  11.439  -0.261 -25.515
  272   HG12  VAL  35          HG21      VAL  35  10.295  -1.405 -26.255
  273   HG13  VAL  35          HG31      VAL  35   9.700   0.104 -25.522
  274   HG21  VAL  35          HG32      VAL  35   8.712  -2.389 -23.009
  275   HG22  VAL  35          1HG2      VAL  35   8.148  -1.122 -24.116
  276   HG23  VAL  35          HG22      VAL  35   8.668  -2.684 -24.764
  277    H    GLU  36           H        GLU  36  11.456  -3.618 -21.675
  278    HA   GLU  36           HA       GLU  36  14.090  -2.647 -20.895
  279    HB2  GLU  36           HB2      GLU  36  12.676  -0.675 -20.378
  280    HB3  GLU  36           HB3      GLU  36  11.589  -1.705 -19.428
  281    HG2  GLU  36           HG2      GLU  36  13.428  -2.219 -17.867
  282    HG3  GLU  36           HG3      GLU  36  14.522  -1.209 -18.829
  283    H    VAL  37           H        VAL  37  14.954  -3.947 -19.236
  284    HA   VAL  37           HA       VAL  37  13.045  -5.615 -17.713
  285    HB   VAL  37           HB       VAL  37  15.282  -6.656 -19.420
  286   HG11  VAL  37          1HG1      VAL  37  16.089  -7.256 -17.163
  287   HG12  VAL  37          HG21      VAL  37  14.483  -7.905 -16.760
  288   HG13  VAL  37          HG31      VAL  37  15.468  -8.675 -18.023
  289   HG21  VAL  37          HG32      VAL  37  13.676  -8.556 -19.574
  290   HG22  VAL  37          1HG2      VAL  37  12.627  -7.767 -18.384
  291   HG23  VAL  37          HG22      VAL  37  12.885  -7.008 -19.974
  292    H    LEU  38           H        LEU  38  13.495  -5.896 -15.669
  293    HA   LEU  38           HA       LEU  38  16.022  -4.721 -14.519
  294    HB2  LEU  38           HB2      LEU  38  13.154  -4.520 -13.912
  295    HB3  LEU  38           HB3      LEU  38  14.165  -4.702 -12.493
  296    HG   LEU  38           HG       LEU  38  14.696  -2.577 -14.620
  297   HD11  LEU  38          1HD1      LEU  38  13.701  -0.994 -12.996
  298   HD12  LEU  38          2HD1      LEU  38  12.507  -2.194 -13.537
  299   HD13  LEU  38          3HD1      LEU  38  13.274  -2.357 -11.937
  300   HD21  LEU  38          3HD2      LEU  38  15.668  -2.881 -11.757
  301   HD22  LEU  38          1HD2      LEU  38  16.649  -3.186 -13.218
  302   HD23  LEU  38          2HD2      LEU  38  16.062  -1.549 -12.863
  303    H    LEU  39           H        LEU  39  16.887  -5.813 -12.747
  304    HA   LEU  39           HA       LEU  39  15.555  -8.222 -11.837
  305    HB2  LEU  39           HB2      LEU  39  16.847  -9.020 -13.757
  306    HB3  LEU  39           HB3      LEU  39  18.294  -8.185 -13.187
  307    HG   LEU  39           HG       LEU  39  18.108 -10.715 -12.972
  308   HD11  LEU  39          1HD1      LEU  39  18.851  -9.169 -10.467
  309   HD12  LEU  39          2HD1      LEU  39  19.448 -10.763 -10.955
  310   HD13  LEU  39          3HD1      LEU  39  19.868  -9.335 -11.929
  311   HD21  LEU  39          3HD2      LEU  39  15.870 -10.813 -11.921
  312   HD22  LEU  39          1HD2      LEU  39  17.133 -11.642 -10.984
  313   HD23  LEU  39          2HD2      LEU  39  16.544 -10.053 -10.450
  314    H    MET  40           H        MET  40  15.736  -8.101  -9.626
  315    HA   MET  40           HA       MET  40  17.623  -6.046  -8.669
  316    HB2  MET  40           HB2      MET  40  15.469  -7.378  -7.013
  317    HB3  MET  40           HB3      MET  40  16.274  -5.839  -6.741
  318    HG2  MET  40           HG2      MET  40  14.001  -6.546  -8.518
  319    HG3  MET  40           HG3      MET  40  14.264  -5.097  -7.559
  320    HE1  MET  40           HE3      MET  40  16.830  -3.229 -10.038
  321    HE2  MET  40           HE1      MET  40  15.875  -2.955  -8.553
  322    HE3  MET  40           HE2      MET  40  17.127  -4.206  -8.566
  323    H    LYS  41           H        LYS  41  19.291  -6.407  -7.292
  324    HA   LYS  41           HA       LYS  41  19.534  -9.043  -6.029
  325    HB2  LYS  41           HB2      LYS  41  22.061  -8.907  -6.953
  326    HB3  LYS  41           HB3      LYS  41  20.774  -9.853  -7.703
  327    HG2  LYS  41           HG2      LYS  41  20.314  -8.126  -9.308
  328    HG3  LYS  41           HG3      LYS  41  21.494  -7.025  -8.546
  329    HD2  LYS  41           2HD      LYS  41  23.294  -8.709  -9.066
  330    HD3  LYS  41           3HD      LYS  41  22.081  -9.725  -9.855
  331    HE2  LYS  41           HE2      LYS  41  23.192  -8.457 -11.577
  332    HE3  LYS  41           HE3      LYS  41  21.558  -7.788 -11.391
  333    HZ1  LYS  41           3HZ      LYS  41  23.237  -6.076 -11.528
  334    HZ2  LYS  41           1HZ      LYS  41  22.501  -6.031 -10.062
  335    HZ3  LYS  41           2HZ      LYS  41  24.012  -6.671 -10.206
  336    H    ASP  42           H        ASP  42  21.074  -9.172  -4.386
  337    HA   ASP  42           HA       ASP  42  21.265  -6.859  -2.758
  338    HB2  ASP  42           HB2      ASP  42  21.255  -9.433  -2.264
  339    HB3  ASP  42           HB3      ASP  42  23.005  -9.297  -2.476
  340    H    ARG  43           H        ARG  43  23.154  -5.728  -2.020
  341    HA   ARG  43           HA       ARG  43  25.157  -5.408  -4.163
  342    HB2  ARG  43           HB2      ARG  43  25.642  -3.302  -3.283
  343    HB3  ARG  43           HB3      ARG  43  23.885  -3.448  -3.225
  344    HG2  ARG  43           HG2      ARG  43  25.807  -3.803  -0.881
  345    HG3  ARG  43           HG3      ARG  43  24.828  -2.373  -1.200
  346    HD2  ARG  43           2HD      ARG  43  23.757  -5.144  -0.541
  347    HD3  ARG  43           3HD      ARG  43  23.834  -3.765   0.555
  348    HE   ARG  43           HE       ARG  43  22.398  -2.756  -1.545
  349   HH11  ARG  43          1HH1      ARG  43  22.067  -5.701   0.377
  350   HH12  ARG  43          2HH1      ARG  43  20.327  -5.729   0.253
  351   HH21  ARG  43          1HH2      ARG  43  20.123  -2.822  -1.704
  352   HH22  ARG  43          2HH2      ARG  43  19.228  -4.113  -0.943
  353    H    GLU  44           H        GLU  44  24.876  -7.175  -1.336
  354    HA   GLU  44           HA       GLU  44  27.805  -7.074  -0.771
  355    HB2  GLU  44           HB2      GLU  44  25.457  -8.169   0.815
  356    HB3  GLU  44           HB3      GLU  44  27.155  -8.286   1.314
  357    HG2  GLU  44           HG2      GLU  44  25.641  -5.682   0.835
  358    HG3  GLU  44           HG3      GLU  44  25.968  -6.401   2.410
  359    H    THR  45           H        THR  45  25.396  -9.002  -2.324
  360    HA   THR  45           HA       THR  45  27.384 -11.224  -2.503
  361    HB   THR  45           HB       THR  45  25.549 -12.851  -2.470
  362    HG1  THR  45           1HG      THR  45  23.473 -12.067  -1.869
  363   HG21  THR  45          1HG2      THR  45  25.303 -10.950  -0.114
  364   HG22  THR  45          HG22      THR  45  24.942 -12.703  -0.145
  365   HG23  THR  45          HG32      THR  45  26.625 -12.131  -0.336
  366    H    ASN  46           H        ASN  46  25.257  -9.004  -4.100
  367    HA   ASN  46           HA       ASN  46  24.727  -8.725  -6.260
  368    HB2  ASN  46           HB2      ASN  46  27.297  -9.391  -6.249
  369    HB3  ASN  46           HB3      ASN  46  26.715 -10.784  -7.162
  370   HD21  ASN  46          2HD2      ASN  46  28.231  -9.700  -8.778
  371   HD22  ASN  46          1HD2      ASN  46  27.518  -8.513  -9.853
  372    H    LYS  47           H        LYS  47  23.818 -11.239  -4.566
  373    HA   LYS  47           HA       LYS  47  22.731 -12.968  -6.683
  374    HB2  LYS  47           HB2      LYS  47  22.641 -12.959  -3.646
  375    HB3  LYS  47           HB3      LYS  47  21.604 -14.026  -4.590
  376    HG2  LYS  47           HG2      LYS  47  24.596 -13.929  -5.048
  377    HG3  LYS  47           HG3      LYS  47  23.860 -14.970  -3.799
  378    HD2  LYS  47           2HD      LYS  47  22.414 -15.980  -5.598
  379    HD3  LYS  47           3HD      LYS  47  23.338 -15.045  -6.801
  380    HE2  LYS  47           HE2      LYS  47  25.427 -16.110  -5.994
  381    HE3  LYS  47           HE3      LYS  47  24.490 -17.042  -4.818
  382    HZ1  LYS  47           3HZ      LYS  47  24.904 -18.338  -6.785
  383    HZ2  LYS  47           1HZ      LYS  47  23.293 -18.040  -6.672
  384    HZ3  LYS  47           2HZ      LYS  47  24.201 -17.204  -7.747
  385    H    SER  48           H        SER  48  20.624 -13.174  -7.196
  386    HA   SER  48           HA       SER  48  19.044 -10.891  -7.330
  387    HB2  SER  48           HB2      SER  48  18.058 -13.764  -7.352
  388    HB3  SER  48           HB3      SER  48  17.260 -12.352  -8.084
  389    HG   SER  48           HG       SER  48  18.514 -13.531  -9.607
  390    H    ARG  49           H        ARG  49  17.462  -9.974  -6.177
  391    HA   ARG  49           HA       ARG  49  17.205 -10.468  -3.342
  392    HB2  ARG  49           HB2      ARG  49  15.628  -8.819  -5.351
  393    HB3  ARG  49           HB3      ARG  49  15.422  -8.682  -3.595
  394    HG2  ARG  49           HG2      ARG  49  18.163  -8.295  -4.796
  395    HG3  ARG  49           HG3      ARG  49  16.956  -7.021  -5.021
  396    HD2  ARG  49           2HD      ARG  49  17.812  -8.129  -2.334
  397    HD3  ARG  49           3HD      ARG  49  18.417  -6.635  -3.102
  398    HE   ARG  49           HE       ARG  49  15.816  -7.022  -1.809
  399   HH11  ARG  49          1HH1      ARG  49  17.782  -5.066  -3.994
  400   HH12  ARG  49          2HH1      ARG  49  16.790  -3.643  -3.820
  401   HH21  ARG  49          1HH2      ARG  49  14.506  -5.133  -1.606
  402   HH22  ARG  49          2HH2      ARG  49  14.933  -3.688  -2.483
  403    H    GLY  50           H        GLY  50  15.929 -11.987  -6.069
  404    HA2  GLY  50           2HA      GLY  50  14.442 -13.782  -6.109
  405    HA3  GLY  50           3HA      GLY  50  13.771 -13.291  -4.544
  406    H    PHE  51           H        PHE  51  13.953 -10.430  -6.311
  407    HA   PHE  51           HA       PHE  51  11.475 -10.987  -7.831
  408    HB2  PHE  51           HB2      PHE  51  10.313  -9.141  -7.019
  409    HB3  PHE  51           HB3      PHE  51  10.857 -10.053  -5.613
  410    HD1  PHE  51           HD1      PHE  51  12.937  -9.165  -4.337
  411    HD2  PHE  51           HD2      PHE  51  10.795  -6.844  -7.268
  412    HE1  PHE  51           HE1      PHE  51  13.890  -7.075  -3.403
  413    HE2  PHE  51           HE2      PHE  51  11.701  -4.772  -6.287
  414    HZ   PHE  51           HZ       PHE  51  13.272  -4.876  -4.397
  415    H    ALA  52           H        ALA  52  11.014  -9.403  -9.496
  416    HA   ALA  52           HA       ALA  52  13.191  -7.634 -10.327
  417    HB1  ALA  52           1HB      ALA  52  13.949  -9.896 -11.049
  418    HB2  ALA  52           HB2      ALA  52  12.415 -10.109 -11.937
  419    HB3  ALA  52           HB3      ALA  52  13.559  -8.868 -12.449
  420    H    PHE  53           H        PHE  53  12.567  -6.980 -12.803
  421    HA   PHE  53           HA       PHE  53   9.638  -6.739 -13.047
  422    HB2  PHE  53           HB2      PHE  53  11.517  -4.335 -13.029
  423    HB3  PHE  53           HB3      PHE  53   9.811  -4.286 -13.384
  424    HD1  PHE  53           HD2      PHE  53  12.341  -4.983 -10.786
  425    HD2  PHE  53           HD1      PHE  53   8.212  -4.166 -11.608
  426    HE1  PHE  53           HE2      PHE  53  11.919  -4.716  -8.354
  427    HE2  PHE  53           HE1      PHE  53   7.772  -3.905  -9.174
  428    HZ   PHE  53           HZ       PHE  53   9.624  -4.199  -7.547
  429    H    VAL  54           H        VAL  54   8.976  -5.896 -15.191
  430    HA   VAL  54           HA       VAL  54  11.013  -5.722 -17.281
  431    HB   VAL  54           HB       VAL  54  10.701  -8.174 -17.155
  432   HG11  VAL  54          1HG1      VAL  54   8.726  -9.284 -17.495
  433   HG12  VAL  54          HG21      VAL  54   8.709  -8.286 -16.020
  434   HG13  VAL  54          HG31      VAL  54   7.798  -7.737 -17.480
  435   HG21  VAL  54          HG32      VAL  54   9.044  -7.132 -19.502
  436   HG22  VAL  54          1HG2      VAL  54  10.811  -7.004 -19.461
  437   HG23  VAL  54          HG22      VAL  54  10.036  -8.605 -19.446
  438    H    THR  55           H        THR  55  10.303  -4.493 -18.977
  439    HA   THR  55           HA       THR  55   7.435  -3.661 -18.881
  440    HB   THR  55           HB       THR  55   9.756  -2.121 -20.073
  441    HG1  THR  55           1HG      THR  55   9.493  -0.831 -18.248
  442   HG21  THR  55          1HG2      THR  55   6.830  -1.450 -19.535
  443   HG22  THR  55          HG22      THR  55   8.059  -0.272 -20.047
  444   HG23  THR  55          HG32      THR  55   7.608  -1.608 -21.123
  445    H    PHE  56           H        PHE  56   6.187  -4.293 -20.459
  446    HA   PHE  56           HA       PHE  56   7.311  -5.391 -22.960
  447    HB2  PHE  56           HB2      PHE  56   4.574  -5.326 -21.659
  448    HB3  PHE  56           HB3      PHE  56   4.841  -5.917 -23.296
  449    HD1  PHE  56           HD1      PHE  56   6.353  -6.493 -19.848
  450    HD2  PHE  56           HD2      PHE  56   5.058  -8.121 -23.615
  451    HE1  PHE  56           HE1      PHE  56   6.971  -8.757 -19.085
  452    HE2  PHE  56           HE2      PHE  56   5.600 -10.389 -22.825
  453    HZ   PHE  56           HZ       PHE  56   6.506 -10.731 -20.539
  454    H    GLU  57           H        GLU  57   6.571  -4.697 -25.070
  455    HA   GLU  57           HA       GLU  57   6.104  -1.873 -25.338
  456    HB2  GLU  57           HB2      GLU  57   6.238  -4.285 -27.164
  457    HB3  GLU  57           HB3      GLU  57   5.611  -2.740 -27.744
  458    HG2  GLU  57           HG2      GLU  57   7.746  -1.667 -26.810
  459    HG3  GLU  57           HG3      GLU  57   8.391  -3.316 -26.677
  460    H    SER  58           H        SER  58   3.977  -4.715 -25.009
  461    HA   SER  58           HA       SER  58   1.681  -2.837 -25.394
  462    HB2  SER  58           HB2      SER  58   1.643  -4.473 -27.171
  463    HB3  SER  58           HB3      SER  58   1.952  -5.793 -26.024
  464    HG   SER  58           HG       SER  58  -0.278  -5.546 -26.619
  465    HA   PRO  59           HA       PRO  59   0.923  -3.665 -21.174
  466    HB2  PRO  59           HB2      PRO  59  -1.598  -2.727 -20.904
  467    HB3  PRO  59           HB3      PRO  59  -0.261  -1.613 -21.358
  468    HG2  PRO  59           HG2      PRO  59  -2.162  -3.076 -23.208
  469    HG3  PRO  59           HG3      PRO  59  -1.900  -1.304 -23.122
  470    HD2  PRO  59           2HD      PRO  59  -0.504  -2.810 -24.915
  471    HD3  PRO  59           3HD      PRO  59   0.347  -1.540 -23.988
  472    H    ALA  60           H        ALA  60  -0.461  -5.337 -23.793
  473    HA   ALA  60           HA       ALA  60  -2.000  -7.109 -21.968
  474    HB1  ALA  60           1HB      ALA  60  -2.439  -6.563 -24.920
  475    HB2  ALA  60           HB2      ALA  60  -3.390  -7.673 -23.898
  476    HB3  ALA  60           HB3      ALA  60  -3.416  -5.930 -23.567
  477    H    ASP  61           H        ASP  61   0.717  -6.873 -24.162
  478    HA   ASP  61           HA       ASP  61   1.022  -9.740 -24.502
  479    HB2  ASP  61           HB2      ASP  61   3.001  -7.411 -24.533
  480    HB3  ASP  61           HB3      ASP  61   3.442  -9.048 -24.833
  481    H    ALA  62           H        ALA  62   1.690  -7.293 -22.057
  482    HA   ALA  62           HA       ALA  62   3.267  -8.992 -20.336
  483    HB1  ALA  62           1HB      ALA  62   2.871  -7.162 -18.711
  484    HB2  ALA  62           HB2      ALA  62   3.445  -6.554 -20.294
  485    HB3  ALA  62           HB3      ALA  62   1.726  -6.410 -19.848
  486    H    LYS  63           H        LYS  63  -0.209  -8.314 -20.799
  487    HA   LYS  63           HA       LYS  63  -1.063  -9.599 -18.347
  488    HB2  LYS  63           HB2      LYS  63  -2.455  -9.074 -21.009
  489    HB3  LYS  63           HB3      LYS  63  -3.261  -9.770 -19.593
  490    HG2  LYS  63           HG2      LYS  63  -2.800  -7.770 -18.266
  491    HG3  LYS  63           HG3      LYS  63  -1.829  -7.096 -19.581
  492    HD2  LYS  63           2HD      LYS  63  -4.072  -6.055 -19.559
  493    HD3  LYS  63           3HD      LYS  63  -3.822  -6.970 -21.033
  494    HE2  LYS  63           HE2      LYS  63  -6.034  -7.499 -20.233
  495    HE3  LYS  63           HE3      LYS  63  -5.017  -8.928 -19.981
  496    HZ1  LYS  63           3HZ      LYS  63  -5.714  -6.934 -17.915
  497    HZ2  LYS  63           1HZ      LYS  63  -6.366  -8.431 -18.053
  498    HZ3  LYS  63           2HZ      LYS  63  -4.778  -8.261 -17.680
  499    H    ASP  64           H        ASP  64  -0.388 -10.647 -21.690
  500    HA   ASP  64           HA       ASP  64  -1.504 -13.269 -21.359
  501    HB2  ASP  64           HB2      ASP  64  -1.007 -11.995 -23.509
  502    HB3  ASP  64           HB3      ASP  64   0.707 -12.333 -23.241
  503    H    ALA  65           H        ALA  65   1.650 -11.801 -20.736
  504    HA   ALA  65           HA       ALA  65   2.951 -14.318 -20.060
  505    HB1  ALA  65           1HB      ALA  65   3.700 -11.489 -19.219
  506    HB2  ALA  65           HB2      ALA  65   4.744 -12.932 -19.236
  507    HB3  ALA  65           HB3      ALA  65   4.166 -12.230 -20.764
  508    H    ALA  66           H        ALA  66   1.412 -11.625 -18.228
  509    HA   ALA  66           HA       ALA  66   1.978 -12.778 -15.675
  510    HB1  ALA  66           1HB      ALA  66  -0.119 -10.716 -16.510
  511    HB2  ALA  66           HB2      ALA  66   0.509 -10.965 -14.859
  512    HB3  ALA  66           HB3      ALA  66   1.569 -10.342 -16.143
  513    H    ARG  67           H        ARG  67  -0.255 -13.633 -18.072
  514    HA   ARG  67           HA       ARG  67  -2.034 -15.056 -16.170
  515    HB2  ARG  67           HB2      ARG  67  -2.206 -14.397 -19.125
  516    HB3  ARG  67           HB3      ARG  67  -3.341 -15.497 -18.318
  517    HG2  ARG  67           HG2      ARG  67  -4.101 -13.789 -16.819
  518    HG3  ARG  67           HG3      ARG  67  -2.817 -12.670 -17.293
  519    HD2  ARG  67           2HD      ARG  67  -4.929 -12.019 -18.313
  520    HD3  ARG  67           3HD      ARG  67  -3.773 -12.485 -19.557
  521    HE   ARG  67           HE       ARG  67  -5.550 -14.644 -18.645
  522   HH11  ARG  67          1HH1      ARG  67  -5.044 -12.048 -20.992
  523   HH12  ARG  67          2HH1      ARG  67  -6.140 -12.744 -22.169
  524   HH21  ARG  67          1HH2      ARG  67  -6.970 -15.521 -20.192
  525   HH22  ARG  67          2HH2      ARG  67  -7.219 -14.709 -21.718
  526    H    ASP  68           H        ASP  68   0.963 -15.770 -17.369
  527    HA   ASP  68           HA       ASP  68   0.235 -18.604 -17.945
  528    HB2  ASP  68           HB2      ASP  68   1.746 -16.498 -19.431
  529    HB3  ASP  68           HB3      ASP  68   2.616 -17.975 -19.216
  530    H    MET  69           H        MET  69   2.784 -16.253 -17.304
  531    HA   MET  69           HA       MET  69   4.614 -18.089 -16.049
  532    HB2  MET  69           HB2      MET  69   4.412 -15.136 -16.751
  533    HB3  MET  69           HB3      MET  69   5.681 -15.697 -15.714
  534    HG2  MET  69           HG2      MET  69   5.074 -16.628 -18.539
  535    HG3  MET  69           HG3      MET  69   6.448 -15.647 -18.018
  536    HE1  MET  69           HE3      MET  69   8.127 -16.555 -16.106
  537    HE2  MET  69           HE1      MET  69   6.881 -17.433 -15.176
  538    HE3  MET  69           HE2      MET  69   8.350 -18.278 -15.706
  539    H    ASN  70           H        ASN  70   1.879 -16.339 -14.900
  540    HA   ASN  70           HA       ASN  70   2.958 -15.929 -12.219
  541    HB2  ASN  70           HB2      ASN  70   1.253 -14.431 -13.198
  542    HB3  ASN  70           HB3      ASN  70   0.131 -15.782 -13.333
  543   HD21  ASN  70          2HD2      ASN  70  -1.184 -14.182 -12.034
  544   HD22  ASN  70          1HD2      ASN  70  -1.034 -14.247 -10.286
  545    H    GLY  71           H        GLY  71   3.284 -17.567 -10.853
  546    HA2  GLY  71           2HA      GLY  71   2.481 -19.286  -9.449
  547    HA3  GLY  71           3HA      GLY  71   1.284 -19.736 -10.675
  548    H    LYS  72           H        LYS  72   4.015 -19.341 -12.521
  549    HA   LYS  72           HA       LYS  72   4.837 -22.174 -12.166
  550    HB2  LYS  72           HB2      LYS  72   5.583 -22.091 -14.414
  551    HB3  LYS  72           HB3      LYS  72   3.840 -21.823 -14.172
  552    HG2  LYS  72           HG2      LYS  72   4.082 -19.493 -14.661
  553    HG3  LYS  72           HG3      LYS  72   5.873 -19.631 -14.778
  554    HD2  LYS  72           2HD      LYS  72   4.002 -21.425 -16.326
  555    HD3  LYS  72           3HD      LYS  72   4.484 -19.849 -17.005
  556    HE2  LYS  72           HE2      LYS  72   6.872 -20.519 -16.780
  557    HE3  LYS  72           HE3      LYS  72   6.358 -22.123 -16.217
  558    HZ1  LYS  72           3HZ      LYS  72   6.834 -22.124 -18.555
  559    HZ2  LYS  72           1HZ      LYS  72   5.231 -22.412 -18.325
  560    HZ3  LYS  72           2HZ      LYS  72   5.741 -20.932 -18.833
  561    H    SER  73           H        SER  73   7.199 -22.403 -13.192
  562    HA   SER  73           HA       SER  73   8.820 -20.889 -11.217
  563    HB2  SER  73           HB2      SER  73   8.717 -23.308 -10.953
  564    HB3  SER  73           HB3      SER  73   9.135 -23.551 -12.657
  565    HG   SER  73           HG       SER  73  10.930 -23.813 -11.303
  566    H    LEU  74           H        LEU  74  10.826 -20.236 -11.512
  567    HA   LEU  74           HA       LEU  74  11.764 -19.829 -14.305
  568    HB2  LEU  74           HB2      LEU  74  11.067 -17.735 -12.516
  569    HB3  LEU  74           HB3      LEU  74  12.744 -17.958 -12.230
  570    HG   LEU  74           HG       LEU  74  12.565 -16.312 -13.924
  571   HD11  LEU  74          1HD1      LEU  74  13.304 -18.860 -15.406
  572   HD12  LEU  74          2HD1      LEU  74  13.741 -17.197 -15.835
  573   HD13  LEU  74          3HD1      LEU  74  14.389 -17.921 -14.345
  574   HD21  LEU  74          3HD2      LEU  74  10.240 -16.961 -14.604
  575   HD22  LEU  74          1HD2      LEU  74  11.296 -16.656 -15.998
  576   HD23  LEU  74          2HD2      LEU  74  10.920 -18.330 -15.516
  577    H    ASP  75           H        ASP  75  13.657 -20.835 -14.578
  578    HA   ASP  75           HA       ASP  75  15.597 -21.901 -14.208
  579    HB2  ASP  75           HB2      ASP  75  15.948 -19.454 -13.063
  580    HB3  ASP  75           HB3      ASP  75  15.871 -20.333 -11.627
  581    H    GLY  76           H        GLY  76  13.292 -21.986 -11.608
  582    HA2  GLY  76           2HA      GLY  76  13.329 -24.628 -11.222
  583    HA3  GLY  76           3HA      GLY  76  14.691 -24.105 -10.197
  584    H    LYS  77           H        LYS  77  12.850 -21.444  -9.984
  585    HA   LYS  77           HA       LYS  77  11.432 -22.463  -7.568
  586    HB2  LYS  77           HB2      LYS  77  12.627 -19.705  -7.977
  587    HB3  LYS  77           HB3      LYS  77  11.953 -20.369  -6.484
  588    HG2  LYS  77           HG2      LYS  77  14.447 -21.351  -7.932
  589    HG3  LYS  77           HG3      LYS  77  14.418 -20.385  -6.452
  590    HD2  LYS  77           2HD      LYS  77  13.426 -22.187  -5.186
  591    HD3  LYS  77           3HD      LYS  77  13.145 -23.152  -6.641
  592    HE2  LYS  77           HE2      LYS  77  15.111 -23.967  -5.453
  593    HE3  LYS  77           HE3      LYS  77  15.539 -23.351  -7.054
  594    HZ1  LYS  77           3HZ      LYS  77  17.068 -22.618  -5.333
  595    HZ2  LYS  77           1HZ      LYS  77  16.312 -21.339  -6.028
  596    HZ3  LYS  77           2HZ      LYS  77  15.855 -21.860  -4.532
  597    H    ALA  78           H        ALA  78   9.338 -21.921  -7.289
  598    HA   ALA  78           HA       ALA  78   7.820 -21.065  -9.568
  599    HB1  ALA  78           1HB      ALA  78   7.004 -21.383  -6.660
  600    HB2  ALA  78           HB2      ALA  78   5.900 -21.245  -8.046
  601    HB3  ALA  78           HB3      ALA  78   6.972 -22.656  -7.905
  602    H    ILE  79           H        ILE  79   6.782 -19.125 -10.043
  603    HA   ILE  79           HA       ILE  79   7.518 -16.852  -8.262
  604    HB   ILE  79           HB       ILE  79   8.002 -15.469 -10.118
  605   HG12  ILE  79          HG21      ILE  79   7.581 -17.746 -12.073
  606   HG13  ILE  79          HG31      ILE  79   6.278 -16.601 -11.678
  607   HG21  ILE  79          1HG2      ILE  79   9.762 -17.038  -9.269
  608   HG22  ILE  79          HG22      ILE  79   9.368 -18.141 -10.606
  609   HG23  ILE  79          HG32      ILE  79  10.004 -16.514 -10.955
  610   HD11  ILE  79          3HD1      ILE  79   9.015 -15.882 -12.806
  611   HD12  ILE  79          1HD1      ILE  79   7.468 -15.878 -13.684
  612   HD13  ILE  79          2HD1      ILE  79   7.728 -14.729 -12.361
  613    H    LYS  80           H        LYS  80   6.405 -14.835  -8.797
  614    HA   LYS  80           HA       LYS  80   3.535 -15.186  -9.512
  615    HB2  LYS  80           HB2      LYS  80   4.097 -14.444  -7.120
  616    HB3  LYS  80           HB3      LYS  80   4.834 -13.008  -7.830
  617    HG2  LYS  80           HG2      LYS  80   2.630 -12.502  -8.984
  618    HG3  LYS  80           HG3      LYS  80   1.913 -13.845  -8.069
  619    HD2  LYS  80           2HD      LYS  80   2.570 -12.686  -5.952
  620    HD3  LYS  80           3HD      LYS  80   3.256 -11.359  -6.920
  621    HE2  LYS  80           HE2      LYS  80   1.051 -10.705  -6.172
  622    HE3  LYS  80           HE3      LYS  80   1.025 -10.948  -7.927
  623    HZ1  LYS  80           3HZ      LYS  80  -0.872 -11.950  -6.866
  624    HZ2  LYS  80           1HZ      LYS  80   0.066 -13.124  -7.527
  625    HZ3  LYS  80           2HZ      LYS  80   0.085 -12.876  -5.903
  626    H    VAL  81           H        VAL  81   2.723 -13.743 -11.067
  627    HA   VAL  81           HA       VAL  81   4.536 -11.588 -11.992
  628    HB   VAL  81           HB       VAL  81   3.097 -13.507 -13.857
  629   HG11  VAL  81          1HG1      VAL  81   4.923 -11.128 -14.401
  630   HG12  VAL  81          HG21      VAL  81   4.222 -12.213 -15.620
  631   HG13  VAL  81          HG31      VAL  81   3.163 -11.155 -14.660
  632   HG21  VAL  81          HG32      VAL  81   6.048 -13.034 -13.244
  633   HG22  VAL  81          1HG2      VAL  81   5.120 -14.522 -12.902
  634   HG23  VAL  81          HG22      VAL  81   5.438 -14.029 -14.579
  635    H    GLU  82           H        GLU  82   3.534  -9.701 -12.233
  636    HA   GLU  82           HA       GLU  82   0.641  -9.471 -12.585
  637    HB2  GLU  82           HB2      GLU  82   0.984 -10.104 -10.156
  638    HB3  GLU  82           HB3      GLU  82   1.975  -8.659  -9.958
  639    HG2  GLU  82           HG2      GLU  82   0.045  -7.234 -10.494
  640    HG3  GLU  82           HG3      GLU  82  -0.948  -8.666 -10.832
  641    H    GLN  83           H        GLN  83   0.062  -7.052 -12.717
  642    HA   GLN  83           HA       GLN  83   2.156  -5.489 -13.895
  643    HB2  GLN  83           HB2      GLN  83  -0.079  -4.912 -14.481
  644    HB3  GLN  83           HB3      GLN  83  -0.601  -4.919 -12.791
  645    HG2  GLN  83           HG2      GLN  83  -0.569  -2.672 -13.488
  646    HG3  GLN  83           HG3      GLN  83   0.753  -2.893 -12.340
  647   HE21  GLN  83          HE22      GLN  83   2.058  -1.260 -12.919
  648   HE22  GLN  83          HE12      GLN  83   2.723  -1.009 -14.518
  649    H    ALA  84           H        ALA  84   3.627  -4.117 -12.971
  650    HA   ALA  84           HA       ALA  84   4.160  -4.583 -10.163
  651    HB1  ALA  84           1HB      ALA  84   5.527  -2.791 -12.203
  652    HB2  ALA  84           HB2      ALA  84   6.184  -3.250 -10.617
  653    HB3  ALA  84           HB3      ALA  84   5.942  -4.492 -11.869
  654    H    THR  85           H        THR  85   4.525  -2.968  -8.560
  655    HA   THR  85           HA       THR  85   3.094  -0.393  -9.043
  656    HB   THR  85           HB       THR  85   2.746  -0.246  -6.663
  657    HG1  THR  85           1HG      THR  85   3.186  -2.082  -5.365
  658   HG21  THR  85          1HG2      THR  85   1.783  -2.962  -7.690
  659   HG22  THR  85          HG22      THR  85   1.010  -1.978  -6.426
  660   HG23  THR  85          HG32      THR  85   1.024  -1.412  -8.108
  661    H    LYS  86           H        LYS  86   3.955   1.367  -7.603
  662    HA   LYS  86           HA       LYS  86   6.675   1.844  -8.271
  663    HB2  LYS  86           HB2      LYS  86   4.759   3.229  -6.344
  664    HB3  LYS  86           HB3      LYS  86   6.317   3.894  -6.897
  665    HG2  LYS  86           HG2      LYS  86   5.492   3.574  -9.281
  666    HG3  LYS  86           HG3      LYS  86   3.908   3.140  -8.613
  667    HD2  LYS  86           2HD      LYS  86   3.982   5.418  -7.399
  668    HD3  LYS  86           3HD      LYS  86   5.342   5.809  -8.475
  669    HE2  LYS  86           HE2      LYS  86   3.870   5.164 -10.428
  670    HE3  LYS  86           HE3      LYS  86   2.528   4.979  -9.281
  671    HZ1  LYS  86           3HZ      LYS  86   2.796   7.281  -8.685
  672    HZ2  LYS  86           1HZ      LYS  86   4.039   7.464  -9.750
  673    HZ3  LYS  86           2HZ      LYS  86   2.527   7.149 -10.304
  674    HA   PRO  87           HA       PRO  87   8.985  -0.065  -5.144
  675    HB2  PRO  87           HB2      PRO  87  11.027   1.705  -4.621
  676    HB3  PRO  87           HB3      PRO  87  10.887   0.774  -6.142
  677    HG2  PRO  87           HG2      PRO  87   9.954   3.608  -5.623
  678    HG3  PRO  87           HG3      PRO  87  10.952   3.006  -6.991
  679    HD2  PRO  87           2HD      PRO  87   8.291   3.328  -7.286
  680    HD3  PRO  87           3HD      PRO  87   9.092   1.876  -7.961
  681    H    SER  88           H        SER  88   9.518  -0.104  -2.877
  682    HA   SER  88           HA       SER  88   7.505   1.364  -1.391
  683    HB2  SER  88           HB2      SER  88   9.545  -0.688  -0.454
  684    HB3  SER  88           HB3      SER  88   8.138  -0.111   0.464
  685    HG   SER  88           HG       SER  88   7.691  -2.058  -0.618
  686    H    PHE  89           H        PHE  89  10.655   2.188  -2.252
  687    HA   PHE  89           HA       PHE  89  11.140   3.631   0.273
  688    HB2  PHE  89           HB2      PHE  89  13.240   4.293  -0.683
  689    HB3  PHE  89           HB3      PHE  89  13.041   2.541  -0.705
  690    HD1  PHE  89           HD2      PHE  89  12.705   5.573  -2.884
  691    HD2  PHE  89           HD1      PHE  89  13.491   1.358  -2.678
  692    HE1  PHE  89           HE2      PHE  89  13.366   5.582  -5.278
  693    HE2  PHE  89           HE1      PHE  89  14.206   1.384  -5.070
  694    HZ   PHE  89           HZ       PHE  89  14.118   3.469  -6.364
  695    H    GLU  90           H        GLU  90   9.071   4.125  -2.142
  696    HA   GLU  90           HA       GLU  90   9.462   7.067  -2.109
  697    HB2  GLU  90           HB2      GLU  90  10.274   5.822  -4.237
  698    HB3  GLU  90           HB3      GLU  90   8.555   5.528  -4.564
  699    HG2  GLU  90           HG2      GLU  90   8.164   7.998  -4.481
  700    HG3  GLU  90           HG3      GLU  90   9.883   8.230  -4.105
  701    H    SER  91           H        SER  91   7.493   8.285  -2.629
  702    HA   SER  91           HA       SER  91   4.954   6.865  -2.225
  703    HB2  SER  91           HB2      SER  91   6.003   7.167   0.033
  704    HB3  SER  91           HB3      SER  91   5.982   8.919  -0.227
  705    HG   SER  91           HG       SER  91   4.126   8.163   0.906
  706    H    GLY  92           H        GLY  92   3.100   8.418  -2.264
  707    HA2  GLY  92           2HA      GLY  92   3.434  10.331  -4.405
  708    HA3  GLY  92           3HA      GLY  92   1.942   9.961  -3.519
  709    H    ARG  93           H        ARG  93   4.140  10.589  -1.144
  710    HA   ARG  93           HA       ARG  93   3.957  13.537  -1.236
  711    HB2  ARG  93           HB2      ARG  93   1.898  12.671  -0.109
  712    HB3  ARG  93           HB3      ARG  93   2.922  11.846   1.080
  713    HG2  ARG  93           HG2      ARG  93   3.833  14.008   1.829
  714    HG3  ARG  93           HG3      ARG  93   2.886  14.852   0.578
  715    HD2  ARG  93           2HD      ARG  93   0.795  14.012   1.600
  716    HD3  ARG  93           3HD      ARG  93   1.739  13.168   2.842
  717    HE   ARG  93           HE       ARG  93   2.443  15.944   2.809
  718   HH11  ARG  93          1HH1      ARG  93  -0.195  13.791   3.772
  719   HH12  ARG  93          2HH1      ARG  93  -0.759  14.861   5.035
  720   HH21  ARG  93          1HH2      ARG  93   1.677  17.318   4.449
  721   HH22  ARG  93          2HH2      ARG  93   0.291  16.855   5.408
  722    H    ARG  94           H        ARG  94   5.468  14.562   0.156
  723    HA   ARG  94           HA       ARG  94   7.546  14.850   0.943
  724    HB2  ARG  94           HB2      ARG  94   6.289  13.849   2.886
  725    HB3  ARG  94           HB3      ARG  94   7.048  12.303   2.519
  726    HG2  ARG  94           HG2      ARG  94   8.203  13.485   4.340
  727    HG3  ARG  94           HG3      ARG  94   9.276  13.261   2.965
  728    HD2  ARG  94           2HD      ARG  94   9.535  15.498   3.896
  729    HD3  ARG  94           3HD      ARG  94   8.869  15.604   2.260
  730    HE   ARG  94           HE       ARG  94   6.735  15.527   4.177
  731   HH11  ARG  94          1HH1      ARG  94   9.278  17.666   2.972
  732   HH12  ARG  94          2HH1      ARG  94   8.397  19.125   3.359
  733   HH21  ARG  94          1HH2      ARG  94   5.613  17.445   4.680
  734   HH22  ARG  94          2HH2      ARG  94   6.329  19.000   4.323
  735    H    GLY  95           H        GLY  95   7.257  13.238  -1.524
  736    HA2  GLY  95           2HA      GLY  95   9.304  11.216  -1.573
  737    HA3  GLY  95           3HA      GLY  95   8.549  12.001  -2.973
  738    H5'    A  96           H5'        A  96   8.720  -7.035   4.955
  739   H5''    A  96          H5''        A  96   8.756  -5.441   5.712
  740    H4'    A  96           H4'        A  96  10.430  -7.883   6.529
  741    H3'    A  96           H3'        A  96   7.764  -6.890   7.250
  742    H2'    A  96           H2'        A  96   8.121  -6.160   9.448
  743   HO2'    A  96          HO2'        A  96   9.212  -8.161  10.040
  744    H1'    A  96           H1'        A  96  10.612  -5.138   9.316
  745    H8     A  96           H8         A  96  10.255  -3.782   6.177
  746    H61    A  96           H61        A  96   5.471  -0.210   7.886
  747    H62    A  96           H62        A  96   6.698  -0.470   6.658
  748    H2     A  96           H2         A  96   6.019  -3.342  10.973
  749   HO5'    A  96          H5T         A  96  10.096  -5.582   3.836
  750    H5'    U  97           H5'        U  97   5.782  -8.409   8.069
  751   H5''    U  97          H5''        U  97   5.112  -9.859   7.315
  752    H4'    U  97           H4'        U  97   4.096  -8.668   5.568
  753    H3'    U  97           H3'        U  97   6.174  -6.893   5.543
  754    H2'    U  97           H2'        U  97   5.715  -5.416   7.260
  755   HO2'    U  97          HO2'        U  97   4.980  -4.193   5.446
  756    H1'    U  97           H1'        U  97   2.835  -5.655   7.536
  757    H3     U  97           H3         U  97   2.822  -5.959  12.022
  758    H5     U  97           H5         U  97   6.825  -6.711  11.006
  759    H6     U  97           H6         U  97   6.169  -6.667   8.652
  760    H5'    C  98           H5'        C  98   6.748  -8.078   3.786
  761   H5''    C  98          H5''        C  98   7.760  -6.966   2.845
  762    H4'    C  98           H4'        C  98   8.298  -9.112   2.066
  763    H3'    C  98           H3'        C  98   7.363  -7.311   0.233
  764    H2'    C  98           H2'        C  98   5.066  -7.919   0.395
  765   HO2'    C  98          HO2'        C  98   5.778  -8.221  -1.815
  766    H1'    C  98           H1'        C  98   5.679 -10.851   0.326
  767    H41    C  98           H41        C  98  -0.395 -10.558   2.253
  768    H42    C  98           H42        C  98   0.050  -9.567   3.628
  769    H5     C  98           H5         C  98   2.336  -8.787   4.018
  770    H6     C  98           H6         C  98   4.611  -8.814   3.137
  771    H5'    A  99           H5'        A  99   9.781  -5.993  -0.863
  772   H5''    A  99          H5''        A  99   8.187  -6.431  -1.506
  773    H4'    A  99           H4'        A  99  10.615  -5.914  -3.276
  774    H3'    A  99           H3'        A  99   9.299  -3.955  -1.706
  775    H2'    A  99           H2'        A  99   7.274  -4.093  -2.978
  776   HO2'    A  99          HO2'        A  99   8.065  -1.958  -3.270
  777    H1'    A  99           H1'        A  99   9.095  -4.569  -5.350
  778    H8     A  99           H8         A  99   7.396  -3.597  -6.998
  779    H61    A  99           H61        A  99   1.995  -6.668  -6.905
  780    H62    A  99           H62        A  99   2.951  -5.489  -7.779
  781    H2     A  99           H2         A  99   4.390  -7.952  -3.397
  782    H5'    A 100           H5'        A 100  13.106  -1.053  -4.095
  783   H5''    A 100          H5''        A 100  11.890  -2.084  -4.891
  784    H4'    A 100           H4'        A 100  14.579  -3.195  -5.204
  785    H3'    A 100           H3'        A 100  14.864  -0.541  -5.169
  786    H2'    A 100           H2'        A 100  12.783  -0.140  -6.277
  787   HO2'    A 100          HO2'        A 100  14.815  -0.017  -8.275
  788    H1'    A 100           H1'        A 100  13.577  -1.995  -8.507
  789    H8     A 100           H8         A 100  10.490  -1.886  -6.140
  790    H61    A 100           H61        A 100   7.420  -0.025 -11.218
  791    H62    A 100           H62        A 100   7.252  -0.502  -9.535
  792    H2     A 100           H2         A 100  11.716  -0.351 -12.241
  793    H5'    A 101           H5'        A 101  16.333   0.935  -7.185
  794   H5''    A 101          H5''        A 101  17.954   0.518  -7.761
  795    H4'    A 101           H4'        A 101  17.643   2.928  -7.424
  796    H3'    A 101           H3'        A 101  19.872   1.483  -6.736
  797   HO3'    A 101          H3T         A 101  20.821   3.587  -6.346
  798    H2'    A 101           H2'        A 101  19.318   1.087  -4.501
  799   HO2'    A 101          HO2'        A 101  21.292   2.250  -4.450
  800    H1'    A 101           H1'        A 101  18.309   3.897  -4.115
  801    H8     A 101           H8         A 101  17.852   0.119  -3.442
  802    H61    A 101           H61        A 101  15.060   1.983   1.795
  803    H62    A 101           H62        A 101  15.643   0.580   0.912
  804    H2     A 101           H2         A 101  15.911   5.559  -0.663
  Start of MODEL   17
    1    H1   MET   1           H1       MET   1   2.085   4.862  -0.350
    2    H2   MET   1           H2       MET   1   3.722   4.848  -0.258
    3    H3   MET   1           H3       MET   1   2.858   3.580   0.341
    4    HA   MET   1           HA       MET   1   3.030   4.366  -2.489
    5    HB2  MET   1           HB2      MET   1   5.054   3.241  -1.316
    6    HB3  MET   1           HB3      MET   1   4.055   1.782  -1.287
    7    HG2  MET   1           HG2      MET   1   4.845   3.434  -3.720
    8    HG3  MET   1           HG3      MET   1   5.541   1.884  -3.263
    9    HE1  MET   1           HE1      MET   1   4.411  -0.448  -3.651
   10    HE2  MET   1           HE2      MET   1   3.162   0.054  -2.482
   11    HE3  MET   1           HE3      MET   1   2.688  -0.650  -4.044
   12    H    VAL   2           H        VAL   2   0.893   4.380  -2.941
   13    HA   VAL   2           HA       VAL   2  -0.465   1.734  -2.881
   14    HB   VAL   2           HB       VAL   2  -1.632   3.388  -1.470
   15   HG11  VAL   2          1HG1      VAL   2  -1.657   5.120  -3.987
   16   HG12  VAL   2          HG21      VAL   2  -2.535   5.481  -2.489
   17   HG13  VAL   2          HG31      VAL   2  -0.761   5.468  -2.487
   18   HG21  VAL   2          HG32      VAL   2  -3.811   3.333  -2.466
   19   HG22  VAL   2          1HG2      VAL   2  -3.132   3.234  -4.102
   20   HG23  VAL   2          HG22      VAL   2  -2.969   1.849  -2.987
   21    H    GLU   3           H        GLU   3   1.523   3.263  -4.627
   22    HA   GLU   3           HA       GLU   3  -0.055   4.082  -6.913
   23    HB2  GLU   3           HB2      GLU   3   2.917   4.131  -6.251
   24    HB3  GLU   3           HB3      GLU   3   2.233   4.797  -7.750
   25    HG2  GLU   3           HG2      GLU   3   0.792   6.303  -6.453
   26    HG3  GLU   3           HG3      GLU   3   1.461   5.665  -4.941
   27    H    ALA   4           H        ALA   4   0.098   3.402  -8.973
   28    HA   ALA   4           HA       ALA   4   1.375   0.774  -9.530
   29    HB1  ALA   4           1HB      ALA   4  -1.501   1.598 -10.106
   30    HB2  ALA   4           HB2      ALA   4  -0.727   0.071 -10.613
   31    HB3  ALA   4           HB3      ALA   4  -0.984   0.423  -8.883
   32    H    ASP   5           H        ASP   5   2.884   1.454 -10.846
   33    HA   ASP   5           HA       ASP   5   2.739   3.755 -12.514
   34    HB2  ASP   5           HB2      ASP   5   4.784   2.786 -11.549
   35    HB3  ASP   5           HB3      ASP   5   4.587   1.344 -12.536
   36    H    ARG   6           H        ARG   6   3.239   3.537 -14.973
   37    HA   ARG   6           HA       ARG   6   0.797   2.887 -16.129
   38    HB2  ARG   6           HB2      ARG   6   3.528   3.227 -17.424
   39    HB3  ARG   6           HB3      ARG   6   1.987   3.226 -18.304
   40    HG2  ARG   6           HG2      ARG   6   1.217   5.162 -16.932
   41    HG3  ARG   6           HG3      ARG   6   2.783   5.184 -16.098
   42    HD2  ARG   6           2HD      ARG   6   3.932   5.557 -18.253
   43    HD3  ARG   6           3HD      ARG   6   2.380   5.536 -19.097
   44    HE   ARG   6           HE       ARG   6   3.478   7.693 -17.414
   45   HH11  ARG   6          1HH1      ARG   6   0.607   6.399 -19.026
   46   HH12  ARG   6          2HH1      ARG   6  -0.233   7.933 -19.013
   47   HH21  ARG   6          1HH2      ARG   6   2.365   9.673 -17.413
   48   HH22  ARG   6          2HH2      ARG   6   0.767   9.778 -18.109
   49    HA   PRO   7           HA       PRO   7   0.468  -1.353 -17.185
   50    HB2  PRO   7           HB2      PRO   7   0.043  -0.225 -19.960
   51    HB3  PRO   7           HB3      PRO   7  -0.898  -1.529 -19.163
   52    HG2  PRO   7           HG2      PRO   7  -1.870   0.951 -19.286
   53    HG3  PRO   7           HG3      PRO   7  -1.914   0.104 -17.689
   54    HD2  PRO   7           2HD      PRO   7   0.057   2.181 -18.671
   55    HD3  PRO   7           3HD      PRO   7  -0.725   2.036 -17.064
   56    H    GLY   8           H        GLY   8   1.589  -3.098 -18.239
   57    HA2  GLY   8           2HA      GLY   8   2.948  -3.961 -19.972
   58    HA3  GLY   8           3HA      GLY   8   3.657  -2.346 -20.227
   59    H    LYS   9           H        LYS   9   3.645  -2.306 -17.007
   60    HA   LYS   9           HA       LYS   9   6.325  -3.567 -16.925
   61    HB2  LYS   9           HB2      LYS   9   6.257  -1.197 -16.302
   62    HB3  LYS   9           HB3      LYS   9   5.093  -1.573 -15.004
   63    HG2  LYS   9           HG2      LYS   9   6.738  -3.168 -14.019
   64    HG3  LYS   9           HG3      LYS   9   7.897  -2.766 -15.291
   65    HD2  LYS   9           2HD      LYS   9   6.728  -0.764 -13.328
   66    HD3  LYS   9           3HD      LYS   9   8.286  -1.606 -13.121
   67    HE2  LYS   9           HE2      LYS   9   9.147  -0.615 -15.184
   68    HE3  LYS   9           HE3      LYS   9   7.583   0.146 -15.519
   69    HZ1  LYS   9           3HZ      LYS   9   7.828   1.504 -13.627
   70    HZ2  LYS   9           1HZ      LYS   9   9.219   0.744 -13.154
   71    HZ3  LYS   9           2HZ      LYS   9   9.189   1.649 -14.525
   72    H    LEU  10           H        LEU  10   6.653  -5.372 -15.832
   73    HA   LEU  10           HA       LEU  10   4.360  -6.413 -14.219
   74    HB2  LEU  10           HB2      LEU  10   6.499  -7.771 -15.861
   75    HB3  LEU  10           HB3      LEU  10   5.415  -8.674 -14.858
   76    HG   LEU  10           HG       LEU  10   4.619  -6.954 -17.253
   77   HD11  LEU  10          1HD1      LEU  10   4.366  -9.955 -16.712
   78   HD12  LEU  10          2HD1      LEU  10   4.161  -9.119 -18.269
   79   HD13  LEU  10          3HD1      LEU  10   5.775  -9.252 -17.510
   80   HD21  LEU  10          3HD2      LEU  10   2.903  -8.562 -15.329
   81   HD22  LEU  10          1HD2      LEU  10   2.807  -6.808 -15.674
   82   HD23  LEU  10          2HD2      LEU  10   2.363  -7.987 -16.921
   83    H    PHE  11           H        PHE  11   4.806  -7.574 -12.355
   84    HA   PHE  11           HA       PHE  11   7.492  -7.154 -11.128
   85    HB2  PHE  11           HB2      PHE  11   5.759  -6.155  -9.799
   86    HB3  PHE  11           HB3      PHE  11   4.712  -7.568  -9.997
   87    HD1  PHE  11           HD1      PHE  11   8.034  -6.546  -8.602
   88    HD2  PHE  11           HD2      PHE  11   4.712  -9.266  -8.378
   89    HE1  PHE  11           HE1      PHE  11   8.973  -7.522  -6.521
   90    HE2  PHE  11           HE2      PHE  11   5.655 -10.243  -6.300
   91    HZ   PHE  11           HZ       PHE  11   7.800  -9.367  -5.380
   92    H    ILE  12           H        ILE  12   8.723  -8.922 -10.843
   93    HA   ILE  12           HA       ILE  12   7.454 -11.579 -11.317
   94    HB   ILE  12           HB       ILE  12  10.332 -10.928 -11.943
   95   HG12  ILE  12          HG21      ILE  12   9.176  -9.293 -13.292
   96   HG13  ILE  12          HG31      ILE  12   9.833 -10.591 -14.283
   97   HG21  ILE  12          1HG2      ILE  12  10.039 -12.841 -13.475
   98   HG22  ILE  12          HG22      ILE  12   9.621 -13.273 -11.796
   99   HG23  ILE  12          HG32      ILE  12   8.334 -12.972 -12.980
  100   HD11  ILE  12          3HD1      ILE  12   6.920 -10.167 -13.531
  101   HD12  ILE  12          1HD1      ILE  12   7.679 -10.009 -15.130
  102   HD13  ILE  12          2HD1      ILE  12   7.519 -11.608 -14.379
  103    H    GLY  13           H        GLY  13   7.117 -11.751  -8.958
  104    HA2  GLY  13           2HA      GLY  13   9.589 -11.643  -7.318
  105    HA3  GLY  13           3HA      GLY  13   7.936 -11.713  -6.717
  106    H    GLY  14           H        GLY  14  10.485 -13.394  -6.250
  107    HA2  GLY  14           2HA      GLY  14  10.274 -15.486  -5.128
  108    HA3  GLY  14           3HA      GLY  14   8.988 -15.960  -6.255
  109    H    LEU  15           H        LEU  15  11.620 -14.354  -7.774
  110    HA   LEU  15           HA       LEU  15  12.232 -16.646  -9.385
  111    HB2  LEU  15           HB2      LEU  15  13.683 -13.994  -9.003
  112    HB3  LEU  15           HB3      LEU  15  13.994 -15.185 -10.293
  113    HG   LEU  15           HG       LEU  15  11.242 -13.985 -10.003
  114   HD11  LEU  15          1HD1      LEU  15  13.677 -12.940 -11.513
  115   HD12  LEU  15          2HD1      LEU  15  12.003 -12.393 -11.786
  116   HD13  LEU  15          3HD1      LEU  15  12.792 -12.093 -10.218
  117   HD21  LEU  15          3HD2      LEU  15  11.145 -14.691 -12.347
  118   HD22  LEU  15          1HD2      LEU  15  12.886 -15.068 -12.335
  119   HD23  LEU  15          2HD2      LEU  15  11.770 -16.057 -11.379
  120    H    ASN  16           H        ASN  16  14.410 -17.520  -9.746
  121    HA   ASN  16           HA       ASN  16  15.595 -18.481  -7.335
  122    HB2  ASN  16           HB2      ASN  16  15.261 -19.653  -9.516
  123    HB3  ASN  16           HB3      ASN  16  16.570 -18.643 -10.186
  124   HD21  ASN  16          2HD2      ASN  16  17.226 -20.975 -10.601
  125   HD22  ASN  16          1HD2      ASN  16  18.268 -21.681  -9.418
  126    H    THR  17           H        THR  17  17.887 -18.221  -6.768
  127    HA   THR  17           HA       THR  17  18.891 -15.516  -6.963
  128    HB   THR  17           HB       THR  17  20.781 -16.423  -5.681
  129    HG1  THR  17           1HG      THR  17  20.962 -18.449  -6.674
  130   HG21  THR  17          1HG2      THR  17  19.549 -17.236  -3.733
  131   HG22  THR  17          HG22      THR  17  18.591 -15.958  -4.522
  132   HG23  THR  17          HG32      THR  17  18.164 -17.677  -4.752
  133    H    GLU  18           H        GLU  18  18.847 -18.084  -9.081
  134    HA   GLU  18           HA       GLU  18  21.550 -17.657 -10.204
  135    HB2  GLU  18           HB2      GLU  18  19.492 -19.738 -10.974
  136    HB3  GLU  18           HB3      GLU  18  21.245 -19.814 -11.208
  137    HG2  GLU  18           HG2      GLU  18  19.775 -19.858  -8.531
  138    HG3  GLU  18           HG3      GLU  18  20.415 -21.268  -9.337
  139    H    THR  19           H        THR  19  18.324 -16.657 -10.630
  140    HA   THR  19           HA       THR  19  18.333 -16.517 -13.541
  141    HB   THR  19           HB       THR  19  16.516 -15.173 -11.504
  142    HG1  THR  19           1HG      THR  19  15.179 -16.970 -11.955
  143   HG21  THR  19          1HG2      THR  19  14.887 -15.187 -13.393
  144   HG22  THR  19          HG22      THR  19  16.306 -14.199 -13.755
  145   HG23  THR  19          HG32      THR  19  16.168 -15.826 -14.460
  146    H    ASN  20           H        ASN  20  18.679 -14.711 -14.803
  147    HA   ASN  20           HA       ASN  20  19.329 -12.164 -13.417
  148    HB2  ASN  20           HB2      ASN  20  20.852 -12.739 -15.872
  149    HB3  ASN  20           HB3      ASN  20  21.338 -11.846 -14.429
  150   HD21  ASN  20          2HD2      ASN  20  21.316 -14.889 -16.103
  151   HD22  ASN  20          1HD2      ASN  20  22.253 -15.792 -14.928
  152    H    GLU  21           H        GLU  21  19.875 -10.708 -15.680
  153    HA   GLU  21           HA       GLU  21  17.171 -10.124 -16.524
  154    HB2  GLU  21           HB2      GLU  21  19.880  -9.040 -17.370
  155    HB3  GLU  21           HB3      GLU  21  18.317  -8.361 -17.886
  156    HG2  GLU  21           HG2      GLU  21  17.701  -7.869 -15.586
  157    HG3  GLU  21           HG3      GLU  21  19.084  -8.772 -14.988
  158    H    LYS  22           H        LYS  22  19.945 -11.836 -17.977
  159    HA   LYS  22           HA       LYS  22  19.017 -11.751 -20.663
  160    HB2  LYS  22           HB2      LYS  22  21.309 -12.451 -19.499
  161    HB3  LYS  22           HB3      LYS  22  20.600 -14.063 -19.524
  162    HG2  LYS  22           HG2      LYS  22  21.152 -12.241 -21.910
  163    HG3  LYS  22           HG3      LYS  22  22.047 -13.694 -21.450
  164    HD2  LYS  22           2HD      LYS  22  19.920 -15.023 -21.833
  165    HD3  LYS  22           3HD      LYS  22  19.210 -13.534 -22.525
  166    HE2  LYS  22           HE2      LYS  22  21.057 -13.411 -24.152
  167    HE3  LYS  22           HE3      LYS  22  21.750 -14.901 -23.495
  168    HZ1  LYS  22           3HZ      LYS  22  19.758 -16.053 -24.141
  169    HZ2  LYS  22           1HZ      LYS  22  19.093 -14.671 -24.744
  170    HZ3  LYS  22           2HZ      LYS  22  20.429 -15.319 -25.443
  171    H    ALA  23           H        ALA  23  18.186 -13.790 -17.876
  172    HA   ALA  23           HA       ALA  23  16.894 -15.810 -19.583
  173    HB1  ALA  23           1HB      ALA  23  17.092 -15.501 -16.556
  174    HB2  ALA  23           HB2      ALA  23  16.434 -16.913 -17.415
  175    HB3  ALA  23           HB3      ALA  23  18.155 -16.491 -17.573
  176    H    LEU  24           H        LEU  24  16.188 -12.887 -17.909
  177    HA   LEU  24           HA       LEU  24  13.340 -13.366 -17.530
  178    HB2  LEU  24           HB2      LEU  24  15.553 -11.634 -16.663
  179    HB3  LEU  24           HB3      LEU  24  14.167 -10.639 -17.022
  180    HG   LEU  24           HG       LEU  24  13.980 -13.198 -15.402
  181   HD11  LEU  24          1HD1      LEU  24  14.160 -11.828 -13.357
  182   HD12  LEU  24          2HD1      LEU  24  15.661 -11.801 -14.306
  183   HD13  LEU  24          3HD1      LEU  24  14.561 -10.398 -14.351
  184   HD21  LEU  24          3HD2      LEU  24  11.876 -12.087 -16.216
  185   HD22  LEU  24          1HD2      LEU  24  11.982 -12.104 -14.432
  186   HD23  LEU  24          2HD2      LEU  24  12.334 -10.615 -15.336
  187    H    GLU  25           H        GLU  25  15.553 -11.789 -19.770
  188    HA   GLU  25           HA       GLU  25  13.387 -10.490 -21.218
  189    HB2  GLU  25           HB2      GLU  25  16.327 -11.057 -21.885
  190    HB3  GLU  25           HB3      GLU  25  15.222 -10.210 -22.990
  191    HG2  GLU  25           HG2      GLU  25  14.728  -8.581 -21.252
  192    HG3  GLU  25           HG3      GLU  25  15.933  -9.327 -20.176
  193    H    ALA  26           H        ALA  26  15.092 -13.500 -21.205
  194    HA   ALA  26           HA       ALA  26  14.366 -14.355 -23.892
  195    HB1  ALA  26           1HB      ALA  26  16.456 -15.020 -22.791
  196    HB2  ALA  26           HB2      ALA  26  15.524 -15.799 -21.484
  197    HB3  ALA  26           HB3      ALA  26  15.463 -16.458 -23.141
  198    H    VAL  27           H        VAL  27  12.927 -14.514 -20.710
  199    HA   VAL  27           HA       VAL  27  11.245 -16.811 -21.485
  200    HB   VAL  27           HB       VAL  27  12.642 -16.677 -19.438
  201   HG11  VAL  27          1HG1      VAL  27  11.848 -15.486 -17.510
  202   HG12  VAL  27          HG21      VAL  27  12.029 -14.336 -18.861
  203   HG13  VAL  27          HG31      VAL  27  10.400 -14.946 -18.404
  204   HG21  VAL  27          HG32      VAL  27  10.933 -17.728 -18.011
  205   HG22  VAL  27          1HG2      VAL  27   9.639 -17.067 -19.059
  206   HG23  VAL  27          HG22      VAL  27  10.774 -18.287 -19.703
  207    H    PHE  28           H        PHE  28  11.054 -13.416 -20.435
  208    HA   PHE  28           HA       PHE  28   8.114 -13.482 -20.765
  209    HB2  PHE  28           HB2      PHE  28   9.990 -11.307 -19.813
  210    HB3  PHE  28           HB3      PHE  28   8.250 -11.091 -20.057
  211    HD1  PHE  28           HD2      PHE  28   6.604 -12.350 -18.702
  212    HD2  PHE  28           HD1      PHE  28  10.812 -12.507 -17.897
  213    HE1  PHE  28           HE2      PHE  28   6.134 -13.295 -16.451
  214    HE2  PHE  28           HE1      PHE  28  10.360 -13.457 -15.656
  215    HZ   PHE  28           HZ       PHE  28   8.016 -13.832 -14.920
  216    H    GLY  29           H        GLY  29  10.855 -12.962 -22.717
  217    HA2  GLY  29           2HA      GLY  29   9.625 -11.057 -24.538
  218    HA3  GLY  29           3HA      GLY  29  11.060 -12.058 -24.860
  219    H    LYS  30           H        LYS  30   8.878 -14.193 -23.712
  220    HA   LYS  30           HA       LYS  30   8.267 -15.293 -26.326
  221    HB2  LYS  30           HB2      LYS  30   7.553 -16.103 -23.461
  222    HB3  LYS  30           HB3      LYS  30   7.324 -17.127 -24.896
  223    HG2  LYS  30           HG2      LYS  30   9.696 -17.127 -25.341
  224    HG3  LYS  30           HG3      LYS  30  10.028 -15.996 -24.025
  225    HD2  LYS  30           2HD      LYS  30  10.524 -18.463 -23.551
  226    HD3  LYS  30           3HD      LYS  30   9.586 -17.576 -22.335
  227    HE2  LYS  30           HE2      LYS  30   7.523 -18.504 -23.104
  228    HE3  LYS  30           HE3      LYS  30   8.324 -19.307 -24.475
  229    HZ1  LYS  30           3HZ      LYS  30   9.566 -20.612 -22.883
  230    HZ2  LYS  30           1HZ      LYS  30   8.819 -19.874 -21.620
  231    HZ3  LYS  30           2HZ      LYS  30   7.954 -20.824 -22.646
  232    H    TYR  31           H        TYR  31   6.819 -13.102 -24.237
  233    HA   TYR  31           HA       TYR  31   4.071 -13.718 -25.241
  234    HB2  TYR  31           HB2      TYR  31   5.002 -12.213 -22.782
  235    HB3  TYR  31           HB3      TYR  31   3.319 -12.512 -23.224
  236    HD1  TYR  31           HD2      TYR  31   2.593 -15.004 -23.401
  237    HD2  TYR  31           HD1      TYR  31   6.236 -13.724 -21.518
  238    HE1  TYR  31           HE2      TYR  31   2.782 -17.209 -22.283
  239    HE2  TYR  31           HE1      TYR  31   6.425 -15.928 -20.367
  240    HH   TYR  31           HH       TYR  31   5.566 -18.094 -20.235
  241    H    GLY  32           H        GLY  32   6.640 -11.328 -25.354
  242    HA2  GLY  32           2HA      GLY  32   5.281  -9.719 -27.267
  243    HA3  GLY  32           3HA      GLY  32   5.162  -8.945 -25.665
  244    H    ARG  33           H        ARG  33   6.378  -7.639 -27.719
  245    HA   ARG  33           HA       ARG  33   9.222  -8.074 -27.650
  246    HB2  ARG  33           HB2      ARG  33   7.636  -6.925 -29.434
  247    HB3  ARG  33           HB3      ARG  33   7.941  -5.466 -28.461
  248    HG2  ARG  33           HG2      ARG  33  10.394  -5.848 -28.710
  249    HG3  ARG  33           HG3      ARG  33  10.022  -7.351 -29.601
  250    HD2  ARG  33           2HD      ARG  33   8.814  -6.006 -31.311
  251    HD3  ARG  33           3HD      ARG  33   9.253  -4.528 -30.450
  252    HE   ARG  33           HE       ARG  33  11.012  -6.261 -32.082
  253   HH11  ARG  33          1HH1      ARG  33  10.808  -3.504 -29.856
  254   HH12  ARG  33          2HH1      ARG  33  12.384  -2.901 -30.281
  255   HH21  ARG  33          1HH2      ARG  33  13.063  -5.452 -32.608
  256   HH22  ARG  33          2HH2      ARG  33  13.654  -3.994 -31.844
  257    H    ILE  34           H        ILE  34  10.414  -7.668 -25.998
  258    HA   ILE  34           HA       ILE  34   9.565  -5.988 -23.772
  259    HB   ILE  34           HB       ILE  34  12.149  -7.447 -24.415
  260   HG12  ILE  34          HG21      ILE  34   9.746  -8.013 -22.628
  261   HG13  ILE  34          HG31      ILE  34  10.226  -8.898 -24.082
  262   HG21  ILE  34          1HG2      ILE  34  11.315  -6.108 -21.809
  263   HG22  ILE  34          HG22      ILE  34  12.805  -7.052 -22.098
  264   HG23  ILE  34          HG32      ILE  34  12.581  -5.512 -22.920
  265   HD11  ILE  34          3HD1      ILE  34  10.886 -10.176 -22.136
  266   HD12  ILE  34          1HD1      ILE  34  12.344  -9.568 -22.955
  267   HD13  ILE  34          2HD1      ILE  34  11.760  -8.798 -21.453
  268    H    VAL  35           H        VAL  35  10.241  -3.994 -23.170
  269    HA   VAL  35           HA       VAL  35  12.010  -2.538 -25.073
  270    HB   VAL  35           HB       VAL  35  10.638  -0.710 -23.360
  271   HG11  VAL  35          1HG1      VAL  35  10.314  -1.362 -26.313
  272   HG12  VAL  35          HG21      VAL  35   9.808   0.144 -25.500
  273   HG13  VAL  35          HG31      VAL  35  11.531  -0.278 -25.604
  274   HG21  VAL  35          HG32      VAL  35   8.716  -2.610 -24.770
  275   HG22  VAL  35          1HG2      VAL  35   8.852  -2.359 -23.012
  276   HG23  VAL  35          HG22      VAL  35   8.295  -1.044 -24.066
  277    H    GLU  36           H        GLU  36  11.528  -3.627 -21.800
  278    HA   GLU  36           HA       GLU  36  14.245  -2.878 -21.100
  279    HB2  GLU  36           HB2      GLU  36  13.027  -0.752 -20.650
  280    HB3  GLU  36           HB3      GLU  36  11.880  -1.627 -19.619
  281    HG2  GLU  36           HG2      GLU  36  13.648  -2.202 -18.050
  282    HG3  GLU  36           HG3      GLU  36  14.871  -1.505 -19.133
  283    H    VAL  37           H        VAL  37  14.997  -4.090 -19.310
  284    HA   VAL  37           HA       VAL  37  12.975  -5.619 -17.789
  285    HB   VAL  37           HB       VAL  37  15.177  -6.792 -19.446
  286   HG11  VAL  37          1HG1      VAL  37  14.358  -7.972 -16.759
  287   HG12  VAL  37          HG21      VAL  37  15.331  -8.780 -18.003
  288   HG13  VAL  37          HG31      VAL  37  15.976  -7.355 -17.182
  289   HG21  VAL  37          HG32      VAL  37  13.492  -8.653 -19.513
  290   HG22  VAL  37          1HG2      VAL  37  12.483  -7.768 -18.363
  291   HG23  VAL  37          HG22      VAL  37  12.767  -7.095 -19.983
  292    H    LEU  38           H        LEU  38  13.454  -6.017 -15.715
  293    HA   LEU  38           HA       LEU  38  15.999  -4.876 -14.590
  294    HB2  LEU  38           HB2      LEU  38  13.127  -4.637 -13.932
  295    HB3  LEU  38           HB3      LEU  38  14.182  -4.793 -12.547
  296    HG   LEU  38           HG       LEU  38  14.499  -2.655 -14.713
  297   HD11  LEU  38          1HD1      LEU  38  13.485  -2.497 -11.846
  298   HD12  LEU  38          2HD1      LEU  38  13.742  -1.119 -12.933
  299   HD13  LEU  38          3HD1      LEU  38  12.493  -2.322 -13.322
  300   HD21  LEU  38          3HD2      LEU  38  16.659  -3.197 -13.652
  301   HD22  LEU  38          1HD2      LEU  38  16.062  -1.620 -13.098
  302   HD23  LEU  38          2HD2      LEU  38  15.902  -3.043 -12.044
  303    H    LEU  39           H        LEU  39  16.849  -5.990 -12.821
  304    HA   LEU  39           HA       LEU  39  15.447  -8.319 -11.824
  305    HB2  LEU  39           HB2      LEU  39  16.694  -9.186 -13.778
  306    HB3  LEU  39           HB3      LEU  39  18.186  -8.473 -13.163
  307    HG   LEU  39           HG       LEU  39  17.864 -10.958 -12.949
  308   HD11  LEU  39          1HD1      LEU  39  19.023 -11.092 -10.805
  309   HD12  LEU  39          2HD1      LEU  39  19.600  -9.707 -11.775
  310   HD13  LEU  39          3HD1      LEU  39  18.501  -9.453 -10.389
  311   HD21  LEU  39          3HD2      LEU  39  16.727 -11.873 -11.068
  312   HD22  LEU  39          1HD2      LEU  39  16.172 -10.260 -10.534
  313   HD23  LEU  39          2HD2      LEU  39  15.565 -10.965 -12.063
  314    H    MET  40           H        MET  40  15.690  -8.131  -9.621
  315    HA   MET  40           HA       MET  40  17.583  -6.016  -8.822
  316    HB2  MET  40           HB2      MET  40  15.453  -7.277  -7.078
  317    HB3  MET  40           HB3      MET  40  16.236  -5.706  -6.899
  318    HG2  MET  40           HG2      MET  40  14.013  -6.596  -8.687
  319    HG3  MET  40           HG3      MET  40  14.158  -5.128  -7.739
  320    HE1  MET  40           HE3      MET  40  17.080  -4.166  -8.754
  321    HE2  MET  40           HE1      MET  40  16.701  -3.152 -10.174
  322    HE3  MET  40           HE2      MET  40  15.771  -2.974  -8.654
  323    H    LYS  41           H        LYS  41  19.228  -6.263  -7.253
  324    HA   LYS  41           HA       LYS  41  19.466  -8.982  -6.152
  325    HB2  LYS  41           HB2      LYS  41  22.008  -7.802  -7.117
  326    HB3  LYS  41           HB3      LYS  41  21.437  -9.487  -6.964
  327    HG2  LYS  41           HG2      LYS  41  20.220  -9.321  -9.043
  328    HG3  LYS  41           HG3      LYS  41  20.550  -7.569  -9.164
  329    HD2  LYS  41           2HD      LYS  41  22.980  -8.025  -9.235
  330    HD3  LYS  41           3HD      LYS  41  22.659  -9.769  -9.177
  331    HE2  LYS  41           HE2      LYS  41  21.416  -9.638 -11.285
  332    HE3  LYS  41           HE3      LYS  41  21.655  -7.875 -11.338
  333    HZ1  LYS  41           3HZ      LYS  41  23.247  -9.024 -12.707
  334    HZ2  LYS  41           1HZ      LYS  41  24.023  -8.279 -11.461
  335    HZ3  LYS  41           2HZ      LYS  41  23.789  -9.903 -11.428
  336    H    ASP  42           H        ASP  42  21.116  -9.241  -4.531
  337    HA   ASP  42           HA       ASP  42  21.039  -7.235  -2.512
  338    HB2  ASP  42           HB2      ASP  42  21.336  -9.804  -2.344
  339    HB3  ASP  42           HB3      ASP  42  23.023  -9.501  -2.764
  340    H    ARG  43           H        ARG  43  22.722  -5.880  -1.710
  341    HA   ARG  43           HA       ARG  43  24.485  -4.927  -3.855
  342    HB2  ARG  43           HB2      ARG  43  23.020  -3.375  -2.632
  343    HB3  ARG  43           HB3      ARG  43  23.790  -3.820  -1.106
  344    HG2  ARG  43           HG2      ARG  43  24.579  -1.647  -2.012
  345    HG3  ARG  43           HG3      ARG  43  25.891  -2.814  -1.797
  346    HD2  ARG  43           2HD      ARG  43  25.792  -3.354  -4.232
  347    HD3  ARG  43           3HD      ARG  43  24.472  -2.188  -4.420
  348    HE   ARG  43           HE       ARG  43  26.004  -0.456  -4.366
  349   HH11  ARG  43          1HH1      ARG  43  27.571  -3.406  -3.191
  350   HH12  ARG  43          2HH1      ARG  43  29.165  -2.695  -3.187
  351   HH21  ARG  43          1HH2      ARG  43  28.094   0.437  -4.354
  352   HH22  ARG  43          2HH2      ARG  43  29.460  -0.529  -3.832
  353    H    GLU  44           H        GLU  44  24.768  -7.119  -1.288
  354    HA   GLU  44           HA       GLU  44  27.700  -6.594  -1.051
  355    HB2  GLU  44           HB2      GLU  44  25.736  -7.677   0.990
  356    HB3  GLU  44           HB3      GLU  44  27.496  -7.574   1.212
  357    HG2  GLU  44           HG2      GLU  44  27.380  -5.106   0.871
  358    HG3  GLU  44           HG3      GLU  44  25.618  -5.223   0.745
  359    H    THR  45           H        THR  45  25.268  -8.853  -2.048
  360    HA   THR  45           HA       THR  45  27.385 -10.961  -2.130
  361    HB   THR  45           HB       THR  45  25.772 -12.667  -1.830
  362    HG1  THR  45           1HG      THR  45  23.562 -12.152  -1.626
  363   HG21  THR  45          1HG2      THR  45  26.492 -11.423   0.212
  364   HG22  THR  45          HG22      THR  45  25.014 -10.426   0.078
  365   HG23  THR  45          HG32      THR  45  24.885 -12.180   0.376
  366    H    ASN  46           H        ASN  46  25.180  -8.971  -3.878
  367    HA   ASN  46           HA       ASN  46  24.750  -8.789  -6.099
  368    HB2  ASN  46           HB2      ASN  46  27.417 -10.216  -6.116
  369    HB3  ASN  46           HB3      ASN  46  26.649  -9.595  -7.596
  370   HD21  ASN  46          2HD2      ASN  46  26.125  -7.240  -7.662
  371   HD22  ASN  46          1HD2      ASN  46  27.167  -6.140  -6.778
  372    H    LYS  47           H        LYS  47  23.814 -11.265  -4.624
  373    HA   LYS  47           HA       LYS  47  23.520 -13.340  -6.666
  374    HB2  LYS  47           HB2      LYS  47  22.308 -12.855  -3.919
  375    HB3  LYS  47           HB3      LYS  47  21.961 -14.282  -4.904
  376    HG2  LYS  47           HG2      LYS  47  24.752 -13.435  -4.021
  377    HG3  LYS  47           HG3      LYS  47  23.749 -14.642  -3.187
  378    HD2  LYS  47           2HD      LYS  47  23.677 -15.998  -5.276
  379    HD3  LYS  47           3HD      LYS  47  24.776 -14.828  -6.052
  380    HE2  LYS  47           HE2      LYS  47  26.458 -15.249  -4.284
  381    HE3  LYS  47           HE3      LYS  47  25.372 -16.436  -3.538
  382    HZ1  LYS  47           3HZ      LYS  47  27.001 -17.479  -4.956
  383    HZ2  LYS  47           1HZ      LYS  47  25.488 -17.724  -5.553
  384    HZ3  LYS  47           2HZ      LYS  47  26.486 -16.622  -6.258
  385    H    SER  48           H        SER  48  20.627 -12.879  -5.124
  386    HA   SER  48           HA       SER  48  19.528 -10.884  -6.995
  387    HB2  SER  48           HB2      SER  48  19.248 -13.130  -8.138
  388    HB3  SER  48           HB3      SER  48  18.293 -13.652  -6.746
  389    HG   SER  48           HG       SER  48  17.007 -12.798  -8.449
  390    H    ARG  49           H        ARG  49  17.719  -9.825  -6.126
  391    HA   ARG  49           HA       ARG  49  17.175 -10.128  -3.281
  392    HB2  ARG  49           HB2      ARG  49  15.757  -8.620  -5.506
  393    HB3  ARG  49           HB3      ARG  49  15.381  -8.439  -3.785
  394    HG2  ARG  49           HG2      ARG  49  18.224  -8.026  -4.584
  395    HG3  ARG  49           HG3      ARG  49  17.069  -6.813  -5.169
  396    HD2  ARG  49           2HD      ARG  49  17.457  -7.610  -2.266
  397    HD3  ARG  49           3HD      ARG  49  18.119  -6.160  -3.066
  398    HE   ARG  49           HE       ARG  49  15.455  -5.928  -3.577
  399   HH11  ARG  49          1HH1      ARG  49  17.287  -6.464  -0.600
  400   HH12  ARG  49          2HH1      ARG  49  16.125  -5.627   0.406
  401   HH21  ARG  49          1HH2      ARG  49  13.967  -4.801  -2.226
  402   HH22  ARG  49          2HH2      ARG  49  14.255  -4.706  -0.511
  403    H    GLY  50           H        GLY  50  16.267 -11.766  -6.094
  404    HA2  GLY  50           2HA      GLY  50  14.894 -13.630  -6.277
  405    HA3  GLY  50           3HA      GLY  50  14.195 -13.291  -4.686
  406    H    PHE  51           H        PHE  51  14.078 -10.384  -6.450
  407    HA   PHE  51           HA       PHE  51  11.651 -11.185  -7.948
  408    HB2  PHE  51           HB2      PHE  51  10.356  -9.374  -7.154
  409    HB3  PHE  51           HB3      PHE  51  10.889 -10.330  -5.774
  410    HD1  PHE  51           HD1      PHE  51  12.729  -9.445  -4.286
  411    HD2  PHE  51           HD2      PHE  51  10.916  -7.048  -7.375
  412    HE1  PHE  51           HE1      PHE  51  13.580  -7.383  -3.204
  413    HE2  PHE  51           HE2      PHE  51  11.752  -5.010  -6.279
  414    HZ   PHE  51           HZ       PHE  51  13.138  -5.167  -4.246
  415    H    ALA  52           H        ALA  52  11.006  -9.508  -9.549
  416    HA   ALA  52           HA       ALA  52  13.165  -7.722 -10.429
  417    HB1  ALA  52           1HB      ALA  52  13.868  -9.992 -11.177
  418    HB2  ALA  52           HB2      ALA  52  12.311 -10.180 -12.022
  419    HB3  ALA  52           HB3      ALA  52  13.459  -8.949 -12.562
  420    H    PHE  53           H        PHE  53  12.504  -7.065 -12.878
  421    HA   PHE  53           HA       PHE  53   9.577  -6.773 -13.081
  422    HB2  PHE  53           HB2      PHE  53  11.509  -4.408 -13.029
  423    HB3  PHE  53           HB3      PHE  53   9.812  -4.304 -13.422
  424    HD1  PHE  53           HD2      PHE  53  12.273  -5.088 -10.797
  425    HD2  PHE  53           HD1      PHE  53   8.167  -4.218 -11.672
  426    HE1  PHE  53           HE2      PHE  53  11.817  -4.848  -8.366
  427    HE2  PHE  53           HE1      PHE  53   7.692  -3.981  -9.245
  428    HZ   PHE  53           HZ       PHE  53   9.516  -4.319  -7.588
  429    H    VAL  54           H        VAL  54   8.916  -5.946 -15.226
  430    HA   VAL  54           HA       VAL  54  10.973  -5.849 -17.318
  431    HB   VAL  54           HB       VAL  54  10.601  -8.261 -17.193
  432   HG11  VAL  54          1HG1      VAL  54   8.635  -8.336 -16.011
  433   HG12  VAL  54          HG21      VAL  54   7.702  -7.786 -17.456
  434   HG13  VAL  54          HG31      VAL  54   8.598  -9.347 -17.483
  435   HG21  VAL  54          HG32      VAL  54   8.907  -7.211 -19.511
  436   HG22  VAL  54          1HG2      VAL  54  10.676  -7.121 -19.512
  437   HG23  VAL  54          HG22      VAL  54   9.866  -8.705 -19.466
  438    H    THR  55           H        THR  55  10.336  -4.624 -19.036
  439    HA   THR  55           HA       THR  55   7.535  -3.611 -18.946
  440    HB   THR  55           HB       THR  55   9.959  -2.202 -20.103
  441    HG1  THR  55           1HG      THR  55  10.038  -2.345 -17.828
  442   HG21  THR  55          1HG2      THR  55   7.834  -1.550 -21.141
  443   HG22  THR  55          HG22      THR  55   7.072  -1.370 -19.550
  444   HG23  THR  55          HG32      THR  55   8.375  -0.257 -20.047
  445    H    PHE  56           H        PHE  56   6.284  -4.282 -20.491
  446    HA   PHE  56           HA       PHE  56   7.371  -5.388 -23.006
  447    HB2  PHE  56           HB2      PHE  56   4.632  -5.253 -21.713
  448    HB3  PHE  56           HB3      PHE  56   4.889  -5.857 -23.347
  449    HD1  PHE  56           HD1      PHE  56   6.349  -6.455 -19.886
  450    HD2  PHE  56           HD2      PHE  56   5.062  -8.075 -23.663
  451    HE1  PHE  56           HE1      PHE  56   6.858  -8.731 -19.086
  452    HE2  PHE  56           HE2      PHE  56   5.503 -10.355 -22.834
  453    HZ   PHE  56           HZ       PHE  56   6.342 -10.701 -20.525
  454    H    GLU  57           H        GLU  57   6.641  -4.688 -25.121
  455    HA   GLU  57           HA       GLU  57   6.212  -1.855 -25.389
  456    HB2  GLU  57           HB2      GLU  57   6.341  -4.269 -27.224
  457    HB3  GLU  57           HB3      GLU  57   5.742  -2.708 -27.795
  458    HG2  GLU  57           HG2      GLU  57   7.870  -1.650 -26.899
  459    HG3  GLU  57           HG3      GLU  57   8.488  -3.291 -26.627
  460    H    SER  58           H        SER  58   4.065  -4.675 -25.071
  461    HA   SER  58           HA       SER  58   1.777  -2.792 -25.501
  462    HB2  SER  58           HB2      SER  58   1.755  -4.444 -27.251
  463    HB3  SER  58           HB3      SER  58   2.051  -5.748 -26.076
  464    HG   SER  58           HG       SER  58  -0.174  -5.511 -26.703
  465    HA   PRO  59           HA       PRO  59   0.992  -3.578 -21.262
  466    HB2  PRO  59           HB2      PRO  59  -1.503  -2.556 -21.018
  467    HB3  PRO  59           HB3      PRO  59  -0.118  -1.490 -21.454
  468    HG2  PRO  59           HG2      PRO  59  -2.072  -2.884 -23.300
  469    HG3  PRO  59           HG3      PRO  59  -1.725  -1.123 -23.232
  470    HD2  PRO  59           2HD      PRO  59  -0.427  -2.727 -25.007
  471    HD3  PRO  59           3HD      PRO  59   0.489  -1.466 -24.121
  472    H    ALA  60           H        ALA  60  -0.387  -5.267 -23.853
  473    HA   ALA  60           HA       ALA  60  -1.963  -6.982 -22.006
  474    HB1  ALA  60           1HB      ALA  60  -2.411  -6.470 -24.965
  475    HB2  ALA  60           HB2      ALA  60  -3.356  -7.567 -23.929
  476    HB3  ALA  60           HB3      ALA  60  -3.377  -5.818 -23.614
  477    H    ASP  61           H        ASP  61   0.742  -6.807 -24.234
  478    HA   ASP  61           HA       ASP  61   1.014  -9.683 -24.530
  479    HB2  ASP  61           HB2      ASP  61   3.011  -7.366 -24.613
  480    HB3  ASP  61           HB3      ASP  61   3.450  -9.006 -24.871
  481    H    ALA  62           H        ALA  62   1.680  -7.230 -22.110
  482    HA   ALA  62           HA       ALA  62   3.285  -8.920 -20.393
  483    HB1  ALA  62           1HB      ALA  62   3.461  -6.479 -20.389
  484    HB2  ALA  62           HB2      ALA  62   1.755  -6.332 -19.905
  485    HB3  ALA  62           HB3      ALA  62   2.930  -7.062 -18.785
  486    H    LYS  63           H        LYS  63  -0.182  -8.240 -20.827
  487    HA   LYS  63           HA       LYS  63  -1.011  -9.505 -18.354
  488    HB2  LYS  63           HB2      LYS  63  -2.478  -8.949 -20.962
  489    HB3  LYS  63           HB3      LYS  63  -3.249  -9.536 -19.476
  490    HG2  LYS  63           HG2      LYS  63  -2.566  -7.524 -18.262
  491    HG3  LYS  63           HG3      LYS  63  -1.630  -6.974 -19.663
  492    HD2  LYS  63           2HD      LYS  63  -3.731  -5.736 -19.528
  493    HD3  LYS  63           3HD      LYS  63  -3.721  -6.732 -20.979
  494    HE2  LYS  63           HE2      LYS  63  -5.061  -8.467 -19.811
  495    HE3  LYS  63           HE3      LYS  63  -5.067  -7.474 -18.343
  496    HZ1  LYS  63           3HZ      LYS  63  -7.072  -7.182 -19.612
  497    HZ2  LYS  63           1HZ      LYS  63  -6.226  -5.774 -19.590
  498    HZ3  LYS  63           2HZ      LYS  63  -6.226  -6.712 -20.943
  499    H    ASP  64           H        ASP  64  -0.480 -10.518 -21.737
  500    HA   ASP  64           HA       ASP  64  -1.600 -13.133 -21.423
  501    HB2  ASP  64           HB2      ASP  64  -1.092 -11.787 -23.546
  502    HB3  ASP  64           HB3      ASP  64   0.609 -12.187 -23.297
  503    H    ALA  65           H        ALA  65   1.515 -11.726 -20.678
  504    HA   ALA  65           HA       ALA  65   2.731 -14.331 -20.063
  505    HB1  ALA  65           1HB      ALA  65   3.663 -11.550 -19.262
  506    HB2  ALA  65           HB2      ALA  65   4.630 -13.051 -19.328
  507    HB3  ALA  65           HB3      ALA  65   4.041 -12.295 -20.822
  508    H    ALA  66           H        ALA  66   1.264 -11.565 -18.288
  509    HA   ALA  66           HA       ALA  66   1.926 -12.702 -15.731
  510    HB1  ALA  66           1HB      ALA  66  -0.006 -10.459 -16.484
  511    HB2  ALA  66           HB2      ALA  66   0.661 -10.765 -14.862
  512    HB3  ALA  66           HB3      ALA  66   1.726 -10.257 -16.196
  513    H    ARG  67           H        ARG  67  -0.513 -13.489 -17.965
  514    HA   ARG  67           HA       ARG  67  -2.082 -14.819 -15.816
  515    HB2  ARG  67           HB2      ARG  67  -2.709 -14.023 -18.669
  516    HB3  ARG  67           HB3      ARG  67  -3.642 -15.259 -17.829
  517    HG2  ARG  67           HG2      ARG  67  -4.870 -13.337 -17.358
  518    HG3  ARG  67           HG3      ARG  67  -3.891 -13.606 -15.899
  519    HD2  ARG  67           2HD      ARG  67  -2.271 -11.880 -16.764
  520    HD3  ARG  67           3HD      ARG  67  -3.408 -11.573 -18.093
  521    HE   ARG  67           HE       ARG  67  -5.014 -10.729 -16.513
  522   HH11  ARG  67          1HH1      ARG  67  -1.850 -11.425 -15.060
  523   HH12  ARG  67          2HH1      ARG  67  -2.100 -10.291 -13.748
  524   HH21  ARG  67          1HH2      ARG  67  -5.299  -9.323 -14.741
  525   HH22  ARG  67          2HH2      ARG  67  -4.030  -9.159 -13.546
  526    H    ASP  68           H        ASP  68   0.667 -15.611 -17.419
  527    HA   ASP  68           HA       ASP  68  -0.250 -18.393 -18.002
  528    HB2  ASP  68           HB2      ASP  68   1.281 -16.305 -19.490
  529    HB3  ASP  68           HB3      ASP  68   2.052 -17.856 -19.418
  530    H    MET  69           H        MET  69   2.528 -16.257 -17.469
  531    HA   MET  69           HA       MET  69   4.224 -18.306 -16.354
  532    HB2  MET  69           HB2      MET  69   4.287 -15.455 -17.256
  533    HB3  MET  69           HB3      MET  69   5.388 -15.830 -15.976
  534    HG2  MET  69           HG2      MET  69   5.084 -17.250 -18.653
  535    HG3  MET  69           HG3      MET  69   6.389 -16.127 -18.226
  536    HE1  MET  69           HE3      MET  69   8.021 -16.524 -16.317
  537    HE2  MET  69           HE1      MET  69   6.841 -17.213 -15.171
  538    HE3  MET  69           HE2      MET  69   8.362 -18.079 -15.509
  539    H    ASN  70           H        ASN  70   1.736 -16.322 -15.062
  540    HA   ASN  70           HA       ASN  70   2.952 -15.844 -12.479
  541    HB2  ASN  70           HB2      ASN  70   1.123 -14.464 -13.425
  542    HB3  ASN  70           HB3      ASN  70   0.039 -15.855 -13.349
  543   HD21  ASN  70          2HD2      ASN  70  -1.290 -14.375 -12.007
  544   HD22  ASN  70          1HD2      ASN  70  -0.933 -14.247 -10.296
  545    H    GLY  71           H        GLY  71   3.182 -17.213 -10.835
  546    HA2  GLY  71           2HA      GLY  71   2.618 -18.899  -9.337
  547    HA3  GLY  71           3HA      GLY  71   1.303 -19.424 -10.409
  548    H    LYS  72           H        LYS  72   3.766 -19.190 -12.565
  549    HA   LYS  72           HA       LYS  72   4.557 -21.987 -12.472
  550    HB2  LYS  72           HB2      LYS  72   5.426 -19.671 -14.204
  551    HB3  LYS  72           HB3      LYS  72   5.616 -21.393 -14.536
  552    HG2  LYS  72           HG2      LYS  72   2.953 -19.919 -14.407
  553    HG3  LYS  72           HG3      LYS  72   3.748 -20.564 -15.861
  554    HD2  LYS  72           2HD      LYS  72   3.618 -22.850 -14.903
  555    HD3  LYS  72           3HD      LYS  72   2.675 -22.212 -13.540
  556    HE2  LYS  72           HE2      LYS  72   1.929 -21.927 -16.478
  557    HE3  LYS  72           HE3      LYS  72   1.278 -23.158 -15.392
  558    HZ1  LYS  72           3HZ      LYS  72   0.429 -21.347 -14.004
  559    HZ2  LYS  72           1HZ      LYS  72   0.976 -20.244 -15.098
  560    HZ3  LYS  72           2HZ      LYS  72  -0.203 -21.303 -15.523
  561    H    SER  73           H        SER  73   7.145 -21.367 -13.593
  562    HA   SER  73           HA       SER  73   8.675 -20.492 -11.187
  563    HB2  SER  73           HB2      SER  73   8.075 -22.917 -11.095
  564    HB3  SER  73           HB3      SER  73   8.918 -23.167 -12.635
  565    HG   SER  73           HG       SER  73  10.233 -23.633 -10.812
  566    H    LEU  74           H        LEU  74  10.840 -20.216 -11.437
  567    HA   LEU  74           HA       LEU  74  11.847 -19.930 -14.213
  568    HB2  LEU  74           HB2      LEU  74  11.166 -17.705 -12.555
  569    HB3  LEU  74           HB3      LEU  74  12.848 -17.937 -12.289
  570    HG   LEU  74           HG       LEU  74  12.620 -16.382 -14.066
  571   HD11  LEU  74          1HD1      LEU  74  14.465 -17.969 -14.425
  572   HD12  LEU  74          2HD1      LEU  74  13.373 -19.007 -15.392
  573   HD13  LEU  74          3HD1      LEU  74  13.769 -17.374 -15.949
  574   HD21  LEU  74          3HD2      LEU  74  11.356 -16.898 -16.120
  575   HD22  LEU  74          1HD2      LEU  74  11.004 -18.533 -15.507
  576   HD23  LEU  74          2HD2      LEU  74  10.297 -17.099 -14.709
  577    H    ASP  75           H        ASP  75  13.800 -20.877 -14.380
  578    HA   ASP  75           HA       ASP  75  15.598 -22.071 -13.783
  579    HB2  ASP  75           HB2      ASP  75  16.003 -19.466 -13.009
  580    HB3  ASP  75           HB3      ASP  75  15.976 -20.156 -11.472
  581    H    GLY  76           H        GLY  76  13.012 -22.668 -12.369
  582    HA2  GLY  76           2HA      GLY  76  12.753 -24.748 -11.335
  583    HA3  GLY  76           3HA      GLY  76  14.290 -24.539 -10.478
  584    H    LYS  77           H        LYS  77  12.803 -21.576 -10.176
  585    HA   LYS  77           HA       LYS  77  11.671 -22.345  -7.526
  586    HB2  LYS  77           HB2      LYS  77  12.993 -19.720  -8.263
  587    HB3  LYS  77           HB3      LYS  77  12.451 -20.238  -6.656
  588    HG2  LYS  77           HG2      LYS  77  14.670 -21.494  -8.328
  589    HG3  LYS  77           HG3      LYS  77  14.891 -20.485  -6.894
  590    HD2  LYS  77           2HD      LYS  77  13.926 -22.168  -5.451
  591    HD3  LYS  77           3HD      LYS  77  13.377 -23.133  -6.828
  592    HE2  LYS  77           HE2      LYS  77  15.385 -24.131  -5.929
  593    HE3  LYS  77           HE3      LYS  77  15.679 -23.507  -7.556
  594    HZ1  LYS  77           3HZ      LYS  77  17.456 -22.961  -6.020
  595    HZ2  LYS  77           1HZ      LYS  77  16.737 -21.587  -6.565
  596    HZ3  LYS  77           2HZ      LYS  77  16.423 -22.146  -5.044
  597    H    ALA  78           H        ALA  78   9.643 -21.752  -7.061
  598    HA   ALA  78           HA       ALA  78   8.000 -20.946  -9.274
  599    HB1  ALA  78           1HB      ALA  78   7.293 -21.306  -6.343
  600    HB2  ALA  78           HB2      ALA  78   6.143 -21.186  -7.696
  601    HB3  ALA  78           HB3      ALA  78   7.255 -22.566  -7.601
  602    H    ILE  79           H        ILE  79   6.912 -19.082  -9.707
  603    HA   ILE  79           HA       ILE  79   7.711 -16.695  -8.100
  604    HB   ILE  79           HB       ILE  79   7.964 -15.461 -10.120
  605   HG12  ILE  79          HG21      ILE  79   7.151 -17.937 -11.697
  606   HG13  ILE  79          HG31      ILE  79   6.089 -16.557 -11.369
  607   HG21  ILE  79          1HG2      ILE  79   9.848 -16.580 -11.164
  608   HG22  ILE  79          HG22      ILE  79   9.879 -16.875  -9.409
  609   HG23  ILE  79          HG32      ILE  79   9.327 -18.151 -10.531
  610   HD11  ILE  79          3HD1      ILE  79   8.647 -16.537 -13.003
  611   HD12  ILE  79          1HD1      ILE  79   6.985 -16.180 -13.529
  612   HD13  ILE  79          2HD1      ILE  79   7.813 -15.060 -12.438
  613    H    LYS  80           H        LYS  80   6.504 -14.733  -8.791
  614    HA   LYS  80           HA       LYS  80   3.624 -15.201  -9.358
  615    HB2  LYS  80           HB2      LYS  80   4.183 -14.342  -7.014
  616    HB3  LYS  80           HB3      LYS  80   4.858 -12.901  -7.793
  617    HG2  LYS  80           HG2      LYS  80   2.621 -12.551  -8.940
  618    HG3  LYS  80           HG3      LYS  80   1.978 -13.882  -7.959
  619    HD2  LYS  80           2HD      LYS  80   2.668 -12.576  -5.897
  620    HD3  LYS  80           3HD      LYS  80   3.150 -11.251  -6.979
  621    HE2  LYS  80           HE2      LYS  80   0.936 -10.787  -6.132
  622    HE3  LYS  80           HE3      LYS  80   0.831 -11.140  -7.865
  623    HZ1  LYS  80           3HZ      LYS  80   0.251 -13.042  -5.693
  624    HZ2  LYS  80           1HZ      LYS  80  -0.876 -12.270  -6.602
  625    HZ3  LYS  80           2HZ      LYS  80   0.124 -13.373  -7.297
  626    H    VAL  81           H        VAL  81   2.769 -13.822 -10.984
  627    HA   VAL  81           HA       VAL  81   4.561 -11.695 -12.016
  628    HB   VAL  81           HB       VAL  81   3.114 -13.687 -13.812
  629   HG11  VAL  81          1HG1      VAL  81   5.039 -11.407 -14.431
  630   HG12  VAL  81          HG21      VAL  81   4.256 -12.490 -15.612
  631   HG13  VAL  81          HG31      VAL  81   3.280 -11.340 -14.675
  632   HG21  VAL  81          HG32      VAL  81   6.075 -13.305 -13.201
  633   HG22  VAL  81          1HG2      VAL  81   5.080 -14.727 -12.790
  634   HG23  VAL  81          HG22      VAL  81   5.420 -14.339 -14.489
  635    H    GLU  82           H        GLU  82   3.536  -9.817 -12.211
  636    HA   GLU  82           HA       GLU  82   0.688  -9.666 -12.794
  637    HB2  GLU  82           HB2      GLU  82   0.877 -10.312 -10.306
  638    HB3  GLU  82           HB3      GLU  82   1.679  -8.766 -10.051
  639    HG2  GLU  82           HG2      GLU  82  -0.699  -8.638  -9.481
  640    HG3  GLU  82           HG3      GLU  82  -0.364  -7.589 -10.854
  641    H    GLN  83           H        GLN  83   0.003  -7.276 -12.873
  642    HA   GLN  83           HA       GLN  83   2.035  -5.585 -13.946
  643    HB2  GLN  83           HB2      GLN  83  -0.251  -5.161 -14.505
  644    HB3  GLN  83           HB3      GLN  83  -0.735  -5.131 -12.808
  645    HG2  GLN  83           HG2      GLN  83  -0.755  -2.894 -13.665
  646    HG3  GLN  83           HG3      GLN  83   0.510  -3.051 -12.437
  647   HE21  GLN  83          HE22      GLN  83   1.876  -1.475 -12.997
  648   HE22  GLN  83          HE12      GLN  83   2.667  -1.330 -14.544
  649    H    ALA  84           H        ALA  84   3.378  -4.082 -12.991
  650    HA   ALA  84           HA       ALA  84   3.980  -4.690 -10.213
  651    HB1  ALA  84           1HB      ALA  84   5.982  -3.323 -10.646
  652    HB2  ALA  84           HB2      ALA  84   5.735  -4.528 -11.931
  653    HB3  ALA  84           HB3      ALA  84   5.309  -2.818 -12.205
  654    H    THR  85           H        THR  85   4.405  -3.161  -8.576
  655    HA   THR  85           HA       THR  85   3.029  -0.529  -8.853
  656    HB   THR  85           HB       THR  85   3.029  -0.517  -6.364
  657    HG1  THR  85           1HG      THR  85   4.593  -2.102  -6.011
  658   HG21  THR  85          1HG2      THR  85   1.102  -2.060  -6.134
  659   HG22  THR  85          HG22      THR  85   1.004  -1.162  -7.665
  660   HG23  THR  85          HG32      THR  85   1.544  -2.854  -7.664
  661    H    LYS  86           H        LYS  86   4.104   1.139  -7.392
  662    HA   LYS  86           HA       LYS  86   6.839   1.407  -8.256
  663    HB2  LYS  86           HB2      LYS  86   5.052   3.027  -6.400
  664    HB3  LYS  86           HB3      LYS  86   6.658   3.545  -6.938
  665    HG2  LYS  86           HG2      LYS  86   5.828   3.168  -9.340
  666    HG3  LYS  86           HG3      LYS  86   4.201   2.979  -8.652
  667    HD2  LYS  86           2HD      LYS  86   4.540   5.272  -7.562
  668    HD3  LYS  86           3HD      LYS  86   5.998   5.432  -8.563
  669    HE2  LYS  86           HE2      LYS  86   4.604   4.996 -10.599
  670    HE3  LYS  86           HE3      LYS  86   3.167   4.938  -9.565
  671    HZ1  LYS  86           3HZ      LYS  86   3.619   7.189  -8.889
  672    HZ2  LYS  86           1HZ      LYS  86   4.932   7.273  -9.874
  673    HZ3  LYS  86           2HZ      LYS  86   3.429   7.106 -10.518
  674    HA   PRO  87           HA       PRO  87   9.099  -0.404  -5.021
  675    HB2  PRO  87           HB2      PRO  87  11.116   1.368  -4.425
  676    HB3  PRO  87           HB3      PRO  87  11.037   0.417  -5.940
  677    HG2  PRO  87           HG2      PRO  87  10.086   3.262  -5.507
  678    HG3  PRO  87           HG3      PRO  87  11.153   2.633  -6.815
  679    HD2  PRO  87           2HD      PRO  87   8.519   2.959  -7.247
  680    HD3  PRO  87           3HD      PRO  87   9.333   1.485  -7.843
  681    H    SER  88           H        SER  88   9.454  -0.457  -2.735
  682    HA   SER  88           HA       SER  88   7.357   1.009  -1.391
  683    HB2  SER  88           HB2      SER  88   7.859  -1.422  -1.043
  684    HB3  SER  88           HB3      SER  88   9.384  -0.960  -0.257
  685    HG   SER  88           HG       SER  88   7.668  -1.287   1.233
  686    H    PHE  89           H        PHE  89  10.691   1.674  -1.915
  687    HA   PHE  89           HA       PHE  89  10.946   3.213   0.563
  688    HB2  PHE  89           HB2      PHE  89  13.123   3.820  -0.213
  689    HB3  PHE  89           HB3      PHE  89  12.892   2.068  -0.293
  690    HD1  PHE  89           HD2      PHE  89  12.932   5.187  -2.339
  691    HD2  PHE  89           HD1      PHE  89  13.308   0.910  -2.335
  692    HE1  PHE  89           HE2      PHE  89  13.780   5.259  -4.670
  693    HE2  PHE  89           HE1      PHE  89  14.209   0.991  -4.651
  694    HZ   PHE  89           HZ       PHE  89  14.428   3.151  -5.824
  695    H    GLU  90           H        GLU  90   9.041   3.722  -1.993
  696    HA   GLU  90           HA       GLU  90   9.505   6.650  -1.967
  697    HB2  GLU  90           HB2      GLU  90  10.610   5.417  -3.932
  698    HB3  GLU  90           HB3      GLU  90   8.967   5.064  -4.494
  699    HG2  GLU  90           HG2      GLU  90   8.492   7.511  -4.539
  700    HG3  GLU  90           HG3      GLU  90  10.123   7.823  -3.910
  701    H    SER  91           H        SER  91   7.764   7.931  -2.379
  702    HA   SER  91           HA       SER  91   5.083   6.809  -2.792
  703    HB2  SER  91           HB2      SER  91   6.083   8.018  -0.200
  704    HB3  SER  91           HB3      SER  91   4.356   8.028  -0.633
  705    HG   SER  91           HG       SER  91   6.018   5.738  -0.432
  706    H    GLY  92           H        GLY  92   7.246   8.937  -3.749
  707    HA2  GLY  92           2HA      GLY  92   7.140  11.055  -4.691
  708    HA3  GLY  92           3HA      GLY  92   5.397  11.078  -4.359
  709    H    ARG  93           H        ARG  93   5.645  13.270  -3.691
  710    HA   ARG  93           HA       ARG  93   5.947  15.020  -2.308
  711    HB2  ARG  93           HB2      ARG  93   4.556  13.499  -0.910
  712    HB3  ARG  93           HB3      ARG  93   6.018  12.926  -0.111
  713    HG2  ARG  93           HG2      ARG  93   4.852  14.609   1.236
  714    HG3  ARG  93           HG3      ARG  93   6.460  15.174   0.779
  715    HD2  ARG  93           2HD      ARG  93   4.798  16.968   0.554
  716    HD3  ARG  93           3HD      ARG  93   5.471  16.555  -1.025
  717    HE   ARG  93           HE       ARG  93   3.110  15.009  -0.575
  718   HH11  ARG  93          1HH1      ARG  93   4.100  18.344  -1.214
  719   HH12  ARG  93          2HH1      ARG  93   2.598  18.758  -2.010
  720   HH21  ARG  93          1HH2      ARG  93   1.167  15.576  -1.618
  721   HH22  ARG  93          2HH2      ARG  93   0.941  17.196  -2.228
  722    H    ARG  94           H        ARG  94   7.408  16.218  -0.844
  723    HA   ARG  94           HA       ARG  94  10.081  15.069  -0.435
  724    HB2  ARG  94           HB2      ARG  94  10.068  15.964  -2.776
  725    HB3  ARG  94           HB3      ARG  94   9.655  17.564  -2.136
  726    HG2  ARG  94           HG2      ARG  94  11.768  17.616  -0.869
  727    HG3  ARG  94           HG3      ARG  94  12.149  15.964  -1.409
  728    HD2  ARG  94           2HD      ARG  94  12.168  16.729  -3.752
  729    HD3  ARG  94           3HD      ARG  94  11.770  18.382  -3.218
  730    HE   ARG  94           HE       ARG  94  14.092  17.555  -1.832
  731   HH11  ARG  94          1HH1      ARG  94  13.082  18.296  -5.135
  732   HH12  ARG  94          2HH1      ARG  94  14.678  18.811  -5.633
  733   HH21  ARG  94          1HH2      ARG  94  16.169  18.215  -2.513
  734   HH22  ARG  94          2HH2      ARG  94  16.420  18.753  -4.156
  735    H    GLY  95           H        GLY  95  11.326  16.268   1.081
  736    HA2  GLY  95           2HA      GLY  95   9.795  17.633   3.099
  737    HA3  GLY  95           3HA      GLY  95  11.551  17.413   3.065
  738    H5'    A  96           H5'        A  96   2.616  -7.468   0.631
  739   H5''    A  96          H5''        A  96   2.389  -8.870  -0.418
  740    H4'    A  96           H4'        A  96   0.147  -7.108   0.722
  741    H3'    A  96           H3'        A  96   1.496  -9.609   1.627
  742    H2'    A  96           H2'        A  96  -0.477 -10.915   1.807
  743   HO2'    A  96          HO2'        A  96  -1.779  -9.163   2.699
  744    H1'    A  96           H1'        A  96  -1.575 -10.287  -0.546
  745    H8     A  96           H8         A  96   1.677  -9.901  -1.971
  746    H61    A  96           H61        A  96   2.915 -15.904  -0.994
  747    H62    A  96           H62        A  96   3.413 -14.462  -1.861
  748    H2     A  96           H2         A  96  -0.648 -14.825   1.415
  749   HO5'    A  96          H5T         A  96   1.344  -7.410  -1.903
  750    H5'    U  97           H5'        U  97   3.194  -9.973   2.850
  751   H5''    U  97          H5''        U  97   1.684 -10.854   3.130
  752    H4'    U  97           H4'        U  97   4.229 -10.972   4.783
  753    H3'    U  97           H3'        U  97   3.761 -12.188   2.369
  754    H2'    U  97           H2'        U  97   2.053 -13.641   2.771
  755   HO2'    U  97          HO2'        U  97   3.902 -15.057   2.870
  756    H1'    U  97           H1'        U  97   2.353 -14.124   5.637
  757    H3     U  97           H3         U  97  -2.039 -14.001   6.564
  758    H5     U  97           H5         U  97  -1.790 -12.211   2.775
  759    H6     U  97           H6         U  97   0.644 -12.324   2.950
  760    H5'    C  98           H5'        C  98   5.384 -11.072   1.513
  761   H5''    C  98          H5''        C  98   5.398 -12.364   0.305
  762    H4'    C  98           H4'        C  98   7.658 -10.364   0.776
  763    H3'    C  98           H3'        C  98   5.320  -9.607  -0.357
  764    H2'    C  98           H2'        C  98   5.047 -11.599  -1.667
  765   HO2'    C  98          HO2'        C  98   6.296  -9.623  -3.286
  766    H1'    C  98           H1'        C  98   7.834 -11.382  -2.760
  767    H41    C  98           H41        C  98   5.970 -17.189  -4.551
  768    H42    C  98           H42        C  98   5.679 -17.665  -2.885
  769    H5     C  98           H5         C  98   5.914 -16.111  -1.014
  770    H6     C  98           H6         C  98   6.486 -13.821  -0.409
  771    H5'    A  99           H5'        A  99   9.400  -7.839  -2.358
  772   H5''    A  99          H5''        A  99  10.041  -6.623  -1.239
  773    H4'    A  99           H4'        A  99  10.547  -5.928  -3.499
  774    H3'    A  99           H3'        A  99   9.030  -4.270  -1.760
  775    H2'    A  99           H2'        A  99   7.051  -4.435  -3.098
  776   HO2'    A  99          HO2'        A  99   7.675  -2.231  -3.244
  777    H1'    A  99           H1'        A  99   8.917  -4.599  -5.470
  778    H8     A  99           H8         A  99   7.194  -3.794  -7.129
  779    H61    A  99           H61        A  99   1.896  -7.052  -6.922
  780    H62    A  99           H62        A  99   2.809  -5.876  -7.856
  781    H2     A  99           H2         A  99   4.355  -8.161  -3.414
  782    H5'    A 100           H5'        A 100  13.067  -1.367  -4.000
  783   H5''    A 100          H5''        A 100  11.818  -2.288  -4.874
  784    H4'    A 100           H4'        A 100  14.439  -3.589  -5.099
  785    H3'    A 100           H3'        A 100  14.889  -0.951  -4.995
  786    H2'    A 100           H2'        A 100  12.877  -0.401  -6.143
  787   HO2'    A 100          HO2'        A 100  14.973  -0.351  -8.087
  788    H1'    A 100           H1'        A 100  13.603  -2.249  -8.414
  789    H8     A 100           H8         A 100  10.484  -2.100  -6.107
  790    H61    A 100           H61        A 100   7.517  -0.057 -11.162
  791    H62    A 100           H62        A 100   7.328  -0.592  -9.502
  792    H2     A 100           H2         A 100  11.825  -0.441 -12.152
  793    H5'    A 101           H5'        A 101  16.502   0.530  -6.673
  794   H5''    A 101          H5''        A 101  18.138   0.107  -7.195
  795    H4'    A 101           H4'        A 101  17.967   2.471  -6.565
  796    H3'    A 101           H3'        A 101  19.996   0.746  -5.846
  797   HO3'    A 101          H3T         A 101  21.070   2.731  -5.220
  798    H2'    A 101           H2'        A 101  19.208   0.241  -3.702
  799   HO2'    A 101          HO2'        A 101  21.264   1.212  -3.388
  800    H1'    A 101           H1'        A 101  18.396   3.107  -3.227
  801    H8     A 101           H8         A 101  17.643  -0.642  -2.782
  802    H61    A 101           H61        A 101  14.589   1.142   2.339
  803    H62    A 101           H62        A 101  15.134  -0.246   1.412
  804    H2     A 101           H2         A 101  15.857   4.772   0.138
  Start of MODEL   18
    1    H1   MET   1           H1       MET   1  -2.028   4.289  -0.753
    2    H2   MET   1           H2       MET   1  -2.189   5.330  -2.014
    3    H3   MET   1           H3       MET   1  -0.858   5.406  -1.052
    4    HA   MET   1           HA       MET   1  -0.307   4.360  -3.137
    5    HB2  MET   1           HB2      MET   1   0.912   3.687  -1.097
    6    HB3  MET   1           HB3      MET   1  -0.311   2.445  -0.774
    7    HG2  MET   1           HG2      MET   1   1.686   1.512  -1.900
    8    HG3  MET   1           HG3      MET   1   0.232   1.324  -2.883
    9    HE1  MET   1           HE1      MET   1   2.856   0.752  -4.241
   10    HE2  MET   1           HE2      MET   1   1.296   0.852  -5.093
   11    HE3  MET   1           HE3      MET   1   2.723   1.697  -5.744
   12    H    VAL   2           H        VAL   2  -1.988   4.237  -4.562
   13    HA   VAL   2           HA       VAL   2  -3.170   1.536  -4.782
   14    HB   VAL   2           HB       VAL   2  -4.978   3.035  -4.182
   15   HG11  VAL   2          1HG1      VAL   2  -5.461   5.104  -5.469
   16   HG12  VAL   2          HG21      VAL   2  -3.909   5.200  -4.624
   17   HG13  VAL   2          HG31      VAL   2  -3.944   4.880  -6.376
   18   HG21  VAL   2          HG32      VAL   2  -5.074   2.930  -7.203
   19   HG22  VAL   2          1HG2      VAL   2  -5.320   1.488  -6.181
   20   HG23  VAL   2          HG22      VAL   2  -6.440   2.875  -6.064
   21    H    GLU   3           H        GLU   3  -0.711   3.108  -5.627
   22    HA   GLU   3           HA       GLU   3  -1.082   3.826  -8.365
   23    HB2  GLU   3           HB2      GLU   3   1.445   3.431  -6.695
   24    HB3  GLU   3           HB3      GLU   3   1.368   4.294  -8.234
   25    HG2  GLU   3           HG2      GLU   3  -0.173   5.094  -5.731
   26    HG3  GLU   3           HG3      GLU   3   1.377   5.786  -6.229
   27    H    ALA   4           H        ALA   4  -0.325   2.964 -10.212
   28    HA   ALA   4           HA       ALA   4   1.031   0.343 -10.194
   29    HB1  ALA   4           1HB      ALA   4  -0.617  -0.551 -11.805
   30    HB2  ALA   4           HB2      ALA   4  -1.376  -0.160 -10.241
   31    HB3  ALA   4           HB3      ALA   4  -1.592   0.935 -11.626
   32    H    ASP   5           H        ASP   5   2.858   1.105 -11.112
   33    HA   ASP   5           HA       ASP   5   2.815   3.367 -12.908
   34    HB2  ASP   5           HB2      ASP   5   4.514   3.080 -11.201
   35    HB3  ASP   5           HB3      ASP   5   5.043   1.560 -11.913
   36    H    ARG   6           H        ARG   6   2.771   3.425 -14.988
   37    HA   ARG   6           HA       ARG   6   2.633   2.862 -17.167
   38    HB2  ARG   6           HB2      ARG   6   5.020   3.273 -16.763
   39    HB3  ARG   6           HB3      ARG   6   5.271   1.535 -16.489
   40    HG2  ARG   6           HG2      ARG   6   4.500   1.056 -18.789
   41    HG3  ARG   6           HG3      ARG   6   4.176   2.783 -19.050
   42    HD2  ARG   6           2HD      ARG   6   6.567   3.283 -18.685
   43    HD3  ARG   6           3HD      ARG   6   6.894   1.560 -18.422
   44    HE   ARG   6           HE       ARG   6   5.620   1.736 -20.912
   45   HH11  ARG   6          1HH1      ARG   6   8.597   2.943 -19.444
   46   HH12  ARG   6          2HH1      ARG   6   9.478   2.960 -20.955
   47   HH21  ARG   6          1HH2      ARG   6   6.787   1.774 -22.874
   48   HH22  ARG   6          2HH2      ARG   6   8.452   2.304 -22.890
   49    HA   PRO   7           HA       PRO   7   0.601  -1.235 -17.207
   50    HB2  PRO   7           HB2      PRO   7   0.039   0.160 -19.837
   51    HB3  PRO   7           HB3      PRO   7  -1.056  -0.937 -18.925
   52    HG2  PRO   7           HG2      PRO   7  -1.389   1.696 -18.791
   53    HG3  PRO   7           HG3      PRO   7  -1.372   0.761 -17.244
   54    HD2  PRO   7           2HD      PRO   7   0.872   2.376 -18.504
   55    HD3  PRO   7           3HD      PRO   7   0.373   2.318 -16.782
   56    H    GLY   8           H        GLY   8   1.589  -3.098 -18.038
   57    HA2  GLY   8           2HA      GLY   8   2.721  -4.265 -19.791
   58    HA3  GLY   8           3HA      GLY   8   3.514  -2.740 -20.275
   59    H    LYS   9           H        LYS   9   3.633  -2.347 -17.048
   60    HA   LYS   9           HA       LYS   9   6.281  -3.653 -16.919
   61    HB2  LYS   9           HB2      LYS   9   6.161  -1.273 -16.278
   62    HB3  LYS   9           HB3      LYS   9   5.013  -1.692 -14.980
   63    HG2  LYS   9           HG2      LYS   9   6.694  -3.260 -14.021
   64    HG3  LYS   9           HG3      LYS   9   7.838  -2.813 -15.299
   65    HD2  LYS   9           2HD      LYS   9   6.646  -0.853 -13.304
   66    HD3  LYS   9           3HD      LYS   9   8.204  -1.690 -13.087
   67    HE2  LYS   9           HE2      LYS   9   9.041  -0.706 -15.190
   68    HE3  LYS   9           HE3      LYS   9   7.501   0.133 -15.426
   69    HZ1  LYS   9           3HZ      LYS   9   7.890   1.381 -13.466
   70    HZ2  LYS   9           1HZ      LYS   9   9.256   0.538 -13.096
   71    HZ3  LYS   9           2HZ      LYS   9   9.209   1.528 -14.414
   72    H    LEU  10           H        LEU  10   6.622  -5.450 -15.787
   73    HA   LEU  10           HA       LEU  10   4.326  -6.526 -14.213
   74    HB2  LEU  10           HB2      LEU  10   6.490  -7.845 -15.853
   75    HB3  LEU  10           HB3      LEU  10   5.413  -8.771 -14.873
   76    HG   LEU  10           HG       LEU  10   4.597  -7.015 -17.234
   77   HD11  LEU  10          1HD1      LEU  10   4.438 -10.037 -16.832
   78   HD12  LEU  10          2HD1      LEU  10   4.247  -9.143 -18.354
   79   HD13  LEU  10          3HD1      LEU  10   5.847  -9.259 -17.567
   80   HD21  LEU  10          3HD2      LEU  10   2.907  -8.809 -15.460
   81   HD22  LEU  10          1HD2      LEU  10   2.759  -7.034 -15.650
   82   HD23  LEU  10          2HD2      LEU  10   2.390  -8.113 -17.012
   83    H    PHE  11           H        PHE  11   4.750  -7.525 -12.265
   84    HA   PHE  11           HA       PHE  11   7.433  -7.096 -11.058
   85    HB2  PHE  11           HB2      PHE  11   5.648  -6.113  -9.769
   86    HB3  PHE  11           HB3      PHE  11   4.650  -7.562  -9.933
   87    HD1  PHE  11           HD1      PHE  11   7.881  -6.352  -8.504
   88    HD2  PHE  11           HD2      PHE  11   4.739  -9.282  -8.329
   89    HE1  PHE  11           HE1      PHE  11   8.843  -7.261  -6.399
   90    HE2  PHE  11           HE2      PHE  11   5.699 -10.196  -6.243
   91    HZ   PHE  11           HZ       PHE  11   7.777  -9.180  -5.280
   92    H    ILE  12           H        ILE  12   8.696  -8.833 -10.723
   93    HA   ILE  12           HA       ILE  12   7.492 -11.515 -11.224
   94    HB   ILE  12           HB       ILE  12  10.362 -10.786 -11.811
   95   HG12  ILE  12          HG21      ILE  12   9.161  -9.195 -13.173
   96   HG13  ILE  12          HG31      ILE  12   9.870 -10.471 -14.158
   97   HG21  ILE  12          1HG2      ILE  12   9.693 -13.157 -11.672
   98   HG22  ILE  12          HG22      ILE  12   8.412 -12.872 -12.868
   99   HG23  ILE  12          HG32      ILE  12  10.116 -12.723 -13.350
  100   HD11  ILE  12          3HD1      ILE  12   6.935 -10.154 -13.435
  101   HD12  ILE  12          1HD1      ILE  12   7.702  -9.942 -15.019
  102   HD13  ILE  12          2HD1      ILE  12   7.606 -11.559 -14.299
  103    H    GLY  13           H        GLY  13   7.113 -11.632  -8.865
  104    HA2  GLY  13           2HA      GLY  13   9.545 -11.552  -7.177
  105    HA3  GLY  13           3HA      GLY  13   7.895 -11.675  -6.606
  106    H    GLY  14           H        GLY  14  10.441 -13.360  -6.130
  107    HA2  GLY  14           2HA      GLY  14  10.256 -15.489  -5.101
  108    HA3  GLY  14           3HA      GLY  14   8.940 -15.916  -6.218
  109    H    LEU  15           H        LEU  15  11.584 -14.309  -7.691
  110    HA   LEU  15           HA       LEU  15  12.132 -16.500  -9.448
  111    HB2  LEU  15           HB2      LEU  15  13.605 -13.902  -8.844
  112    HB3  LEU  15           HB3      LEU  15  14.027 -15.027 -10.163
  113    HG   LEU  15           HG       LEU  15  11.236 -13.895 -10.019
  114   HD11  LEU  15          1HD1      LEU  15  13.741 -12.686 -11.294
  115   HD12  LEU  15          2HD1      LEU  15  12.071 -12.157 -11.610
  116   HD13  LEU  15          3HD1      LEU  15  12.776 -11.966  -9.984
  117   HD21  LEU  15          3HD2      LEU  15  11.914 -15.848 -11.510
  118   HD22  LEU  15          1HD2      LEU  15  11.363 -14.418 -12.418
  119   HD23  LEU  15          2HD2      LEU  15  13.101 -14.768 -12.270
  120    H    ASN  16           H        ASN  16  14.260 -17.326  -9.951
  121    HA   ASN  16           HA       ASN  16  15.546 -18.563  -7.686
  122    HB2  ASN  16           HB2      ASN  16  15.311 -20.030  -9.324
  123    HB3  ASN  16           HB3      ASN  16  15.336 -18.802 -10.610
  124   HD21  ASN  16          2HD2      ASN  16  16.983 -21.360  -9.115
  125   HD22  ASN  16          1HD2      ASN  16  18.487 -21.111  -9.983
  126    H    THR  17           H        THR  17  17.714 -18.295  -7.068
  127    HA   THR  17           HA       THR  17  18.611 -15.560  -7.117
  128    HB   THR  17           HB       THR  17  20.369 -16.407  -5.623
  129    HG1  THR  17           1HG      THR  17  20.756 -18.399  -6.613
  130   HG21  THR  17          1HG2      THR  17  18.949 -17.319  -3.867
  131   HG22  THR  17          HG22      THR  17  18.043 -16.051  -4.734
  132   HG23  THR  17          HG32      THR  17  17.709 -17.778  -5.061
  133    H    GLU  18           H        GLU  18  19.028 -18.061  -9.296
  134    HA   GLU  18           HA       GLU  18  21.812 -17.409 -10.030
  135    HB2  GLU  18           HB2      GLU  18  20.110 -19.639 -11.159
  136    HB3  GLU  18           HB3      GLU  18  21.863 -19.565 -11.003
  137    HG2  GLU  18           HG2      GLU  18  19.885 -19.788  -8.673
  138    HG3  GLU  18           HG3      GLU  18  20.733 -21.128  -9.386
  139    H    THR  19           H        THR  19  18.561 -16.767 -10.819
  140    HA   THR  19           HA       THR  19  18.795 -16.465 -13.688
  141    HB   THR  19           HB       THR  19  16.726 -15.512 -11.665
  142    HG1  THR  19           1HG      THR  19  17.083 -17.801 -11.919
  143   HG21  THR  19          1HG2      THR  19  15.194 -15.379 -13.590
  144   HG22  THR  19          HG22      THR  19  16.527 -14.222 -13.749
  145   HG23  THR  19          HG32      THR  19  16.543 -15.730 -14.696
  146    H    ASN  20           H        ASN  20  18.871 -14.543 -14.863
  147    HA   ASN  20           HA       ASN  20  19.356 -12.037 -13.356
  148    HB2  ASN  20           HB2      ASN  20  20.936 -12.430 -15.822
  149    HB3  ASN  20           HB3      ASN  20  21.351 -11.539 -14.356
  150   HD21  ASN  20          2HD2      ASN  20  21.409 -14.607 -16.036
  151   HD22  ASN  20          1HD2      ASN  20  22.446 -15.451 -14.904
  152    H    GLU  21           H        GLU  21  19.877 -10.482 -15.630
  153    HA   GLU  21           HA       GLU  21  17.152  -9.968 -16.409
  154    HB2  GLU  21           HB2      GLU  21  19.818  -8.802 -17.261
  155    HB3  GLU  21           HB3      GLU  21  18.242  -8.145 -17.764
  156    HG2  GLU  21           HG2      GLU  21  17.624  -7.684 -15.460
  157    HG3  GLU  21           HG3      GLU  21  18.986  -8.622 -14.868
  158    H    LYS  22           H        LYS  22  19.988 -11.456 -18.046
  159    HA   LYS  22           HA       LYS  22  18.849 -11.345 -20.662
  160    HB2  LYS  22           HB2      LYS  22  21.233 -11.611 -20.291
  161    HB3  LYS  22           HB3      LYS  22  20.983 -13.126 -19.411
  162    HG2  LYS  22           HG2      LYS  22  21.776 -13.441 -21.761
  163    HG3  LYS  22           HG3      LYS  22  20.238 -14.258 -21.419
  164    HD2  LYS  22           2HD      LYS  22  18.992 -12.453 -22.535
  165    HD3  LYS  22           3HD      LYS  22  20.490 -11.522 -22.749
  166    HE2  LYS  22           HE2      LYS  22  21.399 -13.343 -24.167
  167    HE3  LYS  22           HE3      LYS  22  19.904 -14.268 -23.938
  168    HZ1  LYS  22           3HZ      LYS  22  20.111 -11.636 -25.241
  169    HZ2  LYS  22           1HZ      LYS  22  19.870 -13.076 -25.996
  170    HZ3  LYS  22           2HZ      LYS  22  18.713 -12.467 -25.002
  171    H    ALA  23           H        ALA  23  18.400 -13.547 -17.957
  172    HA   ALA  23           HA       ALA  23  17.194 -15.626 -19.676
  173    HB1  ALA  23           1HB      ALA  23  17.461 -15.371 -16.648
  174    HB2  ALA  23           HB2      ALA  23  16.866 -16.805 -17.517
  175    HB3  ALA  23           HB3      ALA  23  18.551 -16.279 -17.722
  176    H    LEU  24           H        LEU  24  16.368 -12.767 -17.982
  177    HA   LEU  24           HA       LEU  24  13.563 -13.444 -17.539
  178    HB2  LEU  24           HB2      LEU  24  15.642 -11.526 -16.691
  179    HB3  LEU  24           HB3      LEU  24  14.147 -10.686 -16.984
  180    HG   LEU  24           HG       LEU  24  14.544 -13.174 -15.265
  181   HD11  LEU  24          1HD1      LEU  24  14.123 -10.256 -14.476
  182   HD12  LEU  24          2HD1      LEU  24  14.172 -11.639 -13.355
  183   HD13  LEU  24          3HD1      LEU  24  15.626 -11.199 -14.284
  184   HD21  LEU  24          3HD2      LEU  24  12.264 -12.651 -14.390
  185   HD22  LEU  24          1HD2      LEU  24  12.130 -11.332 -15.579
  186   HD23  LEU  24          2HD2      LEU  24  12.254 -13.020 -16.128
  187    H    GLU  25           H        GLU  25  15.638 -11.637 -19.744
  188    HA   GLU  25           HA       GLU  25  13.400 -10.470 -21.186
  189    HB2  GLU  25           HB2      GLU  25  16.350 -10.909 -21.897
  190    HB3  GLU  25           HB3      GLU  25  15.196 -10.082 -22.969
  191    HG2  GLU  25           HG2      GLU  25  14.667  -8.509 -21.179
  192    HG3  GLU  25           HG3      GLU  25  15.919  -9.229 -20.150
  193    H    ALA  26           H        ALA  26  15.192 -13.417 -21.142
  194    HA   ALA  26           HA       ALA  26  14.519 -14.310 -23.826
  195    HB1  ALA  26           1HB      ALA  26  15.749 -15.693 -21.423
  196    HB2  ALA  26           HB2      ALA  26  15.686 -16.366 -23.069
  197    HB3  ALA  26           HB3      ALA  26  16.635 -14.890 -22.743
  198    H    VAL  27           H        VAL  27  13.109 -14.517 -20.622
  199    HA   VAL  27           HA       VAL  27  11.445 -16.841 -21.390
  200    HB   VAL  27           HB       VAL  27  12.893 -16.689 -19.366
  201   HG11  VAL  27          1HG1      VAL  27  10.660 -15.030 -18.227
  202   HG12  VAL  27          HG21      VAL  27  12.185 -15.532 -17.436
  203   HG13  VAL  27          HG31      VAL  27  12.233 -14.361 -18.781
  204   HG21  VAL  27          HG32      VAL  27  11.223 -17.778 -17.897
  205   HG22  VAL  27          1HG2      VAL  27   9.908 -17.159 -18.936
  206   HG23  VAL  27          HG22      VAL  27  11.068 -18.358 -19.580
  207    H    PHE  28           H        PHE  28  11.219 -13.454 -20.340
  208    HA   PHE  28           HA       PHE  28   8.278 -13.582 -20.643
  209    HB2  PHE  28           HB2      PHE  28  10.112 -11.346 -19.753
  210    HB3  PHE  28           HB3      PHE  28   8.368 -11.168 -20.028
  211    HD1  PHE  28           HD2      PHE  28   6.714 -12.274 -18.613
  212    HD2  PHE  28           HD1      PHE  28  10.925 -12.602 -17.816
  213    HE1  PHE  28           HE2      PHE  28   6.221 -13.155 -16.349
  214    HE2  PHE  28           HE1      PHE  28  10.437 -13.533 -15.586
  215    HZ   PHE  28           HZ       PHE  28   8.079 -13.769 -14.823
  216    H    GLY  29           H        GLY  29  11.002 -13.013 -22.630
  217    HA2  GLY  29           2HA      GLY  29   9.721 -11.159 -24.471
  218    HA3  GLY  29           3HA      GLY  29  11.188 -12.113 -24.779
  219    H    LYS  30           H        LYS  30   9.119 -14.340 -23.651
  220    HA   LYS  30           HA       LYS  30   8.559 -15.472 -26.260
  221    HB2  LYS  30           HB2      LYS  30   7.791 -16.320 -23.427
  222    HB3  LYS  30           HB3      LYS  30   7.743 -17.353 -24.875
  223    HG2  LYS  30           HG2      LYS  30  10.170 -17.118 -25.138
  224    HG3  LYS  30           HG3      LYS  30  10.254 -16.012 -23.764
  225    HD2  LYS  30           2HD      LYS  30  10.978 -18.296 -23.139
  226    HD3  LYS  30           3HD      LYS  30   9.605 -17.732 -22.194
  227    HE2  LYS  30           HE2      LYS  30   9.261 -20.038 -22.800
  228    HE3  LYS  30           HE3      LYS  30   8.056 -19.025 -23.607
  229    HZ1  LYS  30           3HZ      LYS  30   8.992 -20.655 -25.096
  230    HZ2  LYS  30           1HZ      LYS  30   9.390 -19.145 -25.610
  231    HZ3  LYS  30           2HZ      LYS  30  10.509 -20.086 -24.853
  232    H    TYR  31           H        TYR  31   7.011 -13.307 -24.194
  233    HA   TYR  31           HA       TYR  31   4.287 -14.030 -25.190
  234    HB2  TYR  31           HB2      TYR  31   5.188 -12.478 -22.755
  235    HB3  TYR  31           HB3      TYR  31   3.508 -12.858 -23.164
  236    HD1  TYR  31           HD2      TYR  31   2.905 -15.364 -23.387
  237    HD2  TYR  31           HD1      TYR  31   6.445 -13.908 -21.446
  238    HE1  TYR  31           HE2      TYR  31   3.152 -17.547 -22.231
  239    HE2  TYR  31           HE1      TYR  31   6.687 -16.083 -20.235
  240    HH   TYR  31           HH       TYR  31   5.913 -18.264 -20.080
  241    H    GLY  32           H        GLY  32   6.776 -11.609 -25.489
  242    HA2  GLY  32           2HA      GLY  32   5.341  -9.995 -27.267
  243    HA3  GLY  32           3HA      GLY  32   5.045  -9.323 -25.650
  244    H    ARG  33           H        ARG  33   6.243  -7.665 -27.427
  245    HA   ARG  33           HA       ARG  33   9.101  -8.034 -27.404
  246    HB2  ARG  33           HB2      ARG  33   7.571  -6.984 -29.226
  247    HB3  ARG  33           HB3      ARG  33   7.615  -5.516 -28.212
  248    HG2  ARG  33           HG2      ARG  33  10.081  -5.553 -28.281
  249    HG3  ARG  33           HG3      ARG  33  10.013  -7.096 -29.167
  250    HD2  ARG  33           2HD      ARG  33   8.879  -4.454 -30.186
  251    HD3  ARG  33           3HD      ARG  33  10.469  -5.085 -30.617
  252    HE   ARG  33           HE       ARG  33   9.442  -6.921 -31.783
  253   HH11  ARG  33          1HH1      ARG  33   7.117  -4.456 -30.711
  254   HH12  ARG  33          2HH1      ARG  33   5.902  -4.970 -31.852
  255   HH21  ARG  33          1HH2      ARG  33   7.840  -7.535 -33.248
  256   HH22  ARG  33          2HH2      ARG  33   6.307  -6.698 -33.285
  257    H    ILE  34           H        ILE  34  10.253  -7.668 -25.755
  258    HA   ILE  34           HA       ILE  34   9.448  -5.999 -23.519
  259    HB   ILE  34           HB       ILE  34  12.027  -7.446 -24.223
  260   HG12  ILE  34          HG21      ILE  34   9.664  -8.024 -22.382
  261   HG13  ILE  34          HG31      ILE  34  10.121  -8.921 -23.836
  262   HG21  ILE  34          1HG2      ILE  34  11.257  -6.107 -21.602
  263   HG22  ILE  34          HG22      ILE  34  12.744  -7.041 -21.932
  264   HG23  ILE  34          HG32      ILE  34  12.479  -5.500 -22.740
  265   HD11  ILE  34          3HD1      ILE  34  11.721  -8.775 -21.248
  266   HD12  ILE  34          1HD1      ILE  34  10.827 -10.170 -21.879
  267   HD13  ILE  34          2HD1      ILE  34  12.261  -9.573 -22.749
  268    H    VAL  35           H        VAL  35  10.119  -3.997 -22.949
  269    HA   VAL  35           HA       VAL  35  11.825  -2.531 -24.903
  270    HB   VAL  35           HB       VAL  35  10.338  -0.747 -23.194
  271   HG11  VAL  35          1HG1      VAL  35  10.134  -1.355 -26.168
  272   HG12  VAL  35          HG21      VAL  35   9.579   0.121 -25.356
  273   HG13  VAL  35          HG31      VAL  35  11.318  -0.253 -25.412
  274   HG21  VAL  35          HG32      VAL  35   8.588  -2.708 -24.731
  275   HG22  VAL  35          1HG2      VAL  35   8.618  -2.476 -22.966
  276   HG23  VAL  35          HG22      VAL  35   8.052  -1.173 -24.027
  277    H    GLU  36           H        GLU  36  11.408  -3.590 -21.612
  278    HA   GLU  36           HA       GLU  36  14.094  -2.709 -20.941
  279    HB2  GLU  36           HB2      GLU  36  12.777  -0.642 -20.498
  280    HB3  GLU  36           HB3      GLU  36  11.683  -1.562 -19.450
  281    HG2  GLU  36           HG2      GLU  36  13.498  -2.055 -17.901
  282    HG3  GLU  36           HG3      GLU  36  14.670  -1.294 -18.993
  283    H    VAL  37           H        VAL  37  14.910  -3.885 -19.142
  284    HA   VAL  37           HA       VAL  37  12.965  -5.503 -17.616
  285    HB   VAL  37           HB       VAL  37  15.205  -6.587 -19.289
  286   HG11  VAL  37          1HG1      VAL  37  14.394  -7.810 -16.620
  287   HG12  VAL  37          HG21      VAL  37  15.388  -8.585 -17.861
  288   HG13  VAL  37          HG31      VAL  37  16.003  -7.150 -17.030
  289   HG21  VAL  37          HG32      VAL  37  12.535  -7.640 -18.242
  290   HG22  VAL  37          1HG2      VAL  37  12.814  -6.951 -19.854
  291   HG23  VAL  37          HG22      VAL  37  13.579  -8.494 -19.389
  292    H    LEU  38           H        LEU  38  13.453  -5.869 -15.561
  293    HA   LEU  38           HA       LEU  38  15.960  -4.671 -14.391
  294    HB2  LEU  38           HB2      LEU  38  13.087  -4.461 -13.791
  295    HB3  LEU  38           HB3      LEU  38  14.095  -4.689 -12.378
  296    HG   LEU  38           HG       LEU  38  14.561  -2.478 -14.433
  297   HD11  LEU  38          1HD1      LEU  38  13.313  -2.412 -11.652
  298   HD12  LEU  38          2HD1      LEU  38  13.664  -0.995 -12.663
  299   HD13  LEU  38          3HD1      LEU  38  12.438  -2.183 -13.185
  300   HD21  LEU  38          3HD2      LEU  38  15.722  -2.954 -11.661
  301   HD22  LEU  38          1HD2      LEU  38  16.610  -3.104 -13.201
  302   HD23  LEU  38          2HD2      LEU  38  15.997  -1.520 -12.680
  303    H    LEU  39           H        LEU  39  16.835  -5.818 -12.657
  304    HA   LEU  39           HA       LEU  39  15.445  -8.161 -11.690
  305    HB2  LEU  39           HB2      LEU  39  16.681  -8.983 -13.684
  306    HB3  LEU  39           HB3      LEU  39  18.176  -8.285 -13.052
  307    HG   LEU  39           HG       LEU  39  17.877 -10.773 -12.908
  308   HD11  LEU  39          1HD1      LEU  39  18.441  -9.371 -10.278
  309   HD12  LEU  39          2HD1      LEU  39  19.013 -10.972 -10.783
  310   HD13  LEU  39          3HD1      LEU  39  19.571  -9.515 -11.657
  311   HD21  LEU  39          3HD2      LEU  39  16.152 -10.166 -10.497
  312   HD22  LEU  39          1HD2      LEU  39  15.555 -10.807 -12.054
  313   HD23  LEU  39          2HD2      LEU  39  16.704 -11.757 -11.086
  314    H    MET  40           H        MET  40  15.715  -8.028  -9.497
  315    HA   MET  40           HA       MET  40  17.646  -5.965  -8.634
  316    HB2  MET  40           HB2      MET  40  15.524  -7.269  -6.913
  317    HB3  MET  40           HB3      MET  40  16.344  -5.726  -6.673
  318    HG2  MET  40           HG2      MET  40  14.042  -6.447  -8.413
  319    HG3  MET  40           HG3      MET  40  14.300  -5.012  -7.439
  320    HE1  MET  40           HE3      MET  40  16.838  -3.086  -9.913
  321    HE2  MET  40           HE1      MET  40  15.913  -2.864  -8.399
  322    HE3  MET  40           HE2      MET  40  17.177  -4.108  -8.492
  323    H    LYS  41           H        LYS  41  19.366  -6.345  -7.188
  324    HA   LYS  41           HA       LYS  41  19.510  -9.118  -6.202
  325    HB2  LYS  41           HB2      LYS  41  22.099  -8.021  -7.093
  326    HB3  LYS  41           HB3      LYS  41  21.417  -9.672  -7.082
  327    HG2  LYS  41           HG2      LYS  41  20.222  -9.262  -9.133
  328    HG3  LYS  41           HG3      LYS  41  20.670  -7.528  -9.112
  329    HD2  LYS  41           2HD      LYS  41  23.066  -8.156  -9.221
  330    HD3  LYS  41           3HD      LYS  41  22.608  -9.869  -9.331
  331    HE2  LYS  41           HE2      LYS  41  21.411  -9.447 -11.418
  332    HE3  LYS  41           HE3      LYS  41  21.755  -7.708 -11.295
  333    HZ1  LYS  41           3HZ      LYS  41  23.290  -8.821 -12.763
  334    HZ2  LYS  41           1HZ      LYS  41  24.096  -8.235 -11.455
  335    HZ3  LYS  41           2HZ      LYS  41  23.775  -9.842 -11.570
  336    H    ASP  42           H        ASP  42  21.040  -9.544  -4.556
  337    HA   ASP  42           HA       ASP  42  21.213  -7.608  -2.473
  338    HB2  ASP  42           HB2      ASP  42  21.260 -10.201  -2.415
  339    HB3  ASP  42           HB3      ASP  42  22.967 -10.043  -2.845
  340    H    ARG  43           H        ARG  43  23.051  -6.493  -1.657
  341    HA   ARG  43           HA       ARG  43  24.863  -5.643  -3.830
  342    HB2  ARG  43           HB2      ARG  43  23.444  -4.037  -2.586
  343    HB3  ARG  43           HB3      ARG  43  24.323  -4.421  -1.097
  344    HG2  ARG  43           HG2      ARG  43  26.396  -3.561  -2.030
  345    HG3  ARG  43           HG3      ARG  43  25.640  -3.341  -3.625
  346    HD2  ARG  43           2HD      ARG  43  24.760  -1.954  -1.059
  347    HD3  ARG  43           3HD      ARG  43  25.817  -1.223  -2.283
  348    HE   ARG  43           HE       ARG  43  23.443  -2.154  -3.552
  349   HH11  ARG  43          1HH1      ARG  43  24.524   0.399  -1.350
  350   HH12  ARG  43          2HH1      ARG  43  23.280   1.516  -1.864
  351   HH21  ARG  43          1HH2      ARG  43  21.827  -0.693  -4.173
  352   HH22  ARG  43          2HH2      ARG  43  21.770   0.907  -3.467
  353    H    GLU  44           H        GLU  44  24.928  -7.836  -1.274
  354    HA   GLU  44           HA       GLU  44  27.893  -7.583  -0.989
  355    HB2  GLU  44           HB2      GLU  44  25.806  -8.641   0.944
  356    HB3  GLU  44           HB3      GLU  44  27.562  -8.708   1.200
  357    HG2  GLU  44           HG2      GLU  44  27.664  -6.226   1.048
  358    HG3  GLU  44           HG3      GLU  44  25.905  -6.168   0.856
  359    H    THR  45           H        THR  45  25.331  -9.585  -2.188
  360    HA   THR  45           HA       THR  45  27.311 -11.812  -2.421
  361    HB   THR  45           HB       THR  45  25.562 -13.431  -2.290
  362    HG1  THR  45           1HG      THR  45  23.400 -12.757  -2.020
  363   HG21  THR  45          1HG2      THR  45  24.991 -11.342  -0.166
  364   HG22  THR  45          HG22      THR  45  24.694 -13.095  -0.053
  365   HG23  THR  45          HG32      THR  45  26.372 -12.476  -0.136
  366    H    ASN  46           H        ASN  46  25.247  -9.556  -4.016
  367    HA   ASN  46           HA       ASN  46  24.842  -9.183  -6.223
  368    HB2  ASN  46           HB2      ASN  46  27.389 -10.799  -6.350
  369    HB3  ASN  46           HB3      ASN  46  26.669 -10.052  -7.788
  370   HD21  ASN  46          2HD2      ASN  46  29.097  -9.187  -7.427
  371   HD22  ASN  46          1HD2      ASN  46  29.157  -7.611  -6.654
  372    H    LYS  47           H        LYS  47  23.811 -11.752  -4.887
  373    HA   LYS  47           HA       LYS  47  23.336 -13.603  -7.098
  374    HB2  LYS  47           HB2      LYS  47  22.426 -13.320  -4.226
  375    HB3  LYS  47           HB3      LYS  47  21.666 -14.499  -5.298
  376    HG2  LYS  47           HG2      LYS  47  24.673 -14.362  -4.890
  377    HG3  LYS  47           HG3      LYS  47  23.588 -15.387  -3.917
  378    HD2  LYS  47           2HD      LYS  47  22.736 -16.412  -6.054
  379    HD3  LYS  47           3HD      LYS  47  24.016 -15.535  -6.926
  380    HE2  LYS  47           HE2      LYS  47  25.724 -16.666  -5.550
  381    HE3  LYS  47           HE3      LYS  47  24.447 -17.511  -4.653
  382    HZ1  LYS  47           3HZ      LYS  47  25.302 -18.911  -6.375
  383    HZ2  LYS  47           1HZ      LYS  47  23.751 -18.495  -6.752
  384    HZ3  LYS  47           2HZ      LYS  47  25.005 -17.785  -7.533
  385    H    SER  48           H        SER  48  20.555 -13.054  -5.340
  386    HA   SER  48           HA       SER  48  19.442 -10.963  -7.084
  387    HB2  SER  48           HB2      SER  48  19.019 -13.161  -8.281
  388    HB3  SER  48           HB3      SER  48  18.108 -13.683  -6.860
  389    HG   SER  48           HG       SER  48  16.808 -12.712  -8.515
  390    H    ARG  49           H        ARG  49  17.700  -9.902  -6.097
  391    HA   ARG  49           HA       ARG  49  17.287 -10.267  -3.234
  392    HB2  ARG  49           HB2      ARG  49  15.721  -8.710  -5.326
  393    HB3  ARG  49           HB3      ARG  49  15.518  -8.541  -3.573
  394    HG2  ARG  49           HG2      ARG  49  18.216  -8.119  -4.841
  395    HG3  ARG  49           HG3      ARG  49  17.012  -6.828  -4.931
  396    HD2  ARG  49           2HD      ARG  49  17.962  -8.103  -2.345
  397    HD3  ARG  49           3HD      ARG  49  18.599  -6.597  -3.066
  398    HE   ARG  49           HE       ARG  49  16.027  -6.957  -1.693
  399   HH11  ARG  49          1HH1      ARG  49  18.009  -4.964  -3.820
  400   HH12  ARG  49          2HH1      ARG  49  17.089  -3.509  -3.544
  401   HH21  ARG  49          1HH2      ARG  49  14.841  -5.036  -1.301
  402   HH22  ARG  49          2HH2      ARG  49  15.318  -3.540  -2.076
  403    H    GLY  50           H        GLY  50  16.236 -11.818  -6.031
  404    HA2  GLY  50           2HA      GLY  50  14.820 -13.679  -6.167
  405    HA3  GLY  50           3HA      GLY  50  14.141 -13.285  -4.575
  406    H    PHE  51           H        PHE  51  14.151 -10.411  -6.391
  407    HA   PHE  51           HA       PHE  51  11.634 -11.075  -7.792
  408    HB2  PHE  51           HB2      PHE  51  10.405  -9.286  -6.898
  409    HB3  PHE  51           HB3      PHE  51  11.037 -10.202  -5.537
  410    HD1  PHE  51           HD2      PHE  51  13.057  -9.260  -4.262
  411    HD2  PHE  51           HD1      PHE  51  10.853  -6.989  -7.175
  412    HE1  PHE  51           HE2      PHE  51  13.974  -7.145  -3.324
  413    HE2  PHE  51           HE1      PHE  51  11.735  -4.882  -6.188
  414    HZ   PHE  51           HZ       PHE  51  13.319  -4.968  -4.316
  415    H    ALA  52           H        ALA  52  11.040  -9.450  -9.415
  416    HA   ALA  52           HA       ALA  52  13.174  -7.627 -10.288
  417    HB1  ALA  52           1HB      ALA  52  12.348 -10.072 -11.919
  418    HB2  ALA  52           HB2      ALA  52  13.523  -8.832 -12.400
  419    HB3  ALA  52           HB3      ALA  52  13.886  -9.914 -11.033
  420    H    PHE  53           H        PHE  53  12.507  -6.962 -12.729
  421    HA   PHE  53           HA       PHE  53   9.576  -6.750 -12.961
  422    HB2  PHE  53           HB2      PHE  53  11.435  -4.332 -12.934
  423    HB3  PHE  53           HB3      PHE  53   9.734  -4.290 -13.314
  424    HD1  PHE  53           HD2      PHE  53  12.251  -4.946 -10.688
  425    HD2  PHE  53           HD1      PHE  53   8.102  -4.242 -11.540
  426    HE1  PHE  53           HE2      PHE  53  11.807  -4.676  -8.267
  427    HE2  PHE  53           HE1      PHE  53   7.649  -3.957  -9.116
  428    HZ   PHE  53           HZ       PHE  53   9.493  -4.203  -7.476
  429    H    VAL  54           H        VAL  54   8.902  -5.961 -15.105
  430    HA   VAL  54           HA       VAL  54  10.960  -5.762 -17.184
  431    HB   VAL  54           HB       VAL  54  10.663  -8.211 -17.053
  432   HG11  VAL  54          1HG1      VAL  54   8.664  -8.314 -15.924
  433   HG12  VAL  54          HG21      VAL  54   7.762  -7.784 -17.400
  434   HG13  VAL  54          HG31      VAL  54   8.691  -9.328 -17.393
  435   HG21  VAL  54          HG32      VAL  54   8.993  -7.190 -19.400
  436   HG22  VAL  54          1HG2      VAL  54  10.757  -7.040 -19.366
  437   HG23  VAL  54          HG22      VAL  54  10.003  -8.651 -19.348
  438    H    THR  55           H        THR  55  10.280  -4.495 -18.844
  439    HA   THR  55           HA       THR  55   7.411  -3.674 -18.787
  440    HB   THR  55           HB       THR  55   9.773  -2.136 -19.917
  441    HG1  THR  55           1HG      THR  55   9.443  -0.855 -18.079
  442   HG21  THR  55          1HG2      THR  55   7.688  -1.614 -21.057
  443   HG22  THR  55          HG22      THR  55   6.825  -1.471 -19.511
  444   HG23  THR  55          HG32      THR  55   8.086  -0.287 -19.949
  445    H    PHE  56           H        PHE  56   6.178  -4.273 -20.396
  446    HA   PHE  56           HA       PHE  56   7.383  -5.283 -22.912
  447    HB2  PHE  56           HB2      PHE  56   4.586  -5.378 -21.749
  448    HB3  PHE  56           HB3      PHE  56   5.029  -5.953 -23.356
  449    HD1  PHE  56           HD2      PHE  56   6.499  -6.508 -19.874
  450    HD2  PHE  56           HD1      PHE  56   5.010  -8.195 -23.553
  451    HE1  PHE  56           HE2      PHE  56   7.012  -8.770 -19.052
  452    HE2  PHE  56           HE1      PHE  56   5.428 -10.465 -22.674
  453    HZ   PHE  56           HZ       PHE  56   6.418 -10.761 -20.414
  454    H    GLU  57           H        GLU  57   6.365  -4.633 -24.971
  455    HA   GLU  57           HA       GLU  57   6.133  -1.783 -25.199
  456    HB2  GLU  57           HB2      GLU  57   6.042  -4.209 -26.986
  457    HB3  GLU  57           HB3      GLU  57   5.388  -2.692 -27.590
  458    HG2  GLU  57           HG2      GLU  57   7.594  -1.598 -26.801
  459    HG3  GLU  57           HG3      GLU  57   8.225  -3.250 -26.667
  460    H    SER  58           H        SER  58   3.744  -4.291 -24.602
  461    HA   SER  58           HA       SER  58   1.600  -2.223 -24.892
  462    HB2  SER  58           HB2      SER  58   1.409  -3.724 -26.788
  463    HB3  SER  58           HB3      SER  58   1.601  -5.146 -25.751
  464    HG   SER  58           HG       SER  58  -0.579  -4.661 -26.321
  465    HA   PRO  59           HA       PRO  59   0.565  -3.601 -20.831
  466    HB2  PRO  59           HB2      PRO  59  -1.899  -2.574 -20.543
  467    HB3  PRO  59           HB3      PRO  59  -0.492  -1.468 -20.818
  468    HG2  PRO  59           HG2      PRO  59  -2.372  -2.623 -22.903
  469    HG3  PRO  59           HG3      PRO  59  -2.081  -0.887 -22.590
  470    HD2  PRO  59           2HD      PRO  59  -0.660  -2.210 -24.493
  471    HD3  PRO  59           3HD      PRO  59   0.174  -1.052 -23.415
  472    H    ALA  60           H        ALA  60  -0.558  -4.840 -23.743
  473    HA   ALA  60           HA       ALA  60  -2.391  -6.738 -22.375
  474    HB1  ALA  60           1HB      ALA  60  -3.570  -5.236 -23.917
  475    HB2  ALA  60           HB2      ALA  60  -2.487  -5.733 -25.240
  476    HB3  ALA  60           HB3      ALA  60  -3.599  -6.914 -24.505
  477    H    ASP  61           H        ASP  61   0.565  -6.433 -24.201
  478    HA   ASP  61           HA       ASP  61   0.511  -9.293 -24.903
  479    HB2  ASP  61           HB2      ASP  61   2.511  -8.910 -26.060
  480    HB3  ASP  61           HB3      ASP  61   1.484  -7.467 -26.343
  481    H    ALA  62           H        ALA  62   1.505  -7.144 -22.456
  482    HA   ALA  62           HA       ALA  62   3.252  -8.913 -20.967
  483    HB1  ALA  62           1HB      ALA  62   1.567  -6.504 -20.115
  484    HB2  ALA  62           HB2      ALA  62   2.788  -7.306 -19.103
  485    HB3  ALA  62           HB3      ALA  62   3.280  -6.480 -20.597
  486    H    LYS  63           H        LYS  63  -0.236  -8.490 -21.239
  487    HA   LYS  63           HA       LYS  63  -0.959  -9.772 -18.764
  488    HB2  LYS  63           HB2      LYS  63  -2.464  -9.458 -21.388
  489    HB3  LYS  63           HB3      LYS  63  -3.195  -9.938 -19.835
  490    HG2  LYS  63           HG2      LYS  63  -2.429  -7.778 -18.834
  491    HG3  LYS  63           HG3      LYS  63  -1.709  -7.343 -20.391
  492    HD2  LYS  63           2HD      LYS  63  -3.801  -6.165 -20.199
  493    HD3  LYS  63           3HD      LYS  63  -4.016  -7.418 -21.422
  494    HE2  LYS  63           HE2      LYS  63  -5.076  -8.899 -19.737
  495    HE3  LYS  63           HE3      LYS  63  -4.848  -7.652 -18.502
  496    HZ1  LYS  63           3HZ      LYS  63  -7.061  -7.590 -19.427
  497    HZ2  LYS  63           1HZ      LYS  63  -6.262  -6.200 -19.781
  498    HZ3  LYS  63           2HZ      LYS  63  -6.473  -7.351 -20.939
  499    H    ASP  64           H        ASP  64  -0.150 -10.887 -22.021
  500    HA   ASP  64           HA       ASP  64  -1.299 -13.511 -21.699
  501    HB2  ASP  64           HB2      ASP  64  -0.756 -12.200 -23.831
  502    HB3  ASP  64           HB3      ASP  64   0.938 -12.582 -23.539
  503    H    ALA  65           H        ALA  65   1.704 -11.992 -20.819
  504    HA   ALA  65           HA       ALA  65   2.983 -14.547 -20.100
  505    HB1  ALA  65           1HB      ALA  65   3.803 -11.732 -19.290
  506    HB2  ALA  65           HB2      ALA  65   4.799 -13.215 -19.301
  507    HB3  ALA  65           HB3      ALA  65   4.275 -12.482 -20.827
  508    H    ALA  66           H        ALA  66   1.361 -11.777 -18.462
  509    HA   ALA  66           HA       ALA  66   1.948 -12.780 -15.857
  510    HB1  ALA  66           1HB      ALA  66   0.448 -10.940 -15.132
  511    HB2  ALA  66           HB2      ALA  66   1.516 -10.381 -16.443
  512    HB3  ALA  66           HB3      ALA  66  -0.169 -10.781 -16.795
  513    H    ARG  67           H        ARG  67  -0.485 -13.658 -18.172
  514    HA   ARG  67           HA       ARG  67  -2.045 -15.071 -16.084
  515    HB2  ARG  67           HB2      ARG  67  -2.534 -14.392 -18.994
  516    HB3  ARG  67           HB3      ARG  67  -3.438 -15.673 -18.180
  517    HG2  ARG  67           HG2      ARG  67  -4.815 -13.827 -17.848
  518    HG3  ARG  67           HG3      ARG  67  -3.935 -14.001 -16.318
  519    HD2  ARG  67           2HD      ARG  67  -2.366 -12.196 -17.075
  520    HD3  ARG  67           3HD      ARG  67  -3.370 -11.991 -18.525
  521    HE   ARG  67           HE       ARG  67  -3.954 -11.097 -15.806
  522   HH11  ARG  67          1HH1      ARG  67  -5.354 -11.932 -18.942
  523   HH12  ARG  67          2HH1      ARG  67  -6.809 -11.001 -18.673
  524   HH21  ARG  67          1HH2      ARG  67  -5.848  -9.872 -15.488
  525   HH22  ARG  67          2HH2      ARG  67  -7.089  -9.836 -16.716
  526    H    ASP  68           H        ASP  68   0.834 -15.824 -17.517
  527    HA   ASP  68           HA       ASP  68   0.015 -18.650 -18.042
  528    HB2  ASP  68           HB2      ASP  68   1.557 -16.570 -19.536
  529    HB3  ASP  68           HB3      ASP  68   2.352 -18.099 -19.384
  530    H    MET  69           H        MET  69   2.699 -16.419 -17.457
  531    HA   MET  69           HA       MET  69   4.445 -18.404 -16.302
  532    HB2  MET  69           HB2      MET  69   4.404 -15.535 -17.157
  533    HB3  MET  69           HB3      MET  69   5.491 -15.881 -15.870
  534    HG2  MET  69           HG2      MET  69   5.323 -17.208 -18.608
  535    HG3  MET  69           HG3      MET  69   6.593 -16.106 -18.060
  536    HE1  MET  69           HE3      MET  69   8.113 -16.595 -16.089
  537    HE2  MET  69           HE1      MET  69   6.911 -17.392 -15.039
  538    HE3  MET  69           HE2      MET  69   8.469 -18.197 -15.381
  539    H    ASN  70           H        ASN  70   1.892 -16.469 -15.025
  540    HA   ASN  70           HA       ASN  70   3.067 -16.018 -12.420
  541    HB2  ASN  70           HB2      ASN  70   1.226 -14.651 -13.375
  542    HB3  ASN  70           HB3      ASN  70   0.159 -16.054 -13.328
  543   HD21  ASN  70          2HD2      ASN  70  -1.221 -14.630 -11.985
  544   HD22  ASN  70          1HD2      ASN  70  -0.883 -14.511 -10.272
  545    H    GLY  71           H        GLY  71   3.242 -17.386 -10.744
  546    HA2  GLY  71           2HA      GLY  71   2.676 -19.101  -9.292
  547    HA3  GLY  71           3HA      GLY  71   1.416 -19.644 -10.417
  548    H    LYS  72           H        LYS  72   3.883 -19.412 -12.541
  549    HA   LYS  72           HA       LYS  72   4.706 -22.198 -12.338
  550    HB2  LYS  72           HB2      LYS  72   5.617 -19.997 -14.186
  551    HB3  LYS  72           HB3      LYS  72   5.667 -21.737 -14.459
  552    HG2  LYS  72           HG2      LYS  72   3.134 -20.062 -14.339
  553    HG3  LYS  72           HG3      LYS  72   3.842 -20.824 -15.780
  554    HD2  LYS  72           2HD      LYS  72   3.548 -23.057 -14.754
  555    HD3  LYS  72           3HD      LYS  72   2.715 -22.302 -13.374
  556    HE2  LYS  72           HE2      LYS  72   1.873 -22.014 -16.287
  557    HE3  LYS  72           HE3      LYS  72   1.180 -23.180 -15.152
  558    HZ1  LYS  72           3HZ      LYS  72   0.506 -21.318 -13.769
  559    HZ2  LYS  72           1HZ      LYS  72   1.113 -20.254 -14.875
  560    HZ3  LYS  72           2HZ      LYS  72  -0.156 -21.212 -15.272
  561    H    SER  73           H        SER  73   7.250 -21.823 -13.439
  562    HA   SER  73           HA       SER  73   8.840 -20.623 -11.204
  563    HB2  SER  73           HB2      SER  73   8.366 -23.022 -10.865
  564    HB3  SER  73           HB3      SER  73   9.098 -23.396 -12.437
  565    HG   SER  73           HG       SER  73  10.588 -23.645 -10.716
  566    H    LEU  74           H        LEU  74  10.972 -20.139 -11.678
  567    HA   LEU  74           HA       LEU  74  11.158 -19.363 -14.546
  568    HB2  LEU  74           HB2      LEU  74  11.476 -17.746 -12.422
  569    HB3  LEU  74           HB3      LEU  74  13.078 -18.413 -12.422
  570    HG   LEU  74           HG       LEU  74  12.988 -16.314 -13.658
  571   HD11  LEU  74          1HD1      LEU  74  13.383 -18.535 -15.688
  572   HD12  LEU  74          2HD1      LEU  74  14.056 -16.891 -15.716
  573   HD13  LEU  74          3HD1      LEU  74  14.588 -18.037 -14.469
  574   HD21  LEU  74          3HD2      LEU  74  11.602 -15.980 -15.591
  575   HD22  LEU  74          1HD2      LEU  74  11.163 -17.698 -15.655
  576   HD23  LEU  74          2HD2      LEU  74  10.552 -16.673 -14.334
  577    H    ASP  75           H        ASP  75  13.407 -20.439 -12.024
  578    HA   ASP  75           HA       ASP  75  14.849 -22.060 -14.070
  579    HB2  ASP  75           HB2      ASP  75  15.846 -19.702 -13.318
  580    HB3  ASP  75           HB3      ASP  75  16.139 -20.516 -11.815
  581    H    GLY  76           H        GLY  76  13.029 -22.104 -11.398
  582    HA2  GLY  76           2HA      GLY  76  13.231 -24.667 -10.692
  583    HA3  GLY  76           3HA      GLY  76  14.658 -24.001  -9.855
  584    H    LYS  77           H        LYS  77  12.923 -21.376  -9.733
  585    HA   LYS  77           HA       LYS  77  11.510 -22.125  -7.217
  586    HB2  LYS  77           HB2      LYS  77  12.817 -19.478  -7.953
  587    HB3  LYS  77           HB3      LYS  77  12.055 -19.883  -6.412
  588    HG2  LYS  77           HG2      LYS  77  14.544 -21.157  -7.619
  589    HG3  LYS  77           HG3      LYS  77  14.516 -20.032  -6.258
  590    HD2  LYS  77           2HD      LYS  77  13.460 -21.648  -4.818
  591    HD3  LYS  77           3HD      LYS  77  13.079 -22.719  -6.176
  592    HE2  LYS  77           HE2      LYS  77  14.965 -23.640  -5.015
  593    HE3  LYS  77           HE3      LYS  77  15.478 -23.069  -6.605
  594    HZ1  LYS  77           3HZ      LYS  77  16.344 -21.090  -5.537
  595    HZ2  LYS  77           1HZ      LYS  77  15.829 -21.606  -4.063
  596    HZ3  LYS  77           2HZ      LYS  77  17.006 -22.435  -4.851
  597    H    ALA  78           H        ALA  78   9.452 -21.553  -6.968
  598    HA   ALA  78           HA       ALA  78   8.084 -20.792  -9.397
  599    HB1  ALA  78           1HB      ALA  78   7.191 -22.510  -7.917
  600    HB2  ALA  78           HB2      ALA  78   7.031 -21.321  -6.598
  601    HB3  ALA  78           HB3      ALA  78   6.044 -21.160  -8.080
  602    H    ILE  79           H        ILE  79   7.087 -18.925  -9.930
  603    HA   ILE  79           HA       ILE  79   7.727 -16.608  -8.179
  604    HB   ILE  79           HB       ILE  79   7.999 -15.305 -10.165
  605   HG12  ILE  79          HG21      ILE  79   7.257 -17.776 -11.786
  606   HG13  ILE  79          HG31      ILE  79   6.185 -16.392 -11.505
  607   HG21  ILE  79          1HG2      ILE  79   9.945 -16.381 -11.161
  608   HG22  ILE  79          HG22      ILE  79   9.911 -16.720  -9.415
  609   HG23  ILE  79          HG32      ILE  79   9.417 -17.971 -10.580
  610   HD11  ILE  79          3HD1      ILE  79   7.173 -16.013 -13.627
  611   HD12  ILE  79          1HD1      ILE  79   7.977 -14.907 -12.499
  612   HD13  ILE  79          2HD1      ILE  79   8.804 -16.394 -13.024
  613    H    LYS  80           H        LYS  80   6.501 -14.642  -8.730
  614    HA   LYS  80           HA       LYS  80   3.626 -15.124  -9.333
  615    HB2  LYS  80           HB2      LYS  80   4.227 -14.290  -6.977
  616    HB3  LYS  80           HB3      LYS  80   4.869 -12.834  -7.752
  617    HG2  LYS  80           HG2      LYS  80   2.604 -12.516  -8.866
  618    HG3  LYS  80           HG3      LYS  80   1.998 -13.845  -7.856
  619    HD2  LYS  80           2HD      LYS  80   2.713 -12.529  -5.827
  620    HD3  LYS  80           3HD      LYS  80   3.174 -11.194  -6.923
  621    HE2  LYS  80           HE2      LYS  80   0.883 -11.051  -7.756
  622    HE3  LYS  80           HE3      LYS  80   0.393 -12.401  -6.713
  623    HZ1  LYS  80           3HZ      LYS  80   0.967 -11.071  -4.809
  624    HZ2  LYS  80           1HZ      LYS  80   1.435  -9.815  -5.760
  625    HZ3  LYS  80           2HZ      LYS  80  -0.142 -10.283  -5.732
  626    H    VAL  81           H        VAL  81   2.761 -13.807 -10.967
  627    HA   VAL  81           HA       VAL  81   4.513 -11.640 -12.010
  628    HB   VAL  81           HB       VAL  81   3.048 -13.649 -13.768
  629   HG11  VAL  81          1HG1      VAL  81   4.897 -11.317 -14.423
  630   HG12  VAL  81          HG21      VAL  81   4.180 -12.456 -15.594
  631   HG13  VAL  81          HG31      VAL  81   3.138 -11.341 -14.680
  632   HG21  VAL  81          HG32      VAL  81   6.017 -13.216 -13.229
  633   HG22  VAL  81          1HG2      VAL  81   5.066 -14.650 -12.777
  634   HG23  VAL  81          HG22      VAL  81   5.346 -14.278 -14.486
  635    H    GLU  82           H        GLU  82   3.494  -9.775 -12.158
  636    HA   GLU  82           HA       GLU  82   0.612  -9.581 -12.635
  637    HB2  GLU  82           HB2      GLU  82   0.839 -10.190 -10.189
  638    HB3  GLU  82           HB3      GLU  82   1.825  -8.745  -9.955
  639    HG2  GLU  82           HG2      GLU  82  -0.525  -8.408  -9.263
  640    HG3  GLU  82           HG3      GLU  82  -0.043  -7.296 -10.545
  641    H    GLN  83           H        GLN  83  -0.007  -7.155 -12.758
  642    HA   GLN  83           HA       GLN  83   2.088  -5.582 -13.915
  643    HB2  GLN  83           HB2      GLN  83  -0.142  -5.023 -14.520
  644    HB3  GLN  83           HB3      GLN  83  -0.677  -5.023 -12.829
  645    HG2  GLN  83           HG2      GLN  83  -0.643  -2.771 -13.587
  646    HG3  GLN  83           HG3      GLN  83   0.625  -2.992 -12.377
  647   HE21  GLN  83          HE22      GLN  83   2.156  -1.575 -12.824
  648   HE22  GLN  83          HE12      GLN  83   2.872  -1.285 -14.386
  649    H    ALA  84           H        ALA  84   3.495  -4.124 -13.002
  650    HA   ALA  84           HA       ALA  84   4.091  -4.624 -10.215
  651    HB1  ALA  84           1HB      ALA  84   5.377  -2.761 -12.235
  652    HB2  ALA  84           HB2      ALA  84   6.075  -3.243 -10.673
  653    HB3  ALA  84           HB3      ALA  84   5.829  -4.457 -11.954
  654    H    THR  85           H        THR  85   4.475  -3.016  -8.596
  655    HA   THR  85           HA       THR  85   2.906  -0.504  -8.958
  656    HB   THR  85           HB       THR  85   2.612  -0.464  -6.554
  657    HG1  THR  85           1HG      THR  85   3.820  -3.032  -6.630
  658   HG21  THR  85          1HG2      THR  85   0.947  -2.287  -6.359
  659   HG22  THR  85          HG22      THR  85   0.865  -1.562  -7.978
  660   HG23  THR  85          HG32      THR  85   1.683  -3.124  -7.745
  661    H    LYS  86           H        LYS  86   3.718   1.297  -7.608
  662    HA   LYS  86           HA       LYS  86   6.442   1.811  -8.225
  663    HB2  LYS  86           HB2      LYS  86   4.410   3.176  -6.414
  664    HB3  LYS  86           HB3      LYS  86   6.015   3.837  -6.763
  665    HG2  LYS  86           HG2      LYS  86   5.519   3.753  -9.202
  666    HG3  LYS  86           HG3      LYS  86   3.903   3.103  -8.845
  667    HD2  LYS  86           2HD      LYS  86   3.373   5.184  -7.572
  668    HD3  LYS  86           3HD      LYS  86   4.956   5.844  -8.047
  669    HE2  LYS  86           HE2      LYS  86   4.383   5.595 -10.420
  670    HE3  LYS  86           HE3      LYS  86   2.836   4.850 -10.001
  671    HZ1  LYS  86           3HZ      LYS  86   2.141   6.886  -9.001
  672    HZ2  LYS  86           1HZ      LYS  86   3.595   7.597  -9.263
  673    HZ3  LYS  86           2HZ      LYS  86   2.633   7.203 -10.536
  674    HA   PRO  87           HA       PRO  87   8.616   0.056  -4.867
  675    HB2  PRO  87           HB2      PRO  87  10.778   1.718  -4.612
  676    HB3  PRO  87           HB3      PRO  87  10.541   0.645  -6.026
  677    HG2  PRO  87           HG2      PRO  87   9.813   3.575  -5.791
  678    HG3  PRO  87           HG3      PRO  87  10.735   2.764  -7.104
  679    HD2  PRO  87           2HD      PRO  87   8.072   3.251  -7.343
  680    HD3  PRO  87           3HD      PRO  87   8.776   1.715  -7.944
  681    H    SER  88           H        SER  88   9.336   0.476  -2.612
  682    HA   SER  88           HA       SER  88   7.281   2.033  -1.309
  683    HB2  SER  88           HB2      SER  88   8.038   0.915   0.701
  684    HB3  SER  88           HB3      SER  88   8.053  -0.275  -0.624
  685    HG   SER  88           HG       SER  88   9.976  -0.340   0.588
  686    H    PHE  89           H        PHE  89  10.429   2.809  -2.357
  687    HA   PHE  89           HA       PHE  89  10.710   4.890  -0.271
  688    HB2  PHE  89           HB2      PHE  89  12.929   5.261  -1.126
  689    HB3  PHE  89           HB3      PHE  89  12.683   3.595  -0.596
  690    HD1  PHE  89           HD2      PHE  89  12.426   1.765  -2.325
  691    HD2  PHE  89           HD1      PHE  89  13.566   5.782  -3.363
  692    HE1  PHE  89           HE2      PHE  89  13.390   0.943  -4.437
  693    HE2  PHE  89           HE1      PHE  89  14.523   4.948  -5.507
  694    HZ   PHE  89           HZ       PHE  89  14.438   2.535  -6.040
  695    H    GLU  90           H        GLU  90   8.680   4.837  -2.530
  696    HA   GLU  90           HA       GLU  90   9.246   7.562  -3.502
  697    HB2  GLU  90           HB2      GLU  90  10.107   5.691  -5.094
  698    HB3  GLU  90           HB3      GLU  90   8.388   5.351  -5.394
  699    HG2  GLU  90           HG2      GLU  90   8.109   7.738  -6.110
  700    HG3  GLU  90           HG3      GLU  90   9.832   8.012  -5.756
  701    H    SER  91           H        SER  91   7.355   8.602  -4.455
  702    HA   SER  91           HA       SER  91   4.737   7.384  -3.919
  703    HB2  SER  91           HB2      SER  91   5.658   8.368  -1.739
  704    HB3  SER  91           HB3      SER  91   5.527   9.961  -2.531
  705    HG   SER  91           HG       SER  91   3.636   9.422  -1.349
  706    H    GLY  92           H        GLY  92   2.988   8.665  -4.801
  707    HA2  GLY  92           2HA      GLY  92   2.023  10.043  -6.373
  708    HA3  GLY  92           3HA      GLY  92   3.210  11.245  -5.855
  709    H    ARG  93           H        ARG  93   3.966  12.129  -7.662
  710    HA   ARG  93           HA       ARG  93   5.454  10.472  -9.578
  711    HB2  ARG  93           HB2      ARG  93   4.309  11.477 -11.529
  712    HB3  ARG  93           HB3      ARG  93   3.227  10.462 -10.566
  713    HG2  ARG  93           HG2      ARG  93   2.265  12.471  -9.491
  714    HG3  ARG  93           HG3      ARG  93   3.377  13.505 -10.413
  715    HD2  ARG  93           2HD      ARG  93   2.393  12.685 -12.524
  716    HD3  ARG  93           3HD      ARG  93   1.287  11.641 -11.606
  717    HE   ARG  93           HE       ARG  93   0.966  14.285 -10.651
  718   HH11  ARG  93          1HH1      ARG  93   0.423  12.456 -13.625
  719   HH12  ARG  93          2HH1      ARG  93  -0.913  13.459 -14.144
  720   HH21  ARG  93          1HH2      ARG  93  -0.768  15.579 -11.340
  721   HH22  ARG  93          2HH2      ARG  93  -1.592  15.228 -12.843
  722    H    ARG  94           H        ARG  94   6.683  11.826 -11.091
  723    HA   ARG  94           HA       ARG  94   8.397  13.215 -11.336
  724    HB2  ARG  94           HB2      ARG  94   7.826  15.539 -11.732
  725    HB3  ARG  94           HB3      ARG  94   6.674  14.409 -12.432
  726    HG2  ARG  94           HG2      ARG  94   5.422  16.228 -11.592
  727    HG3  ARG  94           HG3      ARG  94   5.102  14.869 -10.529
  728    HD2  ARG  94           2HD      ARG  94   5.376  16.844  -9.187
  729    HD3  ARG  94           3HD      ARG  94   6.786  15.823  -8.903
  730    HE   ARG  94           HE       ARG  94   7.039  17.879 -11.014
  731   HH11  ARG  94          1HH1      ARG  94   7.741  16.977  -7.655
  732   HH12  ARG  94          2HH1      ARG  94   8.890  18.273  -7.440
  733   HH21  ARG  94          1HH2      ARG  94   8.570  19.516 -10.702
  734   HH22  ARG  94          2HH2      ARG  94   9.393  19.669  -9.168
  735    H    GLY  95           H        GLY  95   7.893  12.416  -8.440
  736    HA2  GLY  95           2HA      GLY  95   9.362  12.664  -6.630
  737    HA3  GLY  95           3HA      GLY  95   9.944  14.200  -7.300
  738    H5'    A  96           H5'        A  96  -0.095  -3.864   4.736
  739   H5''    A  96          H5''        A  96   0.437  -5.403   5.455
  740    H4'    A  96           H4'        A  96   1.272  -2.651   6.491
  741    H3'    A  96           H3'        A  96   2.126  -3.392   4.093
  742    H2'    A  96           H2'        A  96   2.383  -5.756   4.667
  743   HO2'    A  96          HO2'        A  96   4.300  -4.929   3.639
  744    H1'    A  96           H1'        A  96   4.045  -5.084   7.039
  745    H8     A  96           H8         A  96   0.623  -6.700   7.291
  746    H61    A  96           H61        A  96   3.801 -12.071   7.553
  747    H62    A  96           H62        A  96   2.207 -11.355   7.725
  748    H2     A  96           H2         A  96   6.611  -8.741   6.580
  749   HO5'    A  96          H5T         A  96  -1.582  -4.645   6.292
  750    H5'    U  97           H5'        U  97   5.970  -2.382   6.965
  751   H5''    U  97          H5''        U  97   7.310  -1.848   5.962
  752    H4'    U  97           H4'        U  97   8.437  -3.896   6.099
  753    H3'    U  97           H3'        U  97   5.932  -5.225   6.181
  754    H2'    U  97           H2'        U  97   5.447  -5.513   8.380
  755   HO2'    U  97          HO2'        U  97   8.028  -6.675   8.352
  756    H1'    U  97           H1'        U  97   7.683  -4.639   9.803
  757    H3     U  97           H3         U  97   5.481  -1.448  12.093
  758    H5     U  97           H5         U  97   3.003  -2.163   8.776
  759    H6     U  97           H6         U  97   4.734  -3.574   7.853
  760    H5'    C  98           H5'        C  98   7.079  -5.929   2.243
  761   H5''    C  98          H5''        C  98   5.581  -6.855   2.383
  762    H4'    C  98           H4'        C  98   8.383  -8.050   2.338
  763    H3'    C  98           H3'        C  98   7.222  -6.993   0.143
  764    H2'    C  98           H2'        C  98   5.029  -7.807   0.639
  765   HO2'    C  98          HO2'        C  98   5.638  -8.404  -1.536
  766    H1'    C  98           H1'        C  98   6.054 -10.604   1.047
  767    H41    C  98           H41        C  98   0.079 -10.871   3.251
  768    H42    C  98           H42        C  98   0.395  -9.576   4.392
  769    H5     C  98           H5         C  98   2.526  -8.391   4.491
  770    H6     C  98           H6         C  98   4.760  -8.252   3.517
  771    H5'    A  99           H5'        A  99   9.715  -5.665  -0.853
  772   H5''    A  99          H5''        A  99   8.116  -6.143  -1.461
  773    H4'    A  99           H4'        A  99  10.530  -5.790  -3.276
  774    H3'    A  99           H3'        A  99   9.340  -3.688  -1.812
  775    H2'    A  99           H2'        A  99   7.265  -3.825  -3.002
  776   HO2'    A  99          HO2'        A  99   8.694  -1.819  -3.692
  777    H1'    A  99           H1'        A  99   8.960  -4.482  -5.415
  778    H8     A  99           H8         A  99   7.187  -3.563  -7.018
  779    H61    A  99           H61        A  99   1.853  -6.727  -6.612
  780    H62    A  99           H62        A  99   2.766  -5.581  -7.578
  781    H2     A  99           H2         A  99   4.397  -7.842  -3.158
  782    H5'    A 100           H5'        A 100  13.290  -3.341  -3.532
  783   H5''    A 100          H5''        A 100  14.160  -1.823  -3.342
  784    H4'    A 100           H4'        A 100  14.859  -3.272  -5.349
  785    H3'    A 100           H3'        A 100  14.852  -0.572  -4.945
  786    H2'    A 100           H2'        A 100  12.734  -0.194  -5.951
  787   HO2'    A 100          HO2'        A 100  13.164   0.655  -8.086
  788    H1'    A 100           H1'        A 100  13.552  -2.089  -8.165
  789    H8     A 100           H8         A 100  10.458  -1.952  -5.853
  790    H61    A 100           H61        A 100   7.372  -0.219 -10.983
  791    H62    A 100           H62        A 100   7.189  -0.673  -9.296
  792    H2     A 100           H2         A 100  11.672  -0.438 -11.956
  793    H5'    A 101           H5'        A 101  16.424   1.137  -7.021
  794   H5''    A 101          H5''        A 101  17.999   0.598  -7.624
  795    H4'    A 101           H4'        A 101  17.988   3.003  -7.274
  796    H3'    A 101           H3'        A 101  20.016   1.348  -6.499
  797   HO3'    A 101          H3T         A 101  20.306   3.492  -7.293
  798    H2'    A 101           H2'        A 101  19.314   0.964  -4.302
  799   HO2'    A 101          HO2'        A 101  20.866   3.336  -4.201
  800    H1'    A 101           H1'        A 101  18.577   3.841  -3.858
  801    H8     A 101           H8         A 101  17.857   0.110  -3.269
  802    H61    A 101           H61        A 101  14.467   2.036   1.562
  803    H62    A 101           H62        A 101  15.100   0.629   0.725
  804    H2     A 101           H2         A 101  15.764   5.609  -0.726
  Start of MODEL   19
    1    H1   MET   1           H1       MET   1  -6.423   4.062  -0.752
    2    H2   MET   1           H2       MET   1  -6.464   2.419  -0.716
    3    H3   MET   1           H3       MET   1  -7.013   3.223  -2.041
    4    HA   MET   1           HA       MET   1  -4.810   4.034  -2.540
    5    HB2  MET   1           HB2      MET   1  -3.963   4.108  -0.223
    6    HB3  MET   1           HB3      MET   1  -4.018   2.334  -0.147
    7    HG2  MET   1           HG2      MET   1  -2.475   2.246  -2.114
    8    HG3  MET   1           HG3      MET   1  -2.370   4.009  -2.091
    9    HE1  MET   1           HE1      MET   1   1.129   2.535  -1.026
   10    HE2  MET   1           HE2      MET   1  -0.076   1.783  -2.102
   11    HE3  MET   1           HE3      MET   1   0.249   3.522  -2.219
   12    H    VAL   2           H        VAL   2  -4.897   3.098  -4.450
   13    HA   VAL   2           HA       VAL   2  -3.684   0.440  -4.566
   14    HB   VAL   2           HB       VAL   2  -6.015  -0.125  -4.757
   15   HG11  VAL   2          1HG1      VAL   2  -6.226   1.882  -7.042
   16   HG12  VAL   2          HG21      VAL   2  -7.493   0.778  -6.476
   17   HG13  VAL   2          HG31      VAL   2  -6.937   2.094  -5.425
   18   HG21  VAL   2          HG32      VAL   2  -4.682   0.000  -7.482
   19   HG22  VAL   2          1HG2      VAL   2  -4.330  -1.194  -6.215
   20   HG23  VAL   2          HG22      VAL   2  -5.947  -1.152  -6.975
   21    H    GLU   3           H        GLU   3  -1.940   0.677  -5.781
   22    HA   GLU   3           HA       GLU   3  -1.986   2.566  -8.075
   23    HB2  GLU   3           HB2      GLU   3   0.196   3.439  -7.396
   24    HB3  GLU   3           HB3      GLU   3  -1.061   3.785  -6.193
   25    HG2  GLU   3           HG2      GLU   3  -0.253   1.798  -4.867
   26    HG3  GLU   3           HG3      GLU   3   1.081   1.631  -6.024
   27    H    ALA   4           H        ALA   4  -1.185   1.829  -9.845
   28    HA   ALA   4           HA       ALA   4   0.926  -0.228  -9.809
   29    HB1  ALA   4           1HB      ALA   4  -1.639  -0.491 -11.437
   30    HB2  ALA   4           HB2      ALA   4  -0.244  -1.601 -11.457
   31    HB3  ALA   4           HB3      ALA   4  -1.231  -1.450  -9.994
   32    H    ASP   5           H        ASP   5   2.500   0.663 -10.896
   33    HA   ASP   5           HA       ASP   5   1.982   3.014 -12.566
   34    HB2  ASP   5           HB2      ASP   5   3.657   3.206 -10.883
   35    HB3  ASP   5           HB3      ASP   5   4.470   1.730 -11.418
   36    H    ARG   6           H        ARG   6   2.186   3.210 -14.638
   37    HA   ARG   6           HA       ARG   6   2.228   2.766 -16.833
   38    HB2  ARG   6           HB2      ARG   6   4.919   1.703 -15.954
   39    HB3  ARG   6           HB3      ARG   6   4.450   1.960 -17.650
   40    HG2  ARG   6           HG2      ARG   6   4.006   4.345 -17.189
   41    HG3  ARG   6           HG3      ARG   6   4.441   4.104 -15.483
   42    HD2  ARG   6           2HD      ARG   6   6.332   5.059 -16.684
   43    HD3  ARG   6           3HD      ARG   6   6.720   3.406 -16.177
   44    HE   ARG   6           HE       ARG   6   5.627   3.337 -18.813
   45   HH11  ARG   6          1HH1      ARG   6   8.518   4.455 -17.119
   46   HH12  ARG   6          2HH1      ARG   6   9.560   4.234 -18.503
   47   HH21  ARG   6          1HH2      ARG   6   7.004   3.069 -20.609
   48   HH22  ARG   6          2HH2      ARG   6   8.702   3.460 -20.476
   49    HA   PRO   7           HA       PRO   7   0.581  -1.397 -17.513
   50    HB2  PRO   7           HB2      PRO   7   0.361  -0.015 -20.184
   51    HB3  PRO   7           HB3      PRO   7  -0.841  -1.104 -19.399
   52    HG2  PRO   7           HG2      PRO   7  -1.208   1.541 -19.418
   53    HG3  PRO   7           HG3      PRO   7  -1.472   0.633 -17.885
   54    HD2  PRO   7           2HD      PRO   7   0.948   2.268 -18.706
   55    HD3  PRO   7           3HD      PRO   7   0.119   2.208 -17.117
   56    H    GLY   8           H        GLY   8   1.546  -3.195 -18.607
   57    HA2  GLY   8           2HA      GLY   8   2.988  -4.226 -20.146
   58    HA3  GLY   8           3HA      GLY   8   3.722  -2.648 -20.519
   59    H    LYS   9           H        LYS   9   3.822  -2.091 -17.468
   60    HA   LYS   9           HA       LYS   9   6.384  -3.437 -17.039
   61    HB2  LYS   9           HB2      LYS   9   6.124  -1.048 -16.445
   62    HB3  LYS   9           HB3      LYS   9   4.892  -1.503 -15.242
   63    HG2  LYS   9           HG2      LYS   9   6.570  -3.026 -14.156
   64    HG3  LYS   9           HG3      LYS   9   7.795  -2.454 -15.299
   65    HD2  LYS   9           2HD      LYS   9   6.260  -0.696 -13.338
   66    HD3  LYS   9           3HD      LYS   9   7.875  -1.375 -13.054
   67    HE2  LYS   9           HE2      LYS   9   8.746  -0.185 -15.028
   68    HE3  LYS   9           HE3      LYS   9   7.135   0.473 -15.363
   69    HZ1  LYS   9           3HZ      LYS   9   7.216   1.672 -13.330
   70    HZ2  LYS   9           1HZ      LYS   9   8.648   0.991 -12.892
   71    HZ3  LYS   9           2HZ      LYS   9   8.572   2.017 -14.179
   72    H    LEU  10           H        LEU  10   6.661  -5.212 -15.855
   73    HA   LEU  10           HA       LEU  10   4.341  -6.242 -14.267
   74    HB2  LEU  10           HB2      LEU  10   6.469  -7.656 -15.890
   75    HB3  LEU  10           HB3      LEU  10   5.378  -8.517 -14.862
   76    HG   LEU  10           HG       LEU  10   4.595  -6.861 -17.299
   77   HD11  LEU  10          1HD1      LEU  10   4.342  -9.848 -16.708
   78   HD12  LEU  10          2HD1      LEU  10   4.133  -9.043 -18.279
   79   HD13  LEU  10          3HD1      LEU  10   5.748  -9.152 -17.526
   80   HD21  LEU  10          3HD2      LEU  10   2.333  -7.900 -16.933
   81   HD22  LEU  10          1HD2      LEU  10   2.882  -8.432 -15.333
   82   HD23  LEU  10          2HD2      LEU  10   2.777  -6.688 -15.713
   83    H    PHE  11           H        PHE  11   4.824  -7.386 -12.391
   84    HA   PHE  11           HA       PHE  11   7.542  -6.967 -11.231
   85    HB2  PHE  11           HB2      PHE  11   5.872  -5.903  -9.877
   86    HB3  PHE  11           HB3      PHE  11   4.776  -7.286 -10.014
   87    HD1  PHE  11           HD1      PHE  11   8.120  -6.284  -8.679
   88    HD2  PHE  11           HD2      PHE  11   4.827  -9.040  -8.444
   89    HE1  PHE  11           HE1      PHE  11   9.079  -7.256  -6.608
   90    HE2  PHE  11           HE2      PHE  11   5.816 -10.041  -6.397
   91    HZ   PHE  11           HZ       PHE  11   7.946  -9.136  -5.485
   92    H    ILE  12           H        ILE  12   8.733  -8.745 -10.825
   93    HA   ILE  12           HA       ILE  12   7.428 -11.391 -11.267
   94    HB   ILE  12           HB       ILE  12  10.305 -10.785 -11.948
   95   HG12  ILE  12          HG21      ILE  12   9.158  -9.155 -13.305
   96   HG13  ILE  12          HG31      ILE  12   9.778 -10.483 -14.284
   97   HG21  ILE  12          1HG2      ILE  12   8.252 -12.826 -12.880
   98   HG22  ILE  12          HG22      ILE  12   9.936 -12.718 -13.452
   99   HG23  ILE  12          HG32      ILE  12   9.594 -13.109 -11.748
  100   HD11  ILE  12          3HD1      ILE  12   7.450 -11.460 -14.319
  101   HD12  ILE  12          1HD1      ILE  12   6.884  -9.980 -13.514
  102   HD13  ILE  12          2HD1      ILE  12   7.632  -9.888 -15.123
  103    H    GLY  13           H        GLY  13   7.147 -11.710  -8.976
  104    HA2  GLY  13           2HA      GLY  13   9.623 -11.590  -7.327
  105    HA3  GLY  13           3HA      GLY  13   7.976 -11.639  -6.720
  106    H    GLY  14           H        GLY  14  10.476 -13.384  -6.266
  107    HA2  GLY  14           2HA      GLY  14  10.196 -15.462  -5.140
  108    HA3  GLY  14           3HA      GLY  14   8.908 -15.913  -6.273
  109    H    LEU  15           H        LEU  15  11.512 -14.395  -7.853
  110    HA   LEU  15           HA       LEU  15  12.095 -16.704  -9.437
  111    HB2  LEU  15           HB2      LEU  15  13.648 -14.117  -9.030
  112    HB3  LEU  15           HB3      LEU  15  13.910 -15.306 -10.331
  113    HG   LEU  15           HG       LEU  15  11.155 -14.164 -10.114
  114   HD11  LEU  15          1HD1      LEU  15  13.599 -12.690 -11.201
  115   HD12  LEU  15          2HD1      LEU  15  11.909 -12.222 -11.492
  116   HD13  LEU  15          3HD1      LEU  15  12.577 -12.171  -9.843
  117   HD21  LEU  15          3HD2      LEU  15  11.221 -14.499 -12.489
  118   HD22  LEU  15          1HD2      LEU  15  12.995 -14.567 -12.504
  119   HD23  LEU  15          2HD2      LEU  15  12.075 -15.913 -11.819
  120    H    ASN  16           H        ASN  16  14.130 -17.656  -9.830
  121    HA   ASN  16           HA       ASN  16  15.459 -18.729  -7.545
  122    HB2  ASN  16           HB2      ASN  16  15.296 -20.183  -9.233
  123    HB3  ASN  16           HB3      ASN  16  15.379 -18.933 -10.489
  124   HD21  ASN  16          2HD2      ASN  16  17.105 -21.265  -8.558
  125   HD22  ASN  16          1HD2      ASN  16  18.605 -21.083  -9.453
  126    H    THR  17           H        THR  17  17.595 -18.323  -6.829
  127    HA   THR  17           HA       THR  17  18.377 -15.564  -6.927
  128    HB   THR  17           HB       THR  17  20.244 -16.329  -5.493
  129    HG1  THR  17           1HG      THR  17  20.384 -18.547  -5.054
  130   HG21  THR  17          1HG2      THR  17  17.620 -17.718  -4.819
  131   HG22  THR  17          HG22      THR  17  18.891 -17.265  -3.668
  132   HG23  THR  17          HG32      THR  17  17.975 -15.993  -4.515
  133    H    GLU  18           H        GLU  18  18.823 -17.967  -9.159
  134    HA   GLU  18           HA       GLU  18  21.555 -17.150  -9.970
  135    HB2  GLU  18           HB2      GLU  18  20.139 -19.599 -10.976
  136    HB3  GLU  18           HB3      GLU  18  21.861 -19.331 -10.742
  137    HG2  GLU  18           HG2      GLU  18  19.815 -19.678  -8.488
  138    HG3  GLU  18           HG3      GLU  18  20.807 -20.949  -9.139
  139    H    THR  19           H        THR  19  18.288 -16.684 -10.618
  140    HA   THR  19           HA       THR  19  18.323 -16.596 -13.517
  141    HB   THR  19           HB       THR  19  16.402 -15.483 -11.431
  142    HG1  THR  19           1HG      THR  19  16.776 -17.804 -11.591
  143   HG21  THR  19          1HG2      THR  19  15.990 -15.914 -14.418
  144   HG22  THR  19          HG22      THR  19  14.710 -15.527 -13.259
  145   HG23  THR  19          HG32      THR  19  15.997 -14.344 -13.575
  146    H    ASN  20           H        ASN  20  18.465 -14.792 -14.821
  147    HA   ASN  20           HA       ASN  20  19.184 -12.216 -13.517
  148    HB2  ASN  20           HB2      ASN  20  20.700 -13.003 -15.967
  149    HB3  ASN  20           HB3      ASN  20  21.181 -11.948 -14.637
  150   HD21  ASN  20          2HD2      ASN  20  20.978 -15.201 -15.883
  151   HD22  ASN  20          1HD2      ASN  20  21.955 -15.967 -14.644
  152    H    GLU  21           H        GLU  21  19.788 -10.849 -15.816
  153    HA   GLU  21           HA       GLU  21  17.138 -10.203 -16.750
  154    HB2  GLU  21           HB2      GLU  21  19.925  -9.338 -17.613
  155    HB3  GLU  21           HB3      GLU  21  18.424  -8.636 -18.262
  156    HG2  GLU  21           HG2      GLU  21  17.733  -7.890 -16.065
  157    HG3  GLU  21           HG3      GLU  21  19.036  -8.790 -15.294
  158    H    LYS  22           H        LYS  22  19.785 -12.231 -17.978
  159    HA   LYS  22           HA       LYS  22  18.859 -12.356 -20.681
  160    HB2  LYS  22           HB2      LYS  22  21.114 -13.038 -19.435
  161    HB3  LYS  22           HB3      LYS  22  20.339 -14.616 -19.329
  162    HG2  LYS  22           HG2      LYS  22  20.968 -13.020 -21.856
  163    HG3  LYS  22           HG3      LYS  22  21.816 -14.459 -21.270
  164    HD2  LYS  22           2HD      LYS  22  19.665 -15.753 -21.552
  165    HD3  LYS  22           3HD      LYS  22  18.984 -14.309 -22.355
  166    HE2  LYS  22           HE2      LYS  22  20.811 -14.360 -24.008
  167    HE3  LYS  22           HE3      LYS  22  21.484 -15.802 -23.225
  168    HZ1  LYS  22           3HZ      LYS  22  19.452 -16.961 -23.749
  169    HZ2  LYS  22           1HZ      LYS  22  18.818 -15.621 -24.461
  170    HZ3  LYS  22           2HZ      LYS  22  20.132 -16.361 -25.118
  171    H    ALA  23           H        ALA  23  17.890 -14.000 -17.695
  172    HA   ALA  23           HA       ALA  23  16.396 -16.112 -19.166
  173    HB1  ALA  23           1HB      ALA  23  16.891 -15.523 -16.230
  174    HB2  ALA  23           HB2      ALA  23  15.987 -16.926 -16.865
  175    HB3  ALA  23           HB3      ALA  23  17.719 -16.750 -17.217
  176    H    LEU  24           H        LEU  24  15.992 -12.951 -17.911
  177    HA   LEU  24           HA       LEU  24  13.111 -13.282 -17.434
  178    HB2  LEU  24           HB2      LEU  24  15.404 -11.582 -16.631
  179    HB3  LEU  24           HB3      LEU  24  13.969 -10.629 -16.910
  180    HG   LEU  24           HG       LEU  24  13.887 -13.221 -15.334
  181   HD11  LEU  24          1HD1      LEU  24  15.613 -11.842 -14.239
  182   HD12  LEU  24          2HD1      LEU  24  14.479 -10.465 -14.188
  183   HD13  LEU  24          3HD1      LEU  24  14.146 -11.941 -13.242
  184   HD21  LEU  24          3HD2      LEU  24  11.779 -12.073 -16.063
  185   HD22  LEU  24          1HD2      LEU  24  11.919 -12.193 -14.286
  186   HD23  LEU  24          2HD2      LEU  24  12.249 -10.650 -15.114
  187    H    GLU  25           H        GLU  25  15.428 -11.868 -19.705
  188    HA   GLU  25           HA       GLU  25  13.297 -10.520 -21.187
  189    HB2  GLU  25           HB2      GLU  25  16.225 -11.136 -21.843
  190    HB3  GLU  25           HB3      GLU  25  15.134 -10.248 -22.929
  191    HG2  GLU  25           HG2      GLU  25  14.669  -8.654 -21.126
  192    HG3  GLU  25           HG3      GLU  25  15.879  -9.448 -20.100
  193    H    ALA  26           H        ALA  26  14.952 -13.577 -21.127
  194    HA   ALA  26           HA       ALA  26  14.167 -14.439 -23.801
  195    HB1  ALA  26           1HB      ALA  26  16.244 -15.180 -22.720
  196    HB2  ALA  26           HB2      ALA  26  15.296 -15.879 -21.375
  197    HB3  ALA  26           HB3      ALA  26  15.173 -16.578 -23.008
  198    H    VAL  27           H        VAL  27  12.889 -14.668 -20.506
  199    HA   VAL  27           HA       VAL  27  11.107 -16.868 -21.233
  200    HB   VAL  27           HB       VAL  27  12.431 -16.635 -19.206
  201   HG11  VAL  27          1HG1      VAL  27  11.557 -15.307 -17.362
  202   HG12  VAL  27          HG21      VAL  27  11.808 -14.263 -18.785
  203   HG13  VAL  27          HG31      VAL  27  10.153 -14.827 -18.365
  204   HG21  VAL  27          HG32      VAL  27  10.752 -17.761 -17.876
  205   HG22  VAL  27          1HG2      VAL  27   9.435 -17.000 -18.822
  206   HG23  VAL  27          HG22      VAL  27  10.523 -18.214 -19.576
  207    H    PHE  28           H        PHE  28  10.963 -13.404 -20.388
  208    HA   PHE  28           HA       PHE  28   8.026 -13.410 -20.719
  209    HB2  PHE  28           HB2      PHE  28   9.961 -11.268 -19.812
  210    HB3  PHE  28           HB3      PHE  28   8.237 -10.998 -20.086
  211    HD1  PHE  28           HD2      PHE  28   6.524 -12.153 -18.717
  212    HD2  PHE  28           HD1      PHE  28  10.713 -12.418 -17.826
  213    HE1  PHE  28           HE2      PHE  28   5.986 -13.059 -16.475
  214    HE2  PHE  28           HE1      PHE  28  10.185 -13.332 -15.586
  215    HZ   PHE  28           HZ       PHE  28   7.817 -13.647 -14.905
  216    H    GLY  29           H        GLY  29  10.775 -13.000 -22.676
  217    HA2  GLY  29           2HA      GLY  29   9.596 -11.064 -24.513
  218    HA3  GLY  29           3HA      GLY  29  11.020 -12.079 -24.824
  219    H    LYS  30           H        LYS  30   8.808 -14.191 -23.699
  220    HA   LYS  30           HA       LYS  30   8.209 -15.294 -26.310
  221    HB2  LYS  30           HB2      LYS  30   7.452 -16.062 -23.432
  222    HB3  LYS  30           HB3      LYS  30   7.203 -17.096 -24.855
  223    HG2  LYS  30           HG2      LYS  30   9.567 -17.175 -25.290
  224    HG3  LYS  30           HG3      LYS  30   9.926 -16.013 -24.010
  225    HD2  LYS  30           2HD      LYS  30  10.368 -18.473 -23.458
  226    HD3  LYS  30           3HD      LYS  30   9.464 -17.524 -22.273
  227    HE2  LYS  30           HE2      LYS  30   7.354 -18.428 -23.026
  228    HE3  LYS  30           HE3      LYS  30   8.149 -19.317 -24.342
  229    HZ1  LYS  30           3HZ      LYS  30   9.343 -20.568 -22.675
  230    HZ2  LYS  30           1HZ      LYS  30   8.586 -19.751 -21.463
  231    HZ3  LYS  30           2HZ      LYS  30   7.720 -20.726 -22.460
  232    H    TYR  31           H        TYR  31   6.745 -13.102 -24.226
  233    HA   TYR  31           HA       TYR  31   4.009 -13.685 -25.265
  234    HB2  TYR  31           HB2      TYR  31   4.950 -12.179 -22.822
  235    HB3  TYR  31           HB3      TYR  31   3.264 -12.480 -23.237
  236    HD1  TYR  31           HD1      TYR  31   2.639 -15.053 -23.498
  237    HD2  TYR  31           HD2      TYR  31   6.146 -13.601 -21.474
  238    HE1  TYR  31           HE1      TYR  31   2.860 -17.230 -22.318
  239    HE2  TYR  31           HE2      TYR  31   6.356 -15.773 -20.268
  240    HH   TYR  31           HH       TYR  31   4.101 -18.492 -20.891
  241    H    GLY  32           H        GLY  32   6.592 -11.310 -25.357
  242    HA2  GLY  32           2HA      GLY  32   5.274  -9.688 -27.282
  243    HA3  GLY  32           3HA      GLY  32   5.104  -8.922 -25.684
  244    H    ARG  33           H        ARG  33   6.423  -7.653 -27.776
  245    HA   ARG  33           HA       ARG  33   9.245  -8.085 -27.569
  246    HB2  ARG  33           HB2      ARG  33   7.859  -7.026 -29.477
  247    HB3  ARG  33           HB3      ARG  33   7.838  -5.547 -28.474
  248    HG2  ARG  33           HG2      ARG  33  10.315  -5.610 -28.382
  249    HG3  ARG  33           HG3      ARG  33  10.279  -7.134 -29.305
  250    HD2  ARG  33           2HD      ARG  33   9.218  -4.460 -30.326
  251    HD3  ARG  33           3HD      ARG  33  10.831  -5.084 -30.679
  252    HE   ARG  33           HE       ARG  33   9.873  -6.883 -31.950
  253   HH11  ARG  33          1HH1      ARG  33   7.485  -4.454 -30.929
  254   HH12  ARG  33          2HH1      ARG  33   6.334  -4.931 -32.147
  255   HH21  ARG  33          1HH2      ARG  33   8.335  -7.466 -33.503
  256   HH22  ARG  33          2HH2      ARG  33   6.801  -6.629 -33.589
  257    H    ILE  34           H        ILE  34  10.384  -7.681 -25.906
  258    HA   ILE  34           HA       ILE  34   9.524  -5.973 -23.716
  259    HB   ILE  34           HB       ILE  34  12.108  -7.450 -24.313
  260   HG12  ILE  34          HG21      ILE  34   9.682  -7.969 -22.540
  261   HG13  ILE  34          HG31      ILE  34  10.174  -8.889 -23.970
  262   HG21  ILE  34          1HG2      ILE  34  12.543  -5.492 -22.850
  263   HG22  ILE  34          HG22      ILE  34  11.268  -6.055 -21.741
  264   HG23  ILE  34          HG32      ILE  34  12.748  -7.022 -22.007
  265   HD11  ILE  34          3HD1      ILE  34  11.674  -8.739 -21.326
  266   HD12  ILE  34          1HD1      ILE  34  10.803 -10.131 -21.983
  267   HD13  ILE  34          2HD1      ILE  34  12.271  -9.547 -22.802
  268    H    VAL  35           H        VAL  35  10.184  -3.961 -23.146
  269    HA   VAL  35           HA       VAL  35  11.904  -2.517 -25.106
  270    HB   VAL  35           HB       VAL  35  10.470  -0.732 -23.355
  271   HG11  VAL  35          1HG1      VAL  35  10.270  -1.294 -26.327
  272   HG12  VAL  35          HG21      VAL  35   9.704   0.179 -25.493
  273   HG13  VAL  35          HG31      VAL  35  11.441  -0.198 -25.547
  274   HG21  VAL  35          HG32      VAL  35   8.692  -2.661 -24.904
  275   HG22  VAL  35          1HG2      VAL  35   8.717  -2.421 -23.140
  276   HG23  VAL  35          HG22      VAL  35   8.175  -1.114 -24.209
  277    H    GLU  36           H        GLU  36  11.460  -3.517 -21.788
  278    HA   GLU  36           HA       GLU  36  14.184  -2.737 -21.130
  279    HB2  GLU  36           HB2      GLU  36  13.000  -0.609 -20.735
  280    HB3  GLU  36           HB3      GLU  36  11.808  -1.437 -19.719
  281    HG2  GLU  36           HG2      GLU  36  13.510  -1.998 -18.074
  282    HG3  GLU  36           HG3      GLU  36  14.785  -1.373 -19.139
  283    H    VAL  37           H        VAL  37  14.949  -3.893 -19.299
  284    HA   VAL  37           HA       VAL  37  12.934  -5.401 -17.751
  285    HB   VAL  37           HB       VAL  37  15.149  -6.611 -19.380
  286   HG11  VAL  37          1HG1      VAL  37  15.273  -8.570 -17.903
  287   HG12  VAL  37          HG21      VAL  37  15.911  -7.134 -17.089
  288   HG13  VAL  37          HG31      VAL  37  14.279  -7.733 -16.688
  289   HG21  VAL  37          HG32      VAL  37  12.445  -7.548 -18.310
  290   HG22  VAL  37          1HG2      VAL  37  12.750  -6.890 -19.937
  291   HG23  VAL  37          HG22      VAL  37  13.450  -8.453 -19.450
  292    H    LEU  38           H        LEU  38  13.388  -5.749 -15.682
  293    HA   LEU  38           HA       LEU  38  15.881  -4.513 -14.519
  294    HB2  LEU  38           HB2      LEU  38  13.010  -4.435 -13.911
  295    HB3  LEU  38           HB3      LEU  38  14.017  -4.641 -12.502
  296    HG   LEU  38           HG       LEU  38  14.398  -2.382 -14.525
  297   HD11  LEU  38          1HD1      LEU  38  13.446  -0.959 -12.732
  298   HD12  LEU  38          2HD1      LEU  38  12.267  -2.176 -13.275
  299   HD13  LEU  38          3HD1      LEU  38  13.146  -2.399 -11.741
  300   HD21  LEU  38          3HD2      LEU  38  15.802  -1.387 -12.763
  301   HD22  LEU  38          1HD2      LEU  38  15.572  -2.835 -11.758
  302   HD23  LEU  38          2HD2      LEU  38  16.467  -2.950 -13.293
  303    H    LEU  39           H        LEU  39  16.878  -5.680 -12.894
  304    HA   LEU  39           HA       LEU  39  15.568  -8.090 -11.944
  305    HB2  LEU  39           HB2      LEU  39  16.748  -8.870 -13.930
  306    HB3  LEU  39           HB3      LEU  39  18.241  -8.076 -13.418
  307    HG   LEU  39           HG       LEU  39  18.013 -10.610 -13.207
  308   HD11  LEU  39          1HD1      LEU  39  19.830  -9.253 -12.234
  309   HD12  LEU  39          2HD1      LEU  39  18.883  -9.088 -10.726
  310   HD13  LEU  39          3HD1      LEU  39  19.443 -10.684 -11.257
  311   HD21  LEU  39          3HD2      LEU  39  15.809 -10.664 -12.084
  312   HD22  LEU  39          1HD2      LEU  39  17.069 -11.497 -11.154
  313   HD23  LEU  39          2HD2      LEU  39  16.524  -9.879 -10.652
  314    H    MET  40           H        MET  40  15.837  -8.007  -9.760
  315    HA   MET  40           HA       MET  40  17.699  -5.919  -8.832
  316    HB2  MET  40           HB2      MET  40  15.628  -7.335  -7.142
  317    HB3  MET  40           HB3      MET  40  16.375  -5.763  -6.878
  318    HG2  MET  40           HG2      MET  40  14.119  -6.570  -8.654
  319    HG3  MET  40           HG3      MET  40  14.285  -5.151  -7.631
  320    HE1  MET  40           HE3      MET  40  17.121  -4.067  -8.653
  321    HE2  MET  40           HE1      MET  40  16.704  -2.996 -10.024
  322    HE3  MET  40           HE2      MET  40  15.791  -2.904  -8.494
  323    H    LYS  41           H        LYS  41  19.390  -6.260  -7.415
  324    HA   LYS  41           HA       LYS  41  19.646  -8.923  -6.216
  325    HB2  LYS  41           HB2      LYS  41  22.247  -8.544  -7.037
  326    HB3  LYS  41           HB3      LYS  41  21.077  -9.674  -7.721
  327    HG2  LYS  41           HG2      LYS  41  20.478  -8.187  -9.476
  328    HG3  LYS  41           HG3      LYS  41  21.412  -6.840  -8.762
  329    HD2  LYS  41           2HD      LYS  41  23.495  -8.094  -9.081
  330    HD3  LYS  41           3HD      LYS  41  22.587  -9.478  -9.736
  331    HE2  LYS  41           HE2      LYS  41  21.770  -8.069 -11.594
  332    HE3  LYS  41           HE3      LYS  41  22.651  -6.680 -10.935
  333    HZ1  LYS  41           3HZ      LYS  41  23.874  -7.757 -12.685
  334    HZ2  LYS  41           1HZ      LYS  41  24.693  -7.903 -11.265
  335    HZ3  LYS  41           2HZ      LYS  41  23.868  -9.187 -11.881
  336    H    ASP  42           H        ASP  42  21.125  -9.109  -4.529
  337    HA   ASP  42           HA       ASP  42  21.154  -6.888  -2.745
  338    HB2  ASP  42           HB2      ASP  42  21.144  -9.510  -2.404
  339    HB3  ASP  42           HB3      ASP  42  22.898  -9.328  -2.462
  340    H    ARG  43           H        ARG  43  23.160  -6.138  -1.599
  341    HA   ARG  43           HA       ARG  43  25.274  -5.528  -3.607
  342    HB2  ARG  43           HB2      ARG  43  25.687  -3.505  -2.304
  343    HB3  ARG  43           HB3      ARG  43  23.992  -3.594  -2.822
  344    HG2  ARG  43           HG2      ARG  43  23.361  -4.445  -0.572
  345    HG3  ARG  43           HG3      ARG  43  25.064  -4.324  -0.060
  346    HD2  ARG  43           2HD      ARG  43  25.036  -1.909  -0.522
  347    HD3  ARG  43           3HD      ARG  43  23.334  -2.019  -1.027
  348    HE   ARG  43           HE       ARG  43  23.560  -3.116   1.580
  349   HH11  ARG  43          1HH1      ARG  43  23.849   0.008  -0.044
  350   HH12  ARG  43          2HH1      ARG  43  23.368   0.920   1.369
  351   HH21  ARG  43          1HH2      ARG  43  22.933  -1.907   3.406
  352   HH22  ARG  43          2HH2      ARG  43  22.843  -0.165   3.319
  353    H    GLU  44           H        GLU  44  24.668  -7.416  -0.869
  354    HA   GLU  44           HA       GLU  44  27.522  -7.386  -0.016
  355    HB2  GLU  44           HB2      GLU  44  25.041  -8.592   1.264
  356    HB3  GLU  44           HB3      GLU  44  26.676  -8.674   1.927
  357    HG2  GLU  44           HG2      GLU  44  25.090  -6.122   1.431
  358    HG3  GLU  44           HG3      GLU  44  25.346  -6.886   2.996
  359    H    THR  45           H        THR  45  25.252  -9.156  -1.916
  360    HA   THR  45           HA       THR  45  27.177 -11.435  -2.053
  361    HB   THR  45           HB       THR  45  25.334 -13.010  -2.212
  362    HG1  THR  45           1HG      THR  45  23.204 -12.212  -1.900
  363   HG21  THR  45          1HG2      THR  45  24.441 -12.874   0.030
  364   HG22  THR  45          HG22      THR  45  26.135 -12.299   0.052
  365   HG23  THR  45          HG32      THR  45  24.789 -11.119   0.101
  366    H    ASN  46           H        ASN  46  25.227  -9.087  -3.690
  367    HA   ASN  46           HA       ASN  46  24.900  -8.668  -5.872
  368    HB2  ASN  46           HB2      ASN  46  27.439  -9.335  -5.669
  369    HB3  ASN  46           HB3      ASN  46  26.956 -10.712  -6.668
  370   HD21  ASN  46          2HD2      ASN  46  28.683  -9.441  -8.008
  371   HD22  ASN  46          1HD2      ASN  46  28.019  -8.317  -9.180
  372    H    LYS  47           H        LYS  47  23.892 -11.342  -4.430
  373    HA   LYS  47           HA       LYS  47  22.951 -12.885  -6.739
  374    HB2  LYS  47           HB2      LYS  47  22.507 -13.026  -3.729
  375    HB3  LYS  47           HB3      LYS  47  21.627 -14.054  -4.855
  376    HG2  LYS  47           HG2      LYS  47  24.649 -13.871  -4.847
  377    HG3  LYS  47           HG3      LYS  47  23.756 -15.046  -3.838
  378    HD2  LYS  47           2HD      LYS  47  22.695 -15.941  -5.937
  379    HD3  LYS  47           3HD      LYS  47  23.734 -14.852  -6.883
  380    HE2  LYS  47           HE2      LYS  47  25.734 -15.885  -5.783
  381    HE3  LYS  47           HE3      LYS  47  24.658 -17.015  -4.949
  382    HZ1  LYS  47           3HZ      LYS  47  25.544 -18.003  -6.931
  383    HZ2  LYS  47           1HZ      LYS  47  23.926 -17.782  -7.138
  384    HZ3  LYS  47           2HZ      LYS  47  24.984 -16.772  -7.870
  385    H    SER  48           H        SER  48  20.760 -13.170  -7.244
  386    HA   SER  48           HA       SER  48  19.309 -10.763  -7.474
  387    HB2  SER  48           HB2      SER  48  18.248 -13.610  -7.627
  388    HB3  SER  48           HB3      SER  48  17.475 -12.151  -8.290
  389    HG   SER  48           HG       SER  48  18.734 -13.264  -9.858
  390    H    ARG  49           H        ARG  49  17.662  -9.826  -6.333
  391    HA   ARG  49           HA       ARG  49  17.400 -10.363  -3.514
  392    HB2  ARG  49           HB2      ARG  49  15.706  -8.769  -5.473
  393    HB3  ARG  49           HB3      ARG  49  15.571  -8.642  -3.708
  394    HG2  ARG  49           HG2      ARG  49  18.197  -8.105  -5.099
  395    HG3  ARG  49           HG3      ARG  49  16.929  -6.868  -5.088
  396    HD2  ARG  49           2HD      ARG  49  18.047  -8.154  -2.578
  397    HD3  ARG  49           3HD      ARG  49  18.633  -6.630  -3.307
  398    HE   ARG  49           HE       ARG  49  16.149  -7.029  -1.810
  399   HH11  ARG  49          1HH1      ARG  49  17.941  -5.004  -4.090
  400   HH12  ARG  49          2HH1      ARG  49  16.992  -3.582  -3.776
  401   HH21  ARG  49          1HH2      ARG  49  14.929  -5.137  -1.378
  402   HH22  ARG  49          2HH2      ARG  49  15.311  -3.643  -2.204
  403    H    GLY  50           H        GLY  50  16.188 -11.914  -6.238
  404    HA2  GLY  50           2HA      GLY  50  14.743 -13.751  -6.305
  405    HA3  GLY  50           3HA      GLY  50  14.072 -13.297  -4.725
  406    H    PHE  51           H        PHE  51  14.191 -10.445  -6.558
  407    HA   PHE  51           HA       PHE  51  11.680 -11.045  -7.981
  408    HB2  PHE  51           HB2      PHE  51  10.490  -9.232  -7.091
  409    HB3  PHE  51           HB3      PHE  51  11.091 -10.164  -5.729
  410    HD1  PHE  51           HD2      PHE  51  13.119  -9.251  -4.431
  411    HD2  PHE  51           HD1      PHE  51  10.998  -6.961  -7.391
  412    HE1  PHE  51           HE2      PHE  51  14.059  -7.152  -3.488
  413    HE2  PHE  51           HE1      PHE  51  11.882  -4.869  -6.399
  414    HZ   PHE  51           HZ       PHE  51  13.448  -4.957  -4.502
  415    H    ALA  52           H        ALA  52  11.103  -9.379  -9.563
  416    HA   ALA  52           HA       ALA  52  13.254  -7.620 -10.507
  417    HB1  ALA  52           1HB      ALA  52  13.940  -9.876 -11.265
  418    HB2  ALA  52           HB2      ALA  52  12.354 -10.105 -12.038
  419    HB3  ALA  52           HB3      ALA  52  13.465  -8.863 -12.647
  420    H    PHE  53           H        PHE  53  12.512  -6.888 -12.899
  421    HA   PHE  53           HA       PHE  53   9.568  -6.735 -13.087
  422    HB2  PHE  53           HB2      PHE  53  11.357  -4.265 -13.092
  423    HB3  PHE  53           HB3      PHE  53   9.653  -4.288 -13.455
  424    HD1  PHE  53           HD1      PHE  53  12.171  -4.975 -10.811
  425    HD2  PHE  53           HD2      PHE  53   8.074  -4.044 -11.710
  426    HE1  PHE  53           HE1      PHE  53  11.734  -4.622  -8.404
  427    HE2  PHE  53           HE2      PHE  53   7.617  -3.714  -9.289
  428    HZ   PHE  53           HZ       PHE  53   9.448  -4.020  -7.633
  429    H    VAL  54           H        VAL  54   8.893  -5.852 -15.240
  430    HA   VAL  54           HA       VAL  54  10.946  -5.750 -17.327
  431    HB   VAL  54           HB       VAL  54  10.582  -8.179 -17.181
  432   HG11  VAL  54          1HG1      VAL  54   7.681  -7.691 -17.459
  433   HG12  VAL  54          HG21      VAL  54   8.574  -9.253 -17.449
  434   HG13  VAL  54          HG31      VAL  54   8.613  -8.223 -15.996
  435   HG21  VAL  54          HG32      VAL  54  10.659  -7.055 -19.515
  436   HG22  VAL  54          1HG2      VAL  54   9.844  -8.639 -19.452
  437   HG23  VAL  54          HG22      VAL  54   8.892  -7.149 -19.517
  438    H    THR  55           H        THR  55  10.281  -4.531 -19.062
  439    HA   THR  55           HA       THR  55   7.458  -3.566 -18.980
  440    HB   THR  55           HB       THR  55   9.894  -2.132 -20.098
  441    HG1  THR  55           1HG      THR  55   9.898  -2.244 -17.831
  442   HG21  THR  55          1HG2      THR  55   8.287  -0.210 -20.144
  443   HG22  THR  55          HG22      THR  55   7.792  -1.522 -21.228
  444   HG23  THR  55          HG32      THR  55   6.980  -1.324 -19.666
  445    H    PHE  56           H        PHE  56   6.224  -4.241 -20.537
  446    HA   PHE  56           HA       PHE  56   7.330  -5.342 -23.045
  447    HB2  PHE  56           HB2      PHE  56   4.588  -5.224 -21.759
  448    HB3  PHE  56           HB3      PHE  56   4.859  -5.844 -23.386
  449    HD1  PHE  56           HD2      PHE  56   6.348  -6.410 -19.916
  450    HD2  PHE  56           HD1      PHE  56   5.019  -8.057 -23.667
  451    HE1  PHE  56           HE2      PHE  56   6.847  -8.672 -19.096
  452    HE2  PHE  56           HE1      PHE  56   5.463 -10.328 -22.821
  453    HZ   PHE  56           HZ       PHE  56   6.321 -10.656 -20.515
  454    H    GLU  57           H        GLU  57   6.588  -4.661 -25.146
  455    HA   GLU  57           HA       GLU  57   6.122  -1.839 -25.456
  456    HB2  GLU  57           HB2      GLU  57   6.239  -4.283 -27.242
  457    HB3  GLU  57           HB3      GLU  57   5.623  -2.744 -27.848
  458    HG2  GLU  57           HG2      GLU  57   7.773  -1.675 -26.931
  459    HG3  GLU  57           HG3      GLU  57   8.403  -3.327 -26.795
  460    H    SER  58           H        SER  58   3.986  -4.669 -25.076
  461    HA   SER  58           HA       SER  58   1.698  -2.785 -25.487
  462    HB2  SER  58           HB2      SER  58   1.634  -4.427 -27.239
  463    HB3  SER  58           HB3      SER  58   1.956  -5.740 -26.084
  464    HG   SER  58           HG       SER  58  -0.277  -5.508 -26.650
  465    HA   PRO  59           HA       PRO  59   0.926  -3.579 -21.248
  466    HB2  PRO  59           HB2      PRO  59  -1.562  -2.558 -20.986
  467    HB3  PRO  59           HB3      PRO  59  -0.190  -1.482 -21.445
  468    HG2  PRO  59           HG2      PRO  59  -2.141  -2.897 -23.282
  469    HG3  PRO  59           HG3      PRO  59  -1.818  -1.136 -23.208
  470    HD2  PRO  59           2HD      PRO  59  -0.495  -2.708 -24.995
  471    HD3  PRO  59           3HD      PRO  59   0.412  -1.452 -24.100
  472    H    ALA  60           H        ALA  60  -0.461  -5.260 -23.840
  473    HA   ALA  60           HA       ALA  60  -2.023  -6.978 -21.970
  474    HB1  ALA  60           1HB      ALA  60  -2.481  -6.472 -24.934
  475    HB2  ALA  60           HB2      ALA  60  -3.436  -7.558 -23.892
  476    HB3  ALA  60           HB3      ALA  60  -3.446  -5.805 -23.592
  477    H    ASP  61           H        ASP  61   0.656  -6.800 -24.237
  478    HA   ASP  61           HA       ASP  61   0.948  -9.671 -24.524
  479    HB2  ASP  61           HB2      ASP  61   2.942  -7.348 -24.626
  480    HB3  ASP  61           HB3      ASP  61   3.378  -8.985 -24.878
  481    H    ALA  62           H        ALA  62   1.656  -7.204 -22.106
  482    HA   ALA  62           HA       ALA  62   3.267  -8.914 -20.413
  483    HB1  ALA  62           1HB      ALA  62   2.884  -7.076 -18.777
  484    HB2  ALA  62           HB2      ALA  62   3.467  -6.477 -20.355
  485    HB3  ALA  62           HB3      ALA  62   1.751  -6.312 -19.912
  486    H    LYS  63           H        LYS  63  -0.210  -8.202 -20.791
  487    HA   LYS  63           HA       LYS  63  -1.008  -9.479 -18.314
  488    HB2  LYS  63           HB2      LYS  63  -2.506  -8.973 -20.918
  489    HB3  LYS  63           HB3      LYS  63  -3.251  -9.548 -19.417
  490    HG2  LYS  63           HG2      LYS  63  -2.578  -7.513 -18.235
  491    HG3  LYS  63           HG3      LYS  63  -1.691  -6.958 -19.664
  492    HD2  LYS  63           2HD      LYS  63  -3.823  -5.771 -19.564
  493    HD3  LYS  63           3HD      LYS  63  -3.827  -6.846 -20.948
  494    HE2  LYS  63           HE2      LYS  63  -5.959  -7.064 -19.836
  495    HE3  LYS  63           HE3      LYS  63  -5.060  -8.562 -19.565
  496    HZ1  LYS  63           3HZ      LYS  63  -6.094  -7.762 -17.560
  497    HZ2  LYS  63           1HZ      LYS  63  -4.462  -7.722 -17.383
  498    HZ3  LYS  63           2HZ      LYS  63  -5.297  -6.331 -17.653
  499    H    ASP  64           H        ASP  64  -0.511 -10.530 -21.703
  500    HA   ASP  64           HA       ASP  64  -1.596 -13.152 -21.313
  501    HB2  ASP  64           HB2      ASP  64  -1.154 -11.876 -23.489
  502    HB3  ASP  64           HB3      ASP  64   0.563 -12.224 -23.251
  503    H    ALA  65           H        ALA  65   1.559 -11.690 -20.776
  504    HA   ALA  65           HA       ALA  65   2.901 -14.204 -20.199
  505    HB1  ALA  65           1HB      ALA  65   3.657 -11.381 -19.321
  506    HB2  ALA  65           HB2      ALA  65   4.710 -12.816 -19.439
  507    HB3  ALA  65           HB3      ALA  65   4.058 -12.057 -20.911
  508    H    ALA  66           H        ALA  66   1.408 -11.569 -18.269
  509    HA   ALA  66           HA       ALA  66   2.133 -12.747 -15.755
  510    HB1  ALA  66           1HB      ALA  66   0.011 -10.655 -16.464
  511    HB2  ALA  66           HB2      ALA  66   0.706 -10.923 -14.848
  512    HB3  ALA  66           HB3      ALA  66   1.718 -10.298 -16.180
  513    H    ARG  67           H        ARG  67  -0.321 -13.463 -18.034
  514    HA   ARG  67           HA       ARG  67  -1.953 -14.928 -16.052
  515    HB2  ARG  67           HB2      ARG  67  -2.251 -14.331 -19.016
  516    HB3  ARG  67           HB3      ARG  67  -3.361 -15.382 -18.118
  517    HG2  ARG  67           HG2      ARG  67  -3.957 -13.585 -16.597
  518    HG3  ARG  67           HG3      ARG  67  -2.801 -12.482 -17.341
  519    HD2  ARG  67           2HD      ARG  67  -5.208 -13.737 -18.721
  520    HD3  ARG  67           3HD      ARG  67  -5.100 -12.062 -18.131
  521    HE   ARG  67           HE       ARG  67  -2.943 -12.470 -19.888
  522   HH11  ARG  67          1HH1      ARG  67  -6.472 -12.384 -19.991
  523   HH12  ARG  67          2HH1      ARG  67  -6.535 -11.807 -21.640
  524   HH21  ARG  67          1HH2      ARG  67  -3.054 -11.700 -22.054
  525   HH22  ARG  67          2HH2      ARG  67  -4.609 -11.430 -22.800
  526    H    ASP  68           H        ASP  68   0.992 -15.655 -17.378
  527    HA   ASP  68           HA       ASP  68   0.199 -18.454 -18.033
  528    HB2  ASP  68           HB2      ASP  68   1.724 -16.332 -19.469
  529    HB3  ASP  68           HB3      ASP  68   2.562 -17.835 -19.322
  530    H    MET  69           H        MET  69   2.821 -16.187 -17.240
  531    HA   MET  69           HA       MET  69   4.595 -18.193 -16.185
  532    HB2  MET  69           HB2      MET  69   4.459 -15.217 -16.767
  533    HB3  MET  69           HB3      MET  69   5.731 -15.808 -15.759
  534    HG2  MET  69           HG2      MET  69   5.056 -16.680 -18.593
  535    HG3  MET  69           HG3      MET  69   6.455 -15.726 -18.093
  536    HE1  MET  69           HE3      MET  69   7.044 -17.480 -15.343
  537    HE2  MET  69           HE1      MET  69   8.447 -18.396 -15.951
  538    HE3  MET  69           HE2      MET  69   8.254 -16.677 -16.377
  539    H    ASN  70           H        ASN  70   2.036 -16.233 -14.886
  540    HA   ASN  70           HA       ASN  70   3.141 -16.021 -12.214
  541    HB2  ASN  70           HB2      ASN  70   1.417 -14.466 -13.088
  542    HB3  ASN  70           HB3      ASN  70   0.285 -15.802 -13.252
  543   HD21  ASN  70          2HD2      ASN  70  -1.014 -14.281 -11.840
  544   HD22  ASN  70          1HD2      ASN  70  -0.814 -14.432 -10.104
  545    H    GLY  71           H        GLY  71   3.490 -17.713 -10.949
  546    HA2  GLY  71           2HA      GLY  71   2.672 -19.456  -9.549
  547    HA3  GLY  71           3HA      GLY  71   1.443 -19.851 -10.770
  548    H    LYS  72           H        LYS  72   4.017 -19.446 -12.727
  549    HA   LYS  72           HA       LYS  72   4.827 -22.239 -12.786
  550    HB2  LYS  72           HB2      LYS  72   5.846 -19.822 -14.286
  551    HB3  LYS  72           HB3      LYS  72   5.993 -21.511 -14.753
  552    HG2  LYS  72           HG2      LYS  72   3.397 -19.931 -14.639
  553    HG3  LYS  72           HG3      LYS  72   4.259 -20.448 -16.101
  554    HD2  LYS  72           2HD      LYS  72   2.984 -22.289 -14.036
  555    HD3  LYS  72           3HD      LYS  72   2.342 -21.907 -15.641
  556    HE2  LYS  72           HE2      LYS  72   4.379 -22.887 -16.682
  557    HE3  LYS  72           HE3      LYS  72   4.993 -23.306 -15.076
  558    HZ1  LYS  72           3HZ      LYS  72   3.048 -24.687 -14.767
  559    HZ2  LYS  72           1HZ      LYS  72   2.503 -24.316 -16.275
  560    HZ3  LYS  72           2HZ      LYS  72   3.893 -25.166 -16.092
  561    H    SER  73           H        SER  73   7.458 -21.642 -13.687
  562    HA   SER  73           HA       SER  73   8.943 -20.624 -11.310
  563    HB2  SER  73           HB2      SER  73   8.347 -22.995 -10.922
  564    HB3  SER  73           HB3      SER  73   9.104 -23.447 -12.462
  565    HG   SER  73           HG       SER  73  10.521 -23.741 -10.683
  566    H    LEU  74           H        LEU  74  11.097 -20.415 -11.545
  567    HA   LEU  74           HA       LEU  74  12.066 -20.369 -14.344
  568    HB2  LEU  74           HB2      LEU  74  11.471 -18.007 -12.748
  569    HB3  LEU  74           HB3      LEU  74  13.178 -18.208 -12.793
  570    HG   LEU  74           HG       LEU  74  12.532 -18.787 -15.458
  571   HD11  LEU  74          1HD1      LEU  74  10.967 -16.382 -14.480
  572   HD12  LEU  74          2HD1      LEU  74  11.092 -16.933 -16.147
  573   HD13  LEU  74          3HD1      LEU  74  10.181 -17.942 -14.952
  574   HD21  LEU  74          3HD2      LEU  74  12.957 -16.005 -14.385
  575   HD22  LEU  74          1HD2      LEU  74  14.290 -17.170 -14.769
  576   HD23  LEU  74          2HD2      LEU  74  13.215 -16.557 -16.064
  577    H    ASP  75           H        ASP  75  13.934 -21.373 -14.487
  578    HA   ASP  75           HA       ASP  75  15.839 -22.470 -13.977
  579    HB2  ASP  75           HB2      ASP  75  16.220 -19.932 -13.124
  580    HB3  ASP  75           HB3      ASP  75  16.124 -20.692 -11.579
  581    H    GLY  76           H        GLY  76  13.533 -22.179 -11.359
  582    HA2  GLY  76           2HA      GLY  76  13.515 -24.823 -10.784
  583    HA3  GLY  76           3HA      GLY  76  14.849 -24.214  -9.773
  584    H    LYS  77           H        LYS  77  13.018 -21.544  -9.772
  585    HA   LYS  77           HA       LYS  77  11.511 -22.426  -7.353
  586    HB2  LYS  77           HB2      LYS  77  12.804 -19.715  -7.825
  587    HB3  LYS  77           HB3      LYS  77  12.028 -20.281  -6.339
  588    HG2  LYS  77           HG2      LYS  77  14.576 -21.363  -7.594
  589    HG3  LYS  77           HG3      LYS  77  14.472 -20.360  -6.140
  590    HD2  LYS  77           2HD      LYS  77  13.356 -22.113  -4.894
  591    HD3  LYS  77           3HD      LYS  77  13.164 -23.105  -6.347
  592    HE2  LYS  77           HE2      LYS  77  15.012 -23.993  -5.091
  593    HE3  LYS  77           HE3      LYS  77  15.616 -23.276  -6.585
  594    HZ1  LYS  77           3HZ      LYS  77  16.252 -21.330  -5.311
  595    HZ2  LYS  77           1HZ      LYS  77  15.667 -21.997  -3.926
  596    HZ3  LYS  77           2HZ      LYS  77  16.954 -22.675  -4.682
  597    H    ALA  78           H        ALA  78   9.465 -21.758  -7.093
  598    HA   ALA  78           HA       ALA  78   8.101 -21.042  -9.500
  599    HB1  ALA  78           1HB      ALA  78   7.091 -21.243  -6.637
  600    HB2  ALA  78           HB2      ALA  78   6.078 -21.167  -8.098
  601    HB3  ALA  78           HB3      ALA  78   7.153 -22.560  -7.833
  602    H    ILE  79           H        ILE  79   7.126 -19.131 -10.142
  603    HA   ILE  79           HA       ILE  79   7.805 -16.762  -8.476
  604    HB   ILE  79           HB       ILE  79   8.286 -15.494 -10.410
  605   HG12  ILE  79          HG21      ILE  79   7.743 -17.958 -12.117
  606   HG13  ILE  79          HG31      ILE  79   6.677 -16.547 -11.989
  607   HG21  ILE  79          1HG2      ILE  79  10.345 -16.593 -11.078
  608   HG22  ILE  79          HG22      ILE  79  10.017 -17.013  -9.380
  609   HG23  ILE  79          HG32      ILE  79   9.688 -18.192 -10.670
  610   HD11  ILE  79          3HD1      ILE  79   9.529 -16.529 -13.100
  611   HD12  ILE  79          1HD1      ILE  79   8.003 -16.307 -13.994
  612   HD13  ILE  79          2HD1      ILE  79   8.530 -15.090 -12.828
  613    H    LYS  80           H        LYS  80   6.673 -14.842  -8.917
  614    HA   LYS  80           HA       LYS  80   3.774 -15.196  -9.498
  615    HB2  LYS  80           HB2      LYS  80   4.483 -14.552  -7.164
  616    HB3  LYS  80           HB3      LYS  80   5.262 -13.123  -7.846
  617    HG2  LYS  80           HG2      LYS  80   2.962 -12.485  -8.831
  618    HG3  LYS  80           HG3      LYS  80   2.283 -13.742  -7.772
  619    HD2  LYS  80           2HD      LYS  80   3.410 -12.574  -5.825
  620    HD3  LYS  80           3HD      LYS  80   3.932 -11.311  -6.970
  621    HE2  LYS  80           HE2      LYS  80   1.551 -10.877  -7.537
  622    HE3  LYS  80           HE3      LYS  80   1.060 -12.075  -6.327
  623    HZ1  LYS  80           3HZ      LYS  80   0.997  -9.849  -5.447
  624    HZ2  LYS  80           1HZ      LYS  80   2.158 -10.722  -4.663
  625    HZ3  LYS  80           2HZ      LYS  80   2.581  -9.608  -5.792
  626    H    VAL  81           H        VAL  81   2.860 -13.739 -10.994
  627    HA   VAL  81           HA       VAL  81   4.620 -11.564 -11.985
  628    HB   VAL  81           HB       VAL  81   3.016 -13.376 -13.824
  629   HG11  VAL  81          1HG1      VAL  81   4.987 -11.107 -14.340
  630   HG12  VAL  81          HG21      VAL  81   4.188 -12.106 -15.576
  631   HG13  VAL  81          HG31      VAL  81   3.224 -11.016 -14.552
  632   HG21  VAL  81          HG32      VAL  81   6.017 -13.156 -13.325
  633   HG22  VAL  81          1HG2      VAL  81   4.998 -14.565 -12.965
  634   HG23  VAL  81          HG22      VAL  81   5.260 -14.072 -14.651
  635    H    GLU  82           H        GLU  82   3.604  -9.657 -12.144
  636    HA   GLU  82           HA       GLU  82   0.681  -9.476 -12.233
  637    HB2  GLU  82           HB2      GLU  82   1.260 -10.041  -9.845
  638    HB3  GLU  82           HB3      GLU  82   2.249  -8.587  -9.765
  639    HG2  GLU  82           HG2      GLU  82   0.274  -7.178 -10.090
  640    HG3  GLU  82           HG3      GLU  82  -0.727  -8.600 -10.440
  641    H    GLN  83           H        GLN  83   0.014  -7.105 -12.355
  642    HA   GLN  83           HA       GLN  83   1.985  -5.595 -13.829
  643    HB2  GLN  83           HB2      GLN  83  -0.653  -5.595 -13.877
  644    HB3  GLN  83           HB3      GLN  83  -0.508  -4.347 -12.639
  645    HG2  GLN  83           HG2      GLN  83   0.980  -4.213 -15.296
  646    HG3  GLN  83           HG3      GLN  83  -0.693  -3.672 -15.144
  647   HE21  GLN  83          HE22      GLN  83   2.669  -2.953 -14.276
  648   HE22  GLN  83          HE12      GLN  83   2.359  -1.333 -13.707
  649    H    ALA  84           H        ALA  84   3.552  -4.282 -13.012
  650    HA   ALA  84           HA       ALA  84   4.227  -4.586 -10.304
  651    HB1  ALA  84           1HB      ALA  84   5.207  -2.543 -12.324
  652    HB2  ALA  84           HB2      ALA  84   6.030  -2.987 -10.817
  653    HB3  ALA  84           HB3      ALA  84   5.844  -4.194 -12.113
  654    H    THR  85           H        THR  85   4.265  -3.276  -8.517
  655    HA   THR  85           HA       THR  85   2.529  -0.860  -8.605
  656    HB   THR  85           HB       THR  85   2.523  -0.957  -6.198
  657    HG1  THR  85           1HG      THR  85   4.100  -3.292  -6.504
  658   HG21  THR  85          1HG2      THR  85   0.828  -2.302  -7.474
  659   HG22  THR  85          HG22      THR  85   1.905  -3.711  -7.380
  660   HG23  THR  85          HG32      THR  85   1.207  -3.025  -5.894
  661    H    LYS  86           H        LYS  86   3.296   0.923  -7.109
  662    HA   LYS  86           HA       LYS  86   5.844   1.837  -8.050
  663    HB2  LYS  86           HB2      LYS  86   3.902   2.848  -5.937
  664    HB3  LYS  86           HB3      LYS  86   5.330   3.743  -6.499
  665    HG2  LYS  86           HG2      LYS  86   4.454   3.594  -8.846
  666    HG3  LYS  86           HG3      LYS  86   3.008   2.773  -8.231
  667    HD2  LYS  86           2HD      LYS  86   2.548   4.807  -6.800
  668    HD3  LYS  86           3HD      LYS  86   3.914   5.612  -7.608
  669    HE2  LYS  86           HE2      LYS  86   2.806   5.137  -9.818
  670    HE3  LYS  86           HE3      LYS  86   1.423   4.464  -8.946
  671    HZ1  LYS  86           3HZ      LYS  86   1.109   6.612  -7.910
  672    HZ2  LYS  86           1HZ      LYS  86   2.398   7.233  -8.720
  673    HZ3  LYS  86           2HZ      LYS  86   1.059   6.750  -9.548
  674    HA   PRO  87           HA       PRO  87   8.515   0.172  -4.999
  675    HB2  PRO  87           HB2      PRO  87  10.563   1.955  -4.912
  676    HB3  PRO  87           HB3      PRO  87  10.224   1.014  -6.387
  677    HG2  PRO  87           HG2      PRO  87   9.263   3.823  -5.773
  678    HG3  PRO  87           HG3      PRO  87  10.117   3.241  -7.247
  679    HD2  PRO  87           2HD      PRO  87   7.415   3.443  -7.193
  680    HD3  PRO  87           3HD      PRO  87   8.203   2.044  -7.987
  681    H    SER  88           H        SER  88   9.452   0.580  -2.837
  682    HA   SER  88           HA       SER  88   7.668   2.422  -1.335
  683    HB2  SER  88           HB2      SER  88   8.617  -0.386  -0.641
  684    HB3  SER  88           HB3      SER  88   7.660   0.663   0.432
  685    HG   SER  88           HG       SER  88   6.918  -0.281  -2.138
  686    H    PHE  89           H        PHE  89  10.832   2.230  -2.174
  687    HA   PHE  89           HA       PHE  89  11.878   2.824   0.514
  688    HB2  PHE  89           HB2      PHE  89  14.045   2.955  -0.513
  689    HB3  PHE  89           HB3      PHE  89  13.239   1.437  -0.934
  690    HD1  PHE  89           HD1      PHE  89  12.140   1.289  -3.259
  691    HD2  PHE  89           HD2      PHE  89  14.879   4.398  -2.137
  692    HE1  PHE  89           HE1      PHE  89  12.590   1.774  -5.664
  693    HE2  PHE  89           HE2      PHE  89  15.384   4.827  -4.535
  694    HZ   PHE  89           HZ       PHE  89  14.211   3.505  -6.298
  695    H    GLU  90           H        GLU  90   9.978   4.592  -1.351
  696    HA   GLU  90           HA       GLU  90  11.374   7.109  -0.660
  697    HB2  GLU  90           HB2      GLU  90  11.813   6.341  -3.097
  698    HB3  GLU  90           HB3      GLU  90  10.101   6.700  -3.386
  699    HG2  GLU  90           HG2      GLU  90  10.497   9.024  -2.550
  700    HG3  GLU  90           HG3      GLU  90  12.200   8.603  -2.274
  701    H    SER  91           H        SER  91  10.048   8.885  -0.371
  702    HA   SER  91           HA       SER  91   7.125   8.473  -0.312
  703    HB2  SER  91           HB2      SER  91   8.930   8.881   2.098
  704    HB3  SER  91           HB3      SER  91   7.183   9.230   2.135
  705    HG   SER  91           HG       SER  91   8.377   6.735   1.486
  706    H    GLY  92           H        GLY  92   9.407  10.324  -1.490
  707    HA2  GLY  92           2HA      GLY  92   9.147  12.868  -0.269
  708    HA3  GLY  92           3HA      GLY  92   9.678  12.579  -1.927
  709    H    ARG  93           H        ARG  93   7.837  14.588  -0.599
  710    HA   ARG  93           HA       ARG  93   5.909  15.690  -0.962
  711    HB2  ARG  93           HB2      ARG  93   7.245  15.543  -3.263
  712    HB3  ARG  93           HB3      ARG  93   5.782  14.723  -3.799
  713    HG2  ARG  93           HG2      ARG  93   5.973  17.498  -2.534
  714    HG3  ARG  93           HG3      ARG  93   5.717  17.150  -4.250
  715    HD2  ARG  93           2HD      ARG  93   3.567  16.036  -3.689
  716    HD3  ARG  93           3HD      ARG  93   3.811  16.456  -1.978
  717    HE   ARG  93           HE       ARG  93   4.016  18.838  -3.481
  718   HH11  ARG  93          1HH1      ARG  93   1.599  16.414  -2.624
  719   HH12  ARG  93          2HH1      ARG  93   0.260  17.536  -2.720
  720   HH21  ARG  93          1HH2      ARG  93   2.253  20.285  -3.615
  721   HH22  ARG  93          2HH2      ARG  93   0.632  19.726  -3.282
  722    H    ARG  94           H        ARG  94   5.547  13.078   0.162
  723    HA   ARG  94           HA       ARG  94   2.696  12.755  -0.479
  724    HB2  ARG  94           HB2      ARG  94   3.957  11.258  -2.033
  725    HB3  ARG  94           HB3      ARG  94   4.642  10.412  -0.634
  726    HG2  ARG  94           HG2      ARG  94   2.385   9.721   0.071
  727    HG3  ARG  94           HG3      ARG  94   1.668  10.670  -1.257
  728    HD2  ARG  94           2HD      ARG  94   2.912   9.265  -2.889
  729    HD3  ARG  94           3HD      ARG  94   3.552   8.294  -1.548
  730    HE   ARG  94           HE       ARG  94   0.761   8.296  -1.263
  731   HH11  ARG  94          1HH1      ARG  94   3.130   7.195  -3.662
  732   HH12  ARG  94          2HH1      ARG  94   2.081   5.905  -4.232
  733   HH21  ARG  94          1HH2      ARG  94  -0.551   6.590  -2.072
  734   HH22  ARG  94          2HH2      ARG  94   0.071   5.581  -3.367
  735    H    GLY  95           H        GLY  95   1.536  11.622   1.179
  736    HA2  GLY  95           2HA      GLY  95   2.495  12.146   3.836
  737    HA3  GLY  95           3HA      GLY  95   1.003  11.297   3.395
  738    H5'    A  96           H5'        A  96   8.621 -10.576   4.746
  739   H5''    A  96          H5''        A  96   7.435  -9.566   3.920
  740    H4'    A  96           H4'        A  96   8.673  -9.020   6.674
  741    H3'    A  96           H3'        A  96   6.335 -10.535   5.744
  742    H2'    A  96           H2'        A  96   4.585  -9.195   6.494
  743   HO2'    A  96          HO2'        A  96   5.494  -8.987   8.643
  744    H1'    A  96           H1'        A  96   5.554  -6.712   6.111
  745    H8     A  96           H8         A  96   7.184  -7.432   3.174
  746    H61    A  96           H61        A  96   1.959  -9.157   0.306
  747    H62    A  96           H62        A  96   3.627  -8.666   0.074
  748    H2     A  96           H2         A  96   1.206  -9.204   4.679
  749   HO5'    A  96          H5T         A  96  10.079  -8.820   4.676
  750    H5'    U  97           H5'        U  97   5.193 -12.184   6.838
  751   H5''    U  97          H5''        U  97   5.652 -13.692   7.650
  752    H4'    U  97           H4'        U  97   6.172 -14.666   5.390
  753    H3'    U  97           H3'        U  97   5.775 -12.121   4.299
  754    H2'    U  97           H2'        U  97   3.488 -11.884   4.009
  755   HO2'    U  97          HO2'        U  97   3.849 -14.353   2.691
  756    H1'    U  97           H1'        U  97   2.325 -14.292   4.808
  757    H3     U  97           H3         U  97   0.329 -12.805   8.568
  758    H5     U  97           H5         U  97   2.882  -9.670   7.434
  759    H6     U  97           H6         U  97   3.877 -11.154   5.779
  760    H5'    C  98           H5'        C  98   7.705 -11.187   2.080
  761   H5''    C  98          H5''        C  98   6.108 -11.655   1.463
  762    H4'    C  98           H4'        C  98   8.664 -11.395  -0.180
  763    H3'    C  98           H3'        C  98   7.335  -9.244   0.770
  764    H2'    C  98           H2'        C  98   5.159 -10.171   0.334
  765   HO2'    C  98          HO2'        C  98   5.903  -8.425  -1.781
  766    H1'    C  98           H1'        C  98   5.953 -10.746  -2.519
  767    H41    C  98           H41        C  98   0.393 -13.797  -2.045
  768    H42    C  98           H42        C  98   0.964 -14.725  -0.671
  769    H5     C  98           H5         C  98   3.158 -14.366   0.339
  770    H6     C  98           H6         C  98   5.201 -13.042   0.216
  771    H5'    A  99           H5'        A  99   9.805  -5.981  -1.169
  772   H5''    A  99          H5''        A  99   8.228  -6.408  -1.882
  773    H4'    A  99           H4'        A  99  10.695  -5.781  -3.553
  774    H3'    A  99           H3'        A  99   9.430  -3.871  -1.963
  775    H2'    A  99           H2'        A  99   7.293  -4.121  -3.092
  776   HO2'    A  99          HO2'        A  99   8.648  -1.940  -3.718
  777    H1'    A  99           H1'        A  99   8.968  -4.338  -5.594
  778    H8     A  99           H8         A  99   7.120  -3.491  -7.107
  779    H61    A  99           H61        A  99   2.143  -7.201  -7.023
  780    H62    A  99           H62        A  99   2.914  -5.863  -7.839
  781    H2     A  99           H2         A  99   4.743  -8.271  -3.575
  782    H5'    A 100           H5'        A 100  13.172  -3.324  -3.726
  783   H5''    A 100          H5''        A 100  14.098  -1.851  -3.476
  784    H4'    A 100           H4'        A 100  14.754  -3.205  -5.544
  785    H3'    A 100           H3'        A 100  14.772  -0.496  -5.086
  786    H2'    A 100           H2'        A 100  12.610  -0.148  -6.036
  787   HO2'    A 100          HO2'        A 100  14.494   0.154  -8.163
  788    H1'    A 100           H1'        A 100  13.407  -1.946  -8.323
  789    H8     A 100           H8         A 100  10.360  -1.785  -5.932
  790    H61    A 100           H61        A 100   7.164  -0.038 -10.980
  791    H62    A 100           H62        A 100   7.034  -0.481  -9.289
  792    H2     A 100           H2         A 100  11.447  -0.378 -12.086
  793    H5'    A 101           H5'        A 101  16.396   1.229  -7.084
  794   H5''    A 101          H5''        A 101  17.889   0.600  -7.800
  795    H4'    A 101           H4'        A 101  18.048   2.983  -7.393
  796    H3'    A 101           H3'        A 101  20.016   1.185  -6.821
  797   HO3'    A 101          H3T         A 101  21.294   3.120  -6.399
  798    H2'    A 101           H2'        A 101  19.492   0.832  -4.566
  799   HO2'    A 101          HO2'        A 101  20.951   2.080  -3.305
  800    H1'    A 101           H1'        A 101  18.972   3.760  -4.085
  801    H8     A 101           H8         A 101  17.867   0.093  -3.534
  802    H61    A 101           H61        A 101  15.801   2.104   1.970
  803    H62    A 101           H62        A 101  16.046   0.689   0.966
  804    H2     A 101           H2         A 101  17.165   5.618  -0.358
  Start of MODEL   20
    1    H1   MET   1           H1       MET   1  -1.395   4.580   1.118
    2    H2   MET   1           H2       MET   1  -0.810   3.098   0.694
    3    H3   MET   1           H3       MET   1  -2.419   3.427   0.551
    4    HA   MET   1           HA       MET   1  -2.000   5.068  -1.144
    5    HB2  MET   1           HB2      MET   1   0.260   5.687  -0.279
    6    HB3  MET   1           HB3      MET   1   0.893   4.154  -0.911
    7    HG2  MET   1           HG2      MET   1   1.294   6.001  -2.484
    8    HG3  MET   1           HG3      MET   1   0.199   4.806  -3.188
    9    HE1  MET   1           HE1      MET   1  -0.952   8.218  -4.757
   10    HE2  MET   1           HE2      MET   1   0.703   7.702  -4.344
   11    HE3  MET   1           HE3      MET   1  -0.434   6.553  -5.092
   12    H    VAL   2           H        VAL   2  -3.103   4.091  -2.693
   13    HA   VAL   2           HA       VAL   2  -2.146   1.458  -3.651
   14    HB   VAL   2           HB       VAL   2  -4.467   1.494  -3.034
   15   HG11  VAL   2          1HG1      VAL   2  -4.909   3.703  -5.083
   16   HG12  VAL   2          HG21      VAL   2  -6.145   2.882  -4.112
   17   HG13  VAL   2          HG31      VAL   2  -4.956   3.929  -3.318
   18   HG21  VAL   2          HG32      VAL   2  -4.154   1.550  -6.055
   19   HG22  VAL   2          1HG2      VAL   2  -3.754   0.180  -4.995
   20   HG23  VAL   2          HG22      VAL   2  -5.443   0.733  -5.140
   21    H    GLU   3           H        GLU   3  -0.634   1.620  -5.135
   22    HA   GLU   3           HA       GLU   3  -0.949   3.648  -7.288
   23    HB2  GLU   3           HB2      GLU   3   1.479   4.110  -7.112
   24    HB3  GLU   3           HB3      GLU   3   0.542   4.641  -5.711
   25    HG2  GLU   3           HG2      GLU   3   1.221   2.425  -4.587
   26    HG3  GLU   3           HG3      GLU   3   2.368   2.217  -5.916
   27    H    ALA   4           H        ALA   4  -0.552   3.009  -9.234
   28    HA   ALA   4           HA       ALA   4   0.971   0.515  -9.782
   29    HB1  ALA   4           1HB      ALA   4  -1.819   1.168 -10.823
   30    HB2  ALA   4           HB2      ALA   4  -0.803  -0.199 -11.334
   31    HB3  ALA   4           HB3      ALA   4  -1.413  -0.122  -9.666
   32    H    ASP   5           H        ASP   5   2.571   1.225 -10.923
   33    HA   ASP   5           HA       ASP   5   2.595   3.620 -12.483
   34    HB2  ASP   5           HB2      ASP   5   4.560   2.608 -11.420
   35    HB3  ASP   5           HB3      ASP   5   4.415   1.187 -12.449
   36    H    ARG   6           H        ARG   6   3.343   3.413 -14.924
   37    HA   ARG   6           HA       ARG   6   1.001   2.925 -16.315
   38    HB2  ARG   6           HB2      ARG   6   3.855   3.020 -17.358
   39    HB3  ARG   6           HB3      ARG   6   2.400   3.163 -18.363
   40    HG2  ARG   6           HG2      ARG   6   1.696   5.162 -17.071
   41    HG3  ARG   6           HG3      ARG   6   3.168   5.042 -16.087
   42    HD2  ARG   6           2HD      ARG   6   3.091   5.412 -19.112
   43    HD3  ARG   6           3HD      ARG   6   3.365   6.706 -17.935
   44    HE   ARG   6           HE       ARG   6   5.281   4.776 -17.339
   45   HH11  ARG   6          1HH1      ARG   6   4.429   6.750 -20.146
   46   HH12  ARG   6          2HH1      ARG   6   6.066   6.790 -20.761
   47   HH21  ARG   6          1HH2      ARG   6   7.408   4.841 -18.173
   48   HH22  ARG   6          2HH2      ARG   6   7.742   5.729 -19.643
   49    HA   PRO   7           HA       PRO   7   0.493  -1.338 -17.310
   50    HB2  PRO   7           HB2      PRO   7   0.168  -0.202 -20.087
   51    HB3  PRO   7           HB3      PRO   7  -0.848  -1.454 -19.300
   52    HG2  PRO   7           HG2      PRO   7  -1.709   1.068 -19.434
   53    HG3  PRO   7           HG3      PRO   7  -1.813   0.221 -17.845
   54    HD2  PRO   7           2HD      PRO   7   0.270   2.212 -18.791
   55    HD3  PRO   7           3HD      PRO   7  -0.547   2.101 -17.201
   56    H    GLY   8           H        GLY   8   1.557  -3.132 -18.371
   57    HA2  GLY   8           2HA      GLY   8   2.929  -4.067 -20.037
   58    HA3  GLY   8           3HA      GLY   8   3.660  -2.469 -20.336
   59    H    LYS   9           H        LYS   9   3.632  -2.340 -17.120
   60    HA   LYS   9           HA       LYS   9   6.311  -3.595 -16.987
   61    HB2  LYS   9           HB2      LYS   9   6.208  -1.208 -16.403
   62    HB3  LYS   9           HB3      LYS   9   5.043  -1.592 -15.105
   63    HG2  LYS   9           HG2      LYS   9   6.712  -3.153 -14.099
   64    HG3  LYS   9           HG3      LYS   9   7.864  -2.752 -15.383
   65    HD2  LYS   9           2HD      LYS   9   6.683  -0.739 -13.432
   66    HD3  LYS   9           3HD      LYS   9   8.236  -1.578 -13.204
   67    HE2  LYS   9           HE2      LYS   9   9.112  -0.607 -15.273
   68    HE3  LYS   9           HE3      LYS   9   7.546   0.145 -15.628
   69    HZ1  LYS   9           3HZ      LYS   9   7.776   1.512 -13.728
   70    HZ2  LYS   9           1HZ      LYS   9   9.166   0.761 -13.251
   71    HZ3  LYS   9           2HZ      LYS   9   9.137   1.670 -14.628
   72    H    LEU  10           H        LEU  10   6.645  -5.377 -15.856
   73    HA   LEU  10           HA       LEU  10   4.357  -6.405 -14.236
   74    HB2  LEU  10           HB2      LEU  10   6.488  -7.783 -15.879
   75    HB3  LEU  10           HB3      LEU  10   5.404  -8.670 -14.867
   76    HG   LEU  10           HG       LEU  10   4.602  -6.974 -17.279
   77   HD11  LEU  10          1HD1      LEU  10   4.384  -9.972 -16.722
   78   HD12  LEU  10          2HD1      LEU  10   4.180  -9.156 -18.287
   79   HD13  LEU  10          3HD1      LEU  10   5.791  -9.248 -17.522
   80   HD21  LEU  10          3HD2      LEU  10   2.910  -8.597 -15.353
   81   HD22  LEU  10          1HD2      LEU  10   2.787  -6.843 -15.705
   82   HD23  LEU  10          2HD2      LEU  10   2.364  -8.041 -16.950
   83    H    PHE  11           H        PHE  11   4.805  -7.516 -12.342
   84    HA   PHE  11           HA       PHE  11   7.498  -7.086 -11.138
   85    HB2  PHE  11           HB2      PHE  11   5.766  -6.080  -9.815
   86    HB3  PHE  11           HB3      PHE  11   4.722  -7.496  -9.974
   87    HD1  PHE  11           HD1      PHE  11   8.024  -6.404  -8.590
   88    HD2  PHE  11           HD2      PHE  11   4.795  -9.238  -8.386
   89    HE1  PHE  11           HE1      PHE  11   8.967  -7.338  -6.494
   90    HE2  PHE  11           HE2      PHE  11   5.772 -10.192  -6.304
   91    HZ   PHE  11           HZ       PHE  11   7.867  -9.230  -5.373
   92    H    ILE  12           H        ILE  12   8.738  -8.842 -10.786
   93    HA   ILE  12           HA       ILE  12   7.487 -11.508 -11.247
   94    HB   ILE  12           HB       ILE  12  10.358 -10.848 -11.897
   95   HG12  ILE  12          HG21      ILE  12   9.182  -9.223 -13.256
   96   HG13  ILE  12          HG31      ILE  12   9.843 -10.526 -14.233
   97   HG21  ILE  12          1HG2      ILE  12   8.343 -12.885 -12.908
   98   HG22  ILE  12          HG22      ILE  12  10.047 -12.772 -13.413
   99   HG23  ILE  12          HG32      ILE  12   9.627 -13.186 -11.724
  100   HD11  ILE  12          3HD1      ILE  12   6.922 -10.114 -13.486
  101   HD12  ILE  12          1HD1      ILE  12   7.681  -9.955 -15.087
  102   HD13  ILE  12          2HD1      ILE  12   7.539 -11.553 -14.326
  103    H    GLY  13           H        GLY  13   7.159 -11.689  -8.914
  104    HA2  GLY  13           2HA      GLY  13   9.621 -11.610  -7.258
  105    HA3  GLY  13           3HA      GLY  13   7.974 -11.727  -6.661
  106    H    GLY  14           H        GLY  14  10.541 -13.434  -6.277
  107    HA2  GLY  14           2HA      GLY  14  10.308 -15.574  -5.241
  108    HA3  GLY  14           3HA      GLY  14   9.025 -15.991  -6.397
  109    H    LEU  15           H        LEU  15  11.653 -14.349  -7.839
  110    HA   LEU  15           HA       LEU  15  12.301 -16.588  -9.509
  111    HB2  LEU  15           HB2      LEU  15  13.761 -13.961  -9.019
  112    HB3  LEU  15           HB3      LEU  15  14.068 -15.105 -10.350
  113    HG   LEU  15           HG       LEU  15  11.315 -13.914 -10.014
  114   HD11  LEU  15          1HD1      LEU  15  12.076 -12.211 -11.691
  115   HD12  LEU  15          2HD1      LEU  15  12.871 -12.015 -10.104
  116   HD13  LEU  15          3HD1      LEU  15  13.750 -12.765 -11.455
  117   HD21  LEU  15          3HD2      LEU  15  11.237 -14.463 -12.401
  118   HD22  LEU  15          1HD2      LEU  15  12.978 -14.834 -12.395
  119   HD23  LEU  15          2HD2      LEU  15  11.844 -15.896 -11.526
  120    H    ASN  16           H        ASN  16  14.458 -17.494  -9.840
  121    HA   ASN  16           HA       ASN  16  15.597 -18.485  -7.399
  122    HB2  ASN  16           HB2      ASN  16  15.244 -19.679  -9.572
  123    HB3  ASN  16           HB3      ASN  16  16.562 -18.710 -10.258
  124   HD21  ASN  16          2HD2      ASN  16  17.468 -20.823 -10.713
  125   HD22  ASN  16          1HD2      ASN  16  18.218 -21.761  -9.474
  126    H    THR  17           H        THR  17  17.862 -18.238  -6.777
  127    HA   THR  17           HA       THR  17  18.883 -15.552  -6.970
  128    HB   THR  17           HB       THR  17  20.752 -16.458  -5.663
  129    HG1  THR  17           1HG      THR  17  20.952 -18.479  -6.663
  130   HG21  THR  17          1HG2      THR  17  19.492 -17.310  -3.744
  131   HG22  THR  17          HG22      THR  17  18.560 -16.009  -4.529
  132   HG23  THR  17          HG32      THR  17  18.115 -17.714  -4.793
  133    H    GLU  18           H        GLU  18  18.883 -18.107  -9.109
  134    HA   GLU  18           HA       GLU  18  21.598 -17.659 -10.185
  135    HB2  GLU  18           HB2      GLU  18  19.576 -19.743 -11.019
  136    HB3  GLU  18           HB3      GLU  18  21.339 -19.812 -11.176
  137    HG2  GLU  18           HG2      GLU  18  19.761 -19.885  -8.558
  138    HG3  GLU  18           HG3      GLU  18  20.426 -21.286  -9.351
  139    H    THR  19           H        THR  19  18.381 -16.661 -10.644
  140    HA   THR  19           HA       THR  19  18.418 -16.522 -13.557
  141    HB   THR  19           HB       THR  19  16.523 -15.304 -11.515
  142    HG1  THR  19           1HG      THR  19  15.257 -17.115 -12.103
  143   HG21  THR  19          1HG2      THR  19  16.334 -14.223 -13.721
  144   HG22  THR  19          HG22      THR  19  16.248 -15.822 -14.506
  145   HG23  THR  19          HG32      THR  19  14.933 -15.275 -13.443
  146    H    ASN  20           H        ASN  20  18.660 -14.677 -14.800
  147    HA   ASN  20           HA       ASN  20  19.278 -12.141 -13.390
  148    HB2  ASN  20           HB2      ASN  20  20.834 -12.690 -15.840
  149    HB3  ASN  20           HB3      ASN  20  21.299 -11.791 -14.392
  150   HD21  ASN  20          2HD2      ASN  20  21.206 -14.882 -16.012
  151   HD22  ASN  20          1HD2      ASN  20  22.198 -15.753 -14.859
  152    H    GLU  21           H        GLU  21  19.848 -10.680 -15.672
  153    HA   GLU  21           HA       GLU  21  17.144 -10.081 -16.461
  154    HB2  GLU  21           HB2      GLU  21  19.843  -9.020 -17.358
  155    HB3  GLU  21           HB3      GLU  21  18.282  -8.332 -17.859
  156    HG2  GLU  21           HG2      GLU  21  17.693  -7.809 -15.564
  157    HG3  GLU  21           HG3      GLU  21  19.040  -8.758 -14.957
  158    H    LYS  22           H        LYS  22  19.886 -11.764 -18.050
  159    HA   LYS  22           HA       LYS  22  18.762 -11.640 -20.682
  160    HB2  LYS  22           HB2      LYS  22  21.124 -12.001 -20.288
  161    HB3  LYS  22           HB3      LYS  22  20.802 -13.500 -19.400
  162    HG2  LYS  22           HG2      LYS  22  21.597 -13.873 -21.732
  163    HG3  LYS  22           HG3      LYS  22  20.019 -14.610 -21.399
  164    HD2  LYS  22           2HD      LYS  22  18.872 -12.754 -22.515
  165    HD3  LYS  22           3HD      LYS  22  20.417 -11.920 -22.780
  166    HE2  LYS  22           HE2      LYS  22  19.662 -14.654 -23.896
  167    HE3  LYS  22           HE3      LYS  22  19.581 -13.133 -24.796
  168    HZ1  LYS  22           3HZ      LYS  22  22.029 -14.318 -23.667
  169    HZ2  LYS  22           1HZ      LYS  22  21.611 -14.294 -25.256
  170    HZ3  LYS  22           2HZ      LYS  22  21.950 -12.891 -24.477
  171    H    ALA  23           H        ALA  23  18.209 -13.754 -17.926
  172    HA   ALA  23           HA       ALA  23  16.915 -15.827 -19.580
  173    HB1  ALA  23           1HB      ALA  23  16.514 -16.900 -17.381
  174    HB2  ALA  23           HB2      ALA  23  18.218 -16.457 -17.581
  175    HB3  ALA  23           HB3      ALA  23  17.155 -15.459 -16.558
  176    H    LEU  24           H        LEU  24  16.205 -12.893 -17.941
  177    HA   LEU  24           HA       LEU  24  13.368 -13.401 -17.514
  178    HB2  LEU  24           HB2      LEU  24  15.566 -11.612 -16.703
  179    HB3  LEU  24           HB3      LEU  24  14.146 -10.661 -17.030
  180    HG   LEU  24           HG       LEU  24  14.183 -13.177 -15.325
  181   HD11  LEU  24          1HD1      LEU  24  15.668 -11.504 -14.311
  182   HD12  LEU  24          2HD1      LEU  24  14.391 -10.267 -14.448
  183   HD13  LEU  24          3HD1      LEU  24  14.170 -11.663 -13.361
  184   HD21  LEU  24          3HD2      LEU  24  11.975 -12.435 -16.187
  185   HD22  LEU  24          1HD2      LEU  24  12.060 -12.290 -14.415
  186   HD23  LEU  24          2HD2      LEU  24  12.214 -10.839 -15.439
  187    H    GLU  25           H        GLU  25  15.541 -11.779 -19.770
  188    HA   GLU  25           HA       GLU  25  13.347 -10.529 -21.219
  189    HB2  GLU  25           HB2      GLU  25  16.289 -11.059 -21.902
  190    HB3  GLU  25           HB3      GLU  25  15.164 -10.222 -23.001
  191    HG2  GLU  25           HG2      GLU  25  14.663  -8.610 -21.228
  192    HG3  GLU  25           HG3      GLU  25  15.900  -9.348 -20.195
  193    H    ALA  26           H        ALA  26  15.046 -13.531 -21.157
  194    HA   ALA  26           HA       ALA  26  14.346 -14.392 -23.851
  195    HB1  ALA  26           1HB      ALA  26  15.564 -15.823 -21.464
  196    HB2  ALA  26           HB2      ALA  26  15.471 -16.483 -23.117
  197    HB3  ALA  26           HB3      ALA  26  16.452 -15.028 -22.790
  198    H    VAL  27           H        VAL  27  12.908 -14.536 -20.677
  199    HA   VAL  27           HA       VAL  27  11.193 -16.837 -21.426
  200    HB   VAL  27           HB       VAL  27  12.642 -16.731 -19.415
  201   HG11  VAL  27          1HG1      VAL  27  10.478 -14.984 -18.261
  202   HG12  VAL  27          HG21      VAL  27  11.998 -15.521 -17.489
  203   HG13  VAL  27          HG31      VAL  27  12.063 -14.365 -18.845
  204   HG21  VAL  27          HG32      VAL  27  10.760 -18.328 -19.568
  205   HG22  VAL  27          1HG2      VAL  27  10.916 -17.698 -17.902
  206   HG23  VAL  27          HG22      VAL  27   9.639 -17.066 -18.975
  207    H    PHE  28           H        PHE  28  11.057 -13.441 -20.370
  208    HA   PHE  28           HA       PHE  28   8.112 -13.487 -20.700
  209    HB2  PHE  28           HB2      PHE  28   9.997 -11.311 -19.765
  210    HB3  PHE  28           HB3      PHE  28   8.253 -11.102 -20.012
  211    HD1  PHE  28           HD2      PHE  28   6.602 -12.254 -18.611
  212    HD2  PHE  28           HD1      PHE  28  10.814 -12.570 -17.865
  213    HE1  PHE  28           HE2      PHE  28   6.133 -13.170 -16.359
  214    HE2  PHE  28           HE1      PHE  28  10.358 -13.509 -15.621
  215    HZ   PHE  28           HZ       PHE  28   8.008 -13.791 -14.853
  216    H    GLY  29           H        GLY  29  10.872 -12.972 -22.639
  217    HA2  GLY  29           2HA      GLY  29   9.639 -11.061 -24.460
  218    HA3  GLY  29           3HA      GLY  29  11.100 -12.023 -24.771
  219    H    LYS  30           H        LYS  30   8.916 -14.198 -23.671
  220    HA   LYS  30           HA       LYS  30   8.358 -15.283 -26.311
  221    HB2  LYS  30           HB2      LYS  30   7.598 -16.186 -23.490
  222    HB3  LYS  30           HB3      LYS  30   7.510 -17.181 -24.958
  223    HG2  LYS  30           HG2      LYS  30   9.928 -17.007 -25.245
  224    HG3  LYS  30           HG3      LYS  30  10.072 -15.923 -23.861
  225    HD2  LYS  30           2HD      LYS  30  10.749 -18.218 -23.257
  226    HD3  LYS  30           3HD      LYS  30   9.392 -17.628 -22.297
  227    HE2  LYS  30           HE2      LYS  30   8.992 -19.924 -22.904
  228    HE3  LYS  30           HE3      LYS  30   7.813 -18.878 -23.710
  229    HZ1  LYS  30           3HZ      LYS  30  10.247 -19.999 -24.956
  230    HZ2  LYS  30           1HZ      LYS  30   8.718 -20.536 -25.209
  231    HZ3  LYS  30           2HZ      LYS  30   9.151 -19.039 -25.717
  232    H    TYR  31           H        TYR  31   6.862 -13.138 -24.199
  233    HA   TYR  31           HA       TYR  31   4.139 -13.778 -25.241
  234    HB2  TYR  31           HB2      TYR  31   5.030 -12.266 -22.773
  235    HB3  TYR  31           HB3      TYR  31   3.354 -12.564 -23.237
  236    HD1  TYR  31           HD2      TYR  31   2.653 -15.069 -23.429
  237    HD2  TYR  31           HD1      TYR  31   6.243 -13.746 -21.476
  238    HE1  TYR  31           HE2      TYR  31   2.831 -17.264 -22.284
  239    HE2  TYR  31           HE1      TYR  31   6.432 -15.950 -20.311
  240    HH   TYR  31           HH       TYR  31   5.585 -18.106 -20.176
  241    H    GLY  32           H        GLY  32   6.684 -11.360 -25.308
  242    HA2  GLY  32           2HA      GLY  32   5.327  -9.757 -27.238
  243    HA3  GLY  32           3HA      GLY  32   5.198  -8.995 -25.629
  244    H    ARG  33           H        ARG  33   6.422  -7.694 -27.712
  245    HA   ARG  33           HA       ARG  33   9.266  -8.110 -27.614
  246    HB2  ARG  33           HB2      ARG  33   7.671  -6.990 -29.416
  247    HB3  ARG  33           HB3      ARG  33   7.963  -5.520 -28.465
  248    HG2  ARG  33           HG2      ARG  33  10.420  -5.890 -28.704
  249    HG3  ARG  33           HG3      ARG  33  10.064  -7.400 -29.586
  250    HD2  ARG  33           2HD      ARG  33   8.833  -6.069 -31.302
  251    HD3  ARG  33           3HD      ARG  33   9.276  -4.589 -30.453
  252    HE   ARG  33           HE       ARG  33  11.016  -6.326 -32.088
  253   HH11  ARG  33          1HH1      ARG  33  10.837  -3.579 -29.853
  254   HH12  ARG  33          2HH1      ARG  33  12.433  -3.000 -30.260
  255   HH21  ARG  33          1HH2      ARG  33  13.086  -5.532 -32.602
  256   HH22  ARG  33          2HH2      ARG  33  13.695  -4.091 -31.826
  257    H    ILE  34           H        ILE  34  10.457  -7.680 -25.967
  258    HA   ILE  34           HA       ILE  34   9.580  -5.996 -23.758
  259    HB   ILE  34           HB       ILE  34  12.169  -7.453 -24.368
  260   HG12  ILE  34          HG21      ILE  34   9.750  -8.009 -22.587
  261   HG13  ILE  34          HG31      ILE  34  10.229  -8.898 -24.040
  262   HG21  ILE  34          1HG2      ILE  34  11.310  -6.089 -21.779
  263   HG22  ILE  34          HG22      ILE  34  12.794  -7.042 -22.040
  264   HG23  ILE  34          HG32      ILE  34  12.591  -5.513 -22.878
  265   HD11  ILE  34          3HD1      ILE  34  12.335  -9.576 -22.910
  266   HD12  ILE  34          1HD1      ILE  34  11.763  -8.787 -21.414
  267   HD13  ILE  34          2HD1      ILE  34  10.870 -10.166 -22.084
  268    H    VAL  35           H        VAL  35  10.234  -4.003 -23.154
  269    HA   VAL  35           HA       VAL  35  11.999  -2.531 -25.052
  270    HB   VAL  35           HB       VAL  35  10.601  -0.705 -23.369
  271   HG11  VAL  35          1HG1      VAL  35  10.310  -1.415 -26.310
  272   HG12  VAL  35          HG21      VAL  35   9.755   0.092 -25.537
  273   HG13  VAL  35          HG31      VAL  35  11.490  -0.285 -25.613
  274   HG21  VAL  35          HG32      VAL  35   8.710  -2.649 -24.758
  275   HG22  VAL  35          1HG2      VAL  35   8.827  -2.366 -23.005
  276   HG23  VAL  35          HG22      VAL  35   8.271  -1.070 -24.083
  277    H    GLU  36           H        GLU  36  11.517  -3.628 -21.780
  278    HA   GLU  36           HA       GLU  36  14.228  -2.835 -21.072
  279    HB2  GLU  36           HB2      GLU  36  12.946  -0.741 -20.630
  280    HB3  GLU  36           HB3      GLU  36  11.842  -1.647 -19.574
  281    HG2  GLU  36           HG2      GLU  36  13.665  -2.166 -18.042
  282    HG3  GLU  36           HG3      GLU  36  14.842  -1.445 -19.156
  283    H    VAL  37           H        VAL  37  14.999  -4.046 -19.289
  284    HA   VAL  37           HA       VAL  37  12.992  -5.585 -17.762
  285    HB   VAL  37           HB       VAL  37  15.192  -6.759 -19.422
  286   HG11  VAL  37          1HG1      VAL  37  14.373  -7.922 -16.724
  287   HG12  VAL  37          HG21      VAL  37  15.343  -8.737 -17.969
  288   HG13  VAL  37          HG31      VAL  37  15.992  -7.302 -17.159
  289   HG21  VAL  37          HG32      VAL  37  12.506  -7.729 -18.329
  290   HG22  VAL  37          1HG2      VAL  37  12.792  -7.062 -19.956
  291   HG23  VAL  37          HG22      VAL  37  13.509  -8.622 -19.473
  292    H    LEU  38           H        LEU  38  13.462  -5.954 -15.698
  293    HA   LEU  38           HA       LEU  38  15.975  -4.764 -14.537
  294    HB2  LEU  38           HB2      LEU  38  13.094  -4.573 -13.954
  295    HB3  LEU  38           HB3      LEU  38  14.116  -4.715 -12.531
  296    HG   LEU  38           HG       LEU  38  14.624  -2.633 -14.704
  297   HD11  LEU  38          1HD1      LEU  38  13.159  -2.370 -12.049
  298   HD12  LEU  38          2HD1      LEU  38  13.590  -1.026 -13.136
  299   HD13  LEU  38          3HD1      LEU  38  12.410  -2.251 -13.660
  300   HD21  LEU  38          3HD2      LEU  38  15.954  -1.540 -12.956
  301   HD22  LEU  38          1HD2      LEU  38  15.554  -2.847 -11.822
  302   HD23  LEU  38          2HD2      LEU  38  16.567  -3.178 -13.256
  303    H    LEU  39           H        LEU  39  16.863  -5.901 -12.800
  304    HA   LEU  39           HA       LEU  39  15.451  -8.215 -11.784
  305    HB2  LEU  39           HB2      LEU  39  16.681  -9.103 -13.738
  306    HB3  LEU  39           HB3      LEU  39  18.183  -8.393 -13.141
  307    HG   LEU  39           HG       LEU  39  17.851 -10.876 -12.920
  308   HD11  LEU  39          1HD1      LEU  39  18.481  -9.385 -10.350
  309   HD12  LEU  39          2HD1      LEU  39  19.003 -11.019 -10.774
  310   HD13  LEU  39          3HD1      LEU  39  19.586  -9.625 -11.738
  311   HD21  LEU  39          3HD2      LEU  39  16.158 -10.162 -10.505
  312   HD22  LEU  39          1HD2      LEU  39  15.546 -10.841 -12.042
  313   HD23  LEU  39          2HD2      LEU  39  16.682 -11.782 -11.056
  314    H    MET  40           H        MET  40  15.712  -8.025  -9.586
  315    HA   MET  40           HA       MET  40  17.632  -5.935  -8.785
  316    HB2  MET  40           HB2      MET  40  15.510  -7.202  -7.022
  317    HB3  MET  40           HB3      MET  40  16.307  -5.643  -6.836
  318    HG2  MET  40           HG2      MET  40  14.043  -6.474  -8.586
  319    HG3  MET  40           HG3      MET  40  14.249  -5.009  -7.638
  320    HE1  MET  40           HE3      MET  40  16.775  -3.088 -10.115
  321    HE2  MET  40           HE1      MET  40  15.814  -2.840  -8.624
  322    HE3  MET  40           HE2      MET  40  17.110  -4.059  -8.646
  323    H    LYS  41           H        LYS  41  19.326  -6.238  -7.291
  324    HA   LYS  41           HA       LYS  41  19.508  -8.959  -6.185
  325    HB2  LYS  41           HB2      LYS  41  22.118  -7.932  -7.090
  326    HB3  LYS  41           HB3      LYS  41  21.394  -9.560  -7.072
  327    HG2  LYS  41           HG2      LYS  41  20.234  -9.164  -9.129
  328    HG3  LYS  41           HG3      LYS  41  20.671  -7.431  -9.125
  329    HD2  LYS  41           2HD      LYS  41  23.054  -8.015  -9.275
  330    HD3  LYS  41           3HD      LYS  41  22.650  -9.747  -9.301
  331    HE2  LYS  41           HE2      LYS  41  21.419  -9.459 -11.391
  332    HE3  LYS  41           HE3      LYS  41  21.704  -7.705 -11.344
  333    HZ1  LYS  41           3HZ      LYS  41  24.048  -8.149 -11.522
  334    HZ2  LYS  41           1HZ      LYS  41  23.793  -9.771 -11.554
  335    HZ3  LYS  41           2HZ      LYS  41  23.249  -8.828 -12.787
  336    H    ASP  42           H        ASP  42  21.053  -9.255  -4.500
  337    HA   ASP  42           HA       ASP  42  20.959  -7.290  -2.467
  338    HB2  ASP  42           HB2      ASP  42  21.244  -9.832  -2.324
  339    HB3  ASP  42           HB3      ASP  42  22.938  -9.565  -2.750
  340    H    ARG  43           H        ARG  43  22.644  -5.974  -1.566
  341    HA   ARG  43           HA       ARG  43  24.452  -4.970  -3.666
  342    HB2  ARG  43           HB2      ARG  43  24.615  -2.980  -2.310
  343    HB3  ARG  43           HB3      ARG  43  22.918  -3.421  -2.588
  344    HG2  ARG  43           HG2      ARG  43  22.830  -4.459  -0.321
  345    HG3  ARG  43           HG3      ARG  43  24.513  -3.961  -0.042
  346    HD2  ARG  43           2HD      ARG  43  22.209  -2.087  -0.696
  347    HD3  ARG  43           3HD      ARG  43  22.823  -2.386   0.939
  348    HE   ARG  43           HE       ARG  43  24.037  -0.722  -1.134
  349   HH11  ARG  43          1HH1      ARG  43  24.618  -2.539   1.843
  350   HH12  ARG  43          2HH1      ARG  43  26.053  -1.627   2.258
  351   HH21  ARG  43          1HH2      ARG  43  25.923   0.438  -0.579
  352   HH22  ARG  43          2HH2      ARG  43  26.786   0.053   0.893
  353    H    GLU  44           H        GLU  44  24.726  -7.208  -1.242
  354    HA   GLU  44           HA       GLU  44  27.637  -6.612  -0.896
  355    HB2  GLU  44           HB2      GLU  44  25.686  -7.917   1.031
  356    HB3  GLU  44           HB3      GLU  44  27.441  -7.829   1.270
  357    HG2  GLU  44           HG2      GLU  44  27.313  -5.340   1.182
  358    HG3  GLU  44           HG3      GLU  44  25.551  -5.456   1.024
  359    H    THR  45           H        THR  45  25.277  -8.856  -2.087
  360    HA   THR  45           HA       THR  45  27.452 -10.889  -2.358
  361    HB   THR  45           HB       THR  45  25.908 -12.663  -2.040
  362    HG1  THR  45           1HG      THR  45  23.680 -12.225  -1.786
  363   HG21  THR  45          1HG2      THR  45  25.091 -10.516  -0.052
  364   HG22  THR  45          HG22      THR  45  25.048 -12.283   0.199
  365   HG23  THR  45          HG32      THR  45  26.612 -11.447   0.046
  366    H    ASN  46           H        ASN  46  25.087  -8.904  -3.873
  367    HA   ASN  46           HA       ASN  46  24.525  -8.598  -6.033
  368    HB2  ASN  46           HB2      ASN  46  27.139  -8.608  -5.880
  369    HB3  ASN  46           HB3      ASN  46  27.007 -10.074  -6.859
  370   HD21  ASN  46          2HD2      ASN  46  28.338  -8.473  -8.274
  371   HD22  ASN  46          1HD2      ASN  46  27.397  -7.558  -9.435
  372    H    LYS  47           H        LYS  47  23.812 -11.225  -4.696
  373    HA   LYS  47           HA       LYS  47  23.561 -13.230  -6.786
  374    HB2  LYS  47           HB2      LYS  47  22.352 -12.828  -4.028
  375    HB3  LYS  47           HB3      LYS  47  21.965 -14.218  -5.044
  376    HG2  LYS  47           HG2      LYS  47  24.780 -13.478  -4.138
  377    HG3  LYS  47           HG3      LYS  47  23.742 -14.699  -3.375
  378    HD2  LYS  47           2HD      LYS  47  23.642 -15.939  -5.538
  379    HD3  LYS  47           3HD      LYS  47  24.784 -14.762  -6.240
  380    HE2  LYS  47           HE2      LYS  47  26.440 -15.331  -4.497
  381    HE3  LYS  47           HE3      LYS  47  25.312 -16.509  -3.806
  382    HZ1  LYS  47           3HZ      LYS  47  26.429 -16.618  -6.529
  383    HZ2  LYS  47           1HZ      LYS  47  26.891 -17.559  -5.263
  384    HZ3  LYS  47           2HZ      LYS  47  25.381 -17.706  -5.882
  385    H    SER  48           H        SER  48  20.686 -12.747  -5.151
  386    HA   SER  48           HA       SER  48  19.478 -10.866  -7.059
  387    HB2  SER  48           HB2      SER  48  19.255 -13.154  -8.148
  388    HB3  SER  48           HB3      SER  48  18.304 -13.651  -6.745
  389    HG   SER  48           HG       SER  48  17.036 -12.844  -8.500
  390    H    ARG  49           H        ARG  49  17.677  -9.845  -6.160
  391    HA   ARG  49           HA       ARG  49  17.180 -10.143  -3.298
  392    HB2  ARG  49           HB2      ARG  49  15.728  -8.651  -5.512
  393    HB3  ARG  49           HB3      ARG  49  15.390  -8.445  -3.784
  394    HG2  ARG  49           HG2      ARG  49  18.177  -8.004  -4.861
  395    HG3  ARG  49           HG3      ARG  49  16.954  -6.744  -5.058
  396    HD2  ARG  49           2HD      ARG  49  17.798  -7.935  -2.393
  397    HD3  ARG  49           3HD      ARG  49  18.355  -6.393  -3.097
  398    HE   ARG  49           HE       ARG  49  15.761  -6.928  -1.848
  399   HH11  ARG  49          1HH1      ARG  49  17.662  -4.834  -3.959
  400   HH12  ARG  49          2HH1      ARG  49  16.612  -3.461  -3.763
  401   HH21  ARG  49          1HH2      ARG  49  14.371  -5.105  -1.606
  402   HH22  ARG  49          2HH2      ARG  49  14.738  -3.620  -2.441
  403    H    GLY  50           H        GLY  50  16.263 -11.786  -6.097
  404    HA2  GLY  50           2HA      GLY  50  14.828 -13.604  -6.304
  405    HA3  GLY  50           3HA      GLY  50  14.120 -13.236  -4.717
  406    H    PHE  51           H        PHE  51  14.108 -10.300  -6.370
  407    HA   PHE  51           HA       PHE  51  11.634 -10.961  -7.858
  408    HB2  PHE  51           HB2      PHE  51  10.393  -9.203  -6.988
  409    HB3  PHE  51           HB3      PHE  51  11.036 -10.074  -5.606
  410    HD1  PHE  51           HD1      PHE  51  12.994  -9.061  -4.313
  411    HD2  PHE  51           HD2      PHE  51  10.833  -6.877  -7.330
  412    HE1  PHE  51           HE1      PHE  51  13.828  -6.919  -3.379
  413    HE2  PHE  51           HE2      PHE  51  11.625  -4.755  -6.361
  414    HZ   PHE  51           HZ       PHE  51  13.138  -4.757  -4.421
  415    H    ALA  52           H        ALA  52  11.039  -9.351  -9.464
  416    HA   ALA  52           HA       ALA  52  13.180  -7.573 -10.399
  417    HB1  ALA  52           1HB      ALA  52  12.328 -10.078 -11.919
  418    HB2  ALA  52           HB2      ALA  52  13.468  -8.858 -12.505
  419    HB3  ALA  52           HB3      ALA  52  13.888  -9.863 -11.090
  420    H    PHE  53           H        PHE  53  12.510  -6.958 -12.846
  421    HA   PHE  53           HA       PHE  53   9.577  -6.732 -13.078
  422    HB2  PHE  53           HB2      PHE  53  11.456  -4.325 -13.083
  423    HB3  PHE  53           HB3      PHE  53   9.754  -4.279 -13.468
  424    HD1  PHE  53           HD1      PHE  53  12.261  -4.936 -10.838
  425    HD2  PHE  53           HD2      PHE  53   8.129  -4.160 -11.699
  426    HE1  PHE  53           HE1      PHE  53  11.819  -4.651  -8.416
  427    HE2  PHE  53           HE2      PHE  53   7.672  -3.883  -9.274
  428    HZ   PHE  53           HZ       PHE  53   9.514  -4.163  -7.626
  429    H    VAL  54           H        VAL  54   8.925  -5.916 -15.243
  430    HA   VAL  54           HA       VAL  54  10.984  -5.827 -17.319
  431    HB   VAL  54           HB       VAL  54  10.613  -8.259 -17.161
  432   HG11  VAL  54          1HG1      VAL  54   8.609  -9.332 -17.460
  433   HG12  VAL  54          HG21      VAL  54   8.644  -8.312 -15.991
  434   HG13  VAL  54          HG31      VAL  54   7.721  -7.767 -17.453
  435   HG21  VAL  54          HG32      VAL  54   9.902  -8.712 -19.443
  436   HG22  VAL  54          1HG2      VAL  54   8.933  -7.225 -19.503
  437   HG23  VAL  54          HG22      VAL  54  10.699  -7.119 -19.496
  438    H    THR  55           H        THR  55  10.338  -4.607 -19.029
  439    HA   THR  55           HA       THR  55   7.519  -3.630 -18.950
  440    HB   THR  55           HB       THR  55   9.930  -2.191 -20.098
  441    HG1  THR  55           1HG      THR  55  10.002  -2.325 -17.829
  442   HG21  THR  55          1HG2      THR  55   7.033  -1.387 -19.555
  443   HG22  THR  55          HG22      THR  55   8.319  -0.275 -20.087
  444   HG23  THR  55          HG32      THR  55   7.781  -1.586 -21.148
  445    H    PHE  56           H        PHE  56   6.271  -4.307 -20.511
  446    HA   PHE  56           HA       PHE  56   7.380  -5.421 -23.005
  447    HB2  PHE  56           HB2      PHE  56   4.628  -5.286 -21.742
  448    HB3  PHE  56           HB3      PHE  56   4.906  -5.898 -23.370
  449    HD1  PHE  56           HD2      PHE  56   6.363  -6.478 -19.905
  450    HD2  PHE  56           HD1      PHE  56   5.075  -8.121 -23.667
  451    HE1  PHE  56           HE2      PHE  56   6.873  -8.755 -19.086
  452    HE2  PHE  56           HE1      PHE  56   5.523 -10.395 -22.826
  453    HZ   PHE  56           HZ       PHE  56   6.372 -10.729 -20.521
  454    H    GLU  57           H        GLU  57   6.634  -4.737 -25.134
  455    HA   GLU  57           HA       GLU  57   6.212  -1.900 -25.406
  456    HB2  GLU  57           HB2      GLU  57   6.382  -4.314 -27.225
  457    HB3  GLU  57           HB3      GLU  57   5.779  -2.772 -27.829
  458    HG2  GLU  57           HG2      GLU  57   7.881  -1.680 -26.902
  459    HG3  GLU  57           HG3      GLU  57   8.502  -3.319 -26.610
  460    H    SER  58           H        SER  58   4.075  -4.721 -25.090
  461    HA   SER  58           HA       SER  58   1.791  -2.845 -25.549
  462    HB2  SER  58           HB2      SER  58   1.797  -4.504 -27.307
  463    HB3  SER  58           HB3      SER  58   2.053  -5.811 -26.131
  464    HG   SER  58           HG       SER  58  -0.156  -5.554 -26.783
  465    HA   PRO  59           HA       PRO  59   0.975  -3.650 -21.317
  466    HB2  PRO  59           HB2      PRO  59  -1.495  -2.604 -21.072
  467    HB3  PRO  59           HB3      PRO  59  -0.106  -1.544 -21.518
  468    HG2  PRO  59           HG2      PRO  59  -2.065  -2.923 -23.372
  469    HG3  PRO  59           HG3      PRO  59  -1.708  -1.166 -23.296
  470    HD2  PRO  59           2HD      PRO  59  -0.401  -2.758 -25.070
  471    HD3  PRO  59           3HD      PRO  59   0.513  -1.510 -24.163
  472    H    ALA  60           H        ALA  60  -0.376  -5.319 -23.923
  473    HA   ALA  60           HA       ALA  60  -1.967  -7.043 -22.085
  474    HB1  ALA  60           1HB      ALA  60  -3.354  -7.622 -24.005
  475    HB2  ALA  60           HB2      ALA  60  -3.368  -5.869 -23.708
  476    HB3  ALA  60           HB3      ALA  60  -2.398  -6.539 -25.050
  477    H    ASP  61           H        ASP  61   0.767  -6.856 -24.253
  478    HA   ASP  61           HA       ASP  61   1.038  -9.734 -24.562
  479    HB2  ASP  61           HB2      ASP  61   3.038  -7.420 -24.627
  480    HB3  ASP  61           HB3      ASP  61   3.471  -9.060 -24.894
  481    H    ALA  62           H        ALA  62   1.708  -7.274 -22.136
  482    HA   ALA  62           HA       ALA  62   3.295  -8.966 -20.405
  483    HB1  ALA  62           1HB      ALA  62   1.741  -6.384 -19.946
  484    HB2  ALA  62           HB2      ALA  62   2.867  -7.118 -18.784
  485    HB3  ALA  62           HB3      ALA  62   3.467  -6.528 -20.362
  486    H    LYS  63           H        LYS  63  -0.164  -8.305 -20.886
  487    HA   LYS  63           HA       LYS  63  -1.021  -9.579 -18.422
  488    HB2  LYS  63           HB2      LYS  63  -2.472  -9.027 -21.042
  489    HB3  LYS  63           HB3      LYS  63  -3.247  -9.595 -19.549
  490    HG2  LYS  63           HG2      LYS  63  -2.557  -7.582 -18.348
  491    HG3  LYS  63           HG3      LYS  63  -1.626  -7.040 -19.753
  492    HD2  LYS  63           2HD      LYS  63  -3.717  -5.798 -19.625
  493    HD3  LYS  63           3HD      LYS  63  -3.737  -6.819 -21.063
  494    HE2  LYS  63           HE2      LYS  63  -5.057  -8.531 -19.829
  495    HE3  LYS  63           HE3      LYS  63  -5.040  -7.499 -18.389
  496    HZ1  LYS  63           3HZ      LYS  63  -6.207  -5.830 -19.643
  497    HZ2  LYS  63           1HZ      LYS  63  -6.242  -6.788 -20.979
  498    HZ3  LYS  63           2HZ      LYS  63  -7.057  -7.238 -19.626
  499    H    ASP  64           H        ASP  64  -0.416 -10.590 -21.787
  500    HA   ASP  64           HA       ASP  64  -1.547 -13.199 -21.495
  501    HB2  ASP  64           HB2      ASP  64  -1.033 -11.864 -23.615
  502    HB3  ASP  64           HB3      ASP  64   0.673 -12.240 -23.344
  503    H    ALA  65           H        ALA  65   1.543 -11.775 -20.710
  504    HA   ALA  65           HA       ALA  65   2.777 -14.367 -20.081
  505    HB1  ALA  65           1HB      ALA  65   3.668 -11.576 -19.260
  506    HB2  ALA  65           HB2      ALA  65   4.646 -13.069 -19.305
  507    HB3  ALA  65           HB3      ALA  65   4.085 -12.317 -20.812
  508    H    ALA  66           H        ALA  66   1.256 -11.626 -18.303
  509    HA   ALA  66           HA       ALA  66   1.894 -12.758 -15.751
  510    HB1  ALA  66           1HB      ALA  66   0.585 -10.852 -14.890
  511    HB2  ALA  66           HB2      ALA  66   1.624 -10.311 -16.229
  512    HB3  ALA  66           HB3      ALA  66  -0.103 -10.573 -16.508
  513    H    ARG  67           H        ARG  67  -0.537 -13.536 -18.027
  514    HA   ARG  67           HA       ARG  67  -2.109 -14.917 -15.917
  515    HB2  ARG  67           HB2      ARG  67  -2.694 -14.117 -18.779
  516    HB3  ARG  67           HB3      ARG  67  -3.618 -15.381 -17.967
  517    HG2  ARG  67           HG2      ARG  67  -4.891 -13.481 -17.517
  518    HG3  ARG  67           HG3      ARG  67  -3.953 -13.778 -16.033
  519    HD2  ARG  67           2HD      ARG  67  -2.326 -12.002 -16.803
  520    HD3  ARG  67           3HD      ARG  67  -3.433 -11.661 -18.146
  521    HE   ARG  67           HE       ARG  67  -4.932 -10.657 -16.675
  522   HH11  ARG  67          1HH1      ARG  67  -2.338 -12.244 -14.855
  523   HH12  ARG  67          2HH1      ARG  67  -2.758 -11.450 -13.356
  524   HH21  ARG  67          1HH2      ARG  67  -5.457  -9.662 -14.694
  525   HH22  ARG  67          2HH2      ARG  67  -4.519 -10.007 -13.260
  526    H    ASP  68           H        ASP  68   0.682 -15.694 -17.424
  527    HA   ASP  68           HA       ASP  68  -0.213 -18.472 -18.050
  528    HB2  ASP  68           HB2      ASP  68   1.339 -16.373 -19.506
  529    HB3  ASP  68           HB3      ASP  68   2.114 -17.913 -19.425
  530    H    MET  69           H        MET  69   2.512 -16.316 -17.420
  531    HA   MET  69           HA       MET  69   4.219 -18.367 -16.307
  532    HB2  MET  69           HB2      MET  69   4.290 -15.508 -17.194
  533    HB3  MET  69           HB3      MET  69   5.375 -15.895 -15.908
  534    HG2  MET  69           HG2      MET  69   5.093 -17.298 -18.596
  535    HG3  MET  69           HG3      MET  69   6.400 -16.189 -18.152
  536    HE1  MET  69           HE3      MET  69   6.861 -17.304 -15.107
  537    HE2  MET  69           HE1      MET  69   8.381 -18.158 -15.488
  538    HE3  MET  69           HE2      MET  69   8.012 -16.597 -16.270
  539    H    ASN  70           H        ASN  70   1.716 -16.391 -15.005
  540    HA   ASN  70           HA       ASN  70   2.961 -15.896 -12.444
  541    HB2  ASN  70           HB2      ASN  70   1.117 -14.519 -13.373
  542    HB3  ASN  70           HB3      ASN  70   0.029 -15.905 -13.270
  543   HD21  ASN  70          2HD2      ASN  70  -1.279 -14.423 -11.904
  544   HD22  ASN  70          1HD2      ASN  70  -0.878 -14.289 -10.203
  545    H    GLY  71           H        GLY  71   3.223 -17.272 -10.787
  546    HA2  GLY  71           2HA      GLY  71   2.680 -18.957  -9.289
  547    HA3  GLY  71           3HA      GLY  71   1.353 -19.483 -10.339
  548    H    LYS  72           H        LYS  72   3.794 -19.268 -12.536
  549    HA   LYS  72           HA       LYS  72   4.542 -22.077 -12.436
  550    HB2  LYS  72           HB2      LYS  72   5.487 -19.819 -14.195
  551    HB3  LYS  72           HB3      LYS  72   5.534 -21.546 -14.531
  552    HG2  LYS  72           HG2      LYS  72   3.020 -19.834 -14.370
  553    HG3  LYS  72           HG3      LYS  72   3.732 -20.537 -15.827
  554    HD2  LYS  72           2HD      LYS  72   2.543 -22.108 -13.498
  555    HD3  LYS  72           3HD      LYS  72   1.797 -21.843 -15.077
  556    HE2  LYS  72           HE2      LYS  72   3.680 -23.021 -16.173
  557    HE3  LYS  72           HE3      LYS  72   4.431 -23.302 -14.590
  558    HZ1  LYS  72           3HZ      LYS  72   2.481 -24.565 -13.971
  559    HZ2  LYS  72           1HZ      LYS  72   1.796 -24.307 -15.439
  560    HZ3  LYS  72           2HZ      LYS  72   3.175 -25.195 -15.325
  561    H    SER  73           H        SER  73   7.091 -21.656 -13.572
  562    HA   SER  73           HA       SER  73   8.716 -20.644 -11.285
  563    HB2  SER  73           HB2      SER  73   8.156 -23.041 -11.041
  564    HB3  SER  73           HB3      SER  73   8.885 -23.369 -12.625
  565    HG   SER  73           HG       SER  73  10.339 -23.724 -10.867
  566    H    LEU  74           H        LEU  74  10.871 -20.222 -11.763
  567    HA   LEU  74           HA       LEU  74  11.155 -19.460 -14.636
  568    HB2  LEU  74           HB2      LEU  74  11.361 -17.788 -12.504
  569    HB3  LEU  74           HB3      LEU  74  12.970 -18.424 -12.471
  570    HG   LEU  74           HG       LEU  74  12.930 -16.388 -13.724
  571   HD11  LEU  74          1HD1      LEU  74  13.244 -18.626 -15.756
  572   HD12  LEU  74          2HD1      LEU  74  13.940 -16.991 -15.821
  573   HD13  LEU  74          3HD1      LEU  74  14.484 -18.126 -14.572
  574   HD21  LEU  74          3HD2      LEU  74  11.026 -17.725 -15.689
  575   HD22  LEU  74          1HD2      LEU  74  10.478 -16.666 -14.370
  576   HD23  LEU  74          2HD2      LEU  74  11.528 -16.019 -15.647
  577    H    ASP  75           H        ASP  75  13.347 -20.346 -11.980
  578    HA   ASP  75           HA       ASP  75  14.925 -21.949 -13.931
  579    HB2  ASP  75           HB2      ASP  75  15.871 -19.605 -12.974
  580    HB3  ASP  75           HB3      ASP  75  16.015 -20.487 -11.513
  581    H    GLY  76           H        GLY  76  12.762 -22.432 -11.856
  582    HA2  GLY  76           2HA      GLY  76  12.684 -24.775 -11.084
  583    HA3  GLY  76           3HA      GLY  76  14.248 -24.473 -10.276
  584    H    LYS  77           H        LYS  77  12.794 -21.597 -10.033
  585    HA   LYS  77           HA       LYS  77  11.588 -22.200  -7.381
  586    HB2  LYS  77           HB2      LYS  77  12.943 -19.639  -8.284
  587    HB3  LYS  77           HB3      LYS  77  12.346 -20.017  -6.661
  588    HG2  LYS  77           HG2      LYS  77  14.588 -21.433  -8.170
  589    HG3  LYS  77           HG3      LYS  77  14.798 -20.337  -6.798
  590    HD2  LYS  77           2HD      LYS  77  13.810 -21.896  -5.270
  591    HD3  LYS  77           3HD      LYS  77  13.219 -22.942  -6.579
  592    HE2  LYS  77           HE2      LYS  77  15.463 -23.460  -7.301
  593    HE3  LYS  77           HE3      LYS  77  16.151 -22.377  -6.070
  594    HZ1  LYS  77           3HZ      LYS  77  15.182 -23.788  -4.386
  595    HZ2  LYS  77           1HZ      LYS  77  14.544 -24.787  -5.521
  596    HZ3  LYS  77           2HZ      LYS  77  16.174 -24.669  -5.355
  597    H    ALA  78           H        ALA  78   9.558 -21.569  -7.011
  598    HA   ALA  78           HA       ALA  78   8.057 -20.845  -9.381
  599    HB1  ALA  78           1HB      ALA  78   7.136 -21.349  -6.536
  600    HB2  ALA  78           HB2      ALA  78   6.087 -21.212  -7.972
  601    HB3  ALA  78           HB3      ALA  78   7.247 -22.555  -7.842
  602    H    ILE  79           H        ILE  79   7.040 -18.994  -9.892
  603    HA   ILE  79           HA       ILE  79   7.743 -16.651  -8.196
  604    HB   ILE  79           HB       ILE  79   7.990 -15.371 -10.180
  605   HG12  ILE  79          HG21      ILE  79   7.144 -17.818 -11.795
  606   HG13  ILE  79          HG31      ILE  79   6.105 -16.421 -11.458
  607   HG21  ILE  79          1HG2      ILE  79   9.871 -16.468 -11.254
  608   HG22  ILE  79          HG22      ILE  79   9.904 -16.820  -9.515
  609   HG23  ILE  79          HG32      ILE  79   9.345 -18.060 -10.661
  610   HD11  ILE  79          3HD1      ILE  79   7.855 -14.944 -12.507
  611   HD12  ILE  79          1HD1      ILE  79   8.670 -16.432 -13.064
  612   HD13  ILE  79          2HD1      ILE  79   7.018 -16.040 -13.611
  613    H    LYS  80           H        LYS  80   6.537 -14.696  -8.766
  614    HA   LYS  80           HA       LYS  80   3.629 -15.114  -9.267
  615    HB2  LYS  80           HB2      LYS  80   4.274 -14.285  -6.946
  616    HB3  LYS  80           HB3      LYS  80   5.046 -12.901  -7.724
  617    HG2  LYS  80           HG2      LYS  80   2.786 -12.413  -8.850
  618    HG3  LYS  80           HG3      LYS  80   2.080 -13.585  -7.726
  619    HD2  LYS  80           2HD      LYS  80   2.940 -12.242  -5.816
  620    HD3  LYS  80           3HD      LYS  80   3.682 -11.104  -6.969
  621    HE2  LYS  80           HE2      LYS  80   1.425 -10.660  -7.930
  622    HE3  LYS  80           HE3      LYS  80   0.712 -11.693  -6.675
  623    HZ1  LYS  80           3HZ      LYS  80   2.293  -9.252  -6.188
  624    HZ2  LYS  80           1HZ      LYS  80   0.664  -9.365  -6.085
  625    HZ3  LYS  80           2HZ      LYS  80   1.618 -10.202  -5.030
  626    H    VAL  81           H        VAL  81   2.779 -13.812 -10.939
  627    HA   VAL  81           HA       VAL  81   4.557 -11.673 -11.993
  628    HB   VAL  81           HB       VAL  81   3.000 -13.617 -13.735
  629   HG11  VAL  81          1HG1      VAL  81   4.920 -11.343 -14.408
  630   HG12  VAL  81          HG21      VAL  81   4.126 -12.437 -15.577
  631   HG13  VAL  81          HG31      VAL  81   3.154 -11.301 -14.624
  632   HG21  VAL  81          HG32      VAL  81   5.006 -14.685 -12.793
  633   HG22  VAL  81          1HG2      VAL  81   5.269 -14.306 -14.508
  634   HG23  VAL  81          HG22      VAL  81   5.993 -13.273 -13.253
  635    H    GLU  82           H        GLU  82   3.555  -9.776 -12.171
  636    HA   GLU  82           HA       GLU  82   0.642  -9.573 -12.478
  637    HB2  GLU  82           HB2      GLU  82   1.073 -10.111 -10.036
  638    HB3  GLU  82           HB3      GLU  82   2.032  -8.635  -9.931
  639    HG2  GLU  82           HG2      GLU  82   0.060  -7.273 -10.455
  640    HG3  GLU  82           HG3      GLU  82  -0.900  -8.736 -10.750
  641    H    GLN  83           H        GLN  83   0.014  -7.188 -12.679
  642    HA   GLN  83           HA       GLN  83   2.035  -5.592 -13.945
  643    HB2  GLN  83           HB2      GLN  83  -0.263  -5.155 -14.463
  644    HB3  GLN  83           HB3      GLN  83  -0.695  -5.043 -12.747
  645    HG2  GLN  83           HG2      GLN  83  -0.719  -2.850 -13.691
  646    HG3  GLN  83           HG3      GLN  83   0.582  -2.971 -12.501
  647   HE21  GLN  83          HE22      GLN  83   1.909  -1.399 -13.191
  648   HE22  GLN  83          HE12      GLN  83   2.644  -1.328 -14.771
  649    H    ALA  84           H        ALA  84   3.461  -4.124 -13.077
  650    HA   ALA  84           HA       ALA  84   4.144  -4.623 -10.322
  651    HB1  ALA  84           1HB      ALA  84   5.288  -2.666 -12.343
  652    HB2  ALA  84           HB2      ALA  84   6.048  -3.136 -10.807
  653    HB3  ALA  84           HB3      ALA  84   5.829  -4.344 -12.095
  654    H    THR  85           H        THR  85   4.329  -3.195  -8.606
  655    HA   THR  85           HA       THR  85   2.833  -0.624  -8.843
  656    HB   THR  85           HB       THR  85   2.803  -0.608  -6.408
  657    HG1  THR  85           1HG      THR  85   3.433  -2.476  -5.294
  658   HG21  THR  85          1HG2      THR  85   1.142  -2.407  -6.084
  659   HG22  THR  85          HG22      THR  85   0.932  -1.688  -7.699
  660   HG23  THR  85          HG32      THR  85   1.749  -3.255  -7.524
  661    H    LYS  86           H        LYS  86   3.834   1.007  -7.191
  662    HA   LYS  86           HA       LYS  86   6.498   1.555  -8.212
  663    HB2  LYS  86           HB2      LYS  86   4.696   3.046  -6.265
  664    HB3  LYS  86           HB3      LYS  86   6.151   3.699  -7.058
  665    HG2  LYS  86           HG2      LYS  86   5.060   3.107  -9.283
  666    HG3  LYS  86           HG3      LYS  86   3.575   2.747  -8.379
  667    HD2  LYS  86           2HD      LYS  86   3.696   5.119  -7.453
  668    HD3  LYS  86           3HD      LYS  86   4.989   5.419  -8.646
  669    HE2  LYS  86           HE2      LYS  86   3.395   4.543 -10.421
  670    HE3  LYS  86           HE3      LYS  86   2.132   4.518  -9.178
  671    HZ1  LYS  86           3HZ      LYS  86   2.451   6.878  -8.881
  672    HZ2  LYS  86           1HZ      LYS  86   3.617   6.911 -10.036
  673    HZ3  LYS  86           2HZ      LYS  86   2.067   6.549 -10.445
  674    HA   PRO  87           HA       PRO  87   8.915  -0.123  -5.022
  675    HB2  PRO  87           HB2      PRO  87  10.932   1.694  -4.613
  676    HB3  PRO  87           HB3      PRO  87  10.761   0.735  -6.118
  677    HG2  PRO  87           HG2      PRO  87   9.765   3.555  -5.612
  678    HG3  PRO  87           HG3      PRO  87  10.766   2.972  -6.985
  679    HD2  PRO  87           2HD      PRO  87   8.096   3.197  -7.253
  680    HD3  PRO  87           3HD      PRO  87   8.931   1.757  -7.910
  681    H    SER  88           H        SER  88   9.638   0.035  -2.773
  682    HA   SER  88           HA       SER  88   7.737   1.775  -1.295
  683    HB2  SER  88           HB2      SER  88   8.737  -1.008  -0.592
  684    HB3  SER  88           HB3      SER  88   7.571  -0.050   0.344
  685    HG   SER  88           HG       SER  88   7.258  -0.985  -2.321
  686    H    PHE  89           H        PHE  89  10.960   1.812  -1.890
  687    HA   PHE  89           HA       PHE  89  11.849   2.093   0.879
  688    HB2  PHE  89           HB2      PHE  89  13.931   2.933  -0.122
  689    HB3  PHE  89           HB3      PHE  89  13.485   1.285  -0.608
  690    HD1  PHE  89           HD1      PHE  89  13.544   4.849  -1.699
  691    HD2  PHE  89           HD2      PHE  89  13.297   0.738  -2.890
  692    HE1  PHE  89           HE1      PHE  89  13.917   5.523  -4.069
  693    HE2  PHE  89           HE2      PHE  89  13.702   1.409  -5.265
  694    HZ   PHE  89           HZ       PHE  89  14.012   3.778  -5.842
  695    H    GLU  90           H        GLU  90   9.776   3.994  -0.798
  696    HA   GLU  90           HA       GLU  90  10.721   6.412   0.575
  697    HB2  GLU  90           HB2      GLU  90  11.909   6.255  -1.648
  698    HB3  GLU  90           HB3      GLU  90  10.328   6.291  -2.443
  699    HG2  GLU  90           HG2      GLU  90  11.470   8.480  -2.401
  700    HG3  GLU  90           HG3      GLU  90   9.904   8.520  -1.553
  701    H    SER  91           H        SER  91   9.214   8.104   0.641
  702    HA   SER  91           HA       SER  91   6.421   7.534  -0.093
  703    HB2  SER  91           HB2      SER  91   7.509   7.688   2.737
  704    HB3  SER  91           HB3      SER  91   5.785   7.945   2.351
  705    HG   SER  91           HG       SER  91   7.303   5.632   1.723
  706    H    GLY  92           H        GLY  92   8.389   9.516  -0.925
  707    HA2  GLY  92           2HA      GLY  92   8.140  11.960   0.532
  708    HA3  GLY  92           3HA      GLY  92   8.707  11.772  -1.135
  709    H    ARG  93           H        ARG  93   5.756  10.363  -1.308
  710    HA   ARG  93           HA       ARG  93   4.137  12.827  -1.361
  711    HB2  ARG  93           HB2      ARG  93   5.188  12.734  -3.581
  712    HB3  ARG  93           HB3      ARG  93   4.622  11.066  -3.798
  713    HG2  ARG  93           HG2      ARG  93   2.282  11.825  -3.668
  714    HG3  ARG  93           HG3      ARG  93   2.820  13.497  -3.396
  715    HD2  ARG  93           2HD      ARG  93   3.429  11.825  -5.870
  716    HD3  ARG  93           3HD      ARG  93   2.147  13.048  -5.751
  717    HE   ARG  93           HE       ARG  93   4.640  14.216  -4.997
  718   HH11  ARG  93          1HH1      ARG  93   2.902  13.039  -7.841
  719   HH12  ARG  93          2HH1      ARG  93   3.739  14.108  -8.943
  720   HH21  ARG  93          1HH2      ARG  93   5.715  15.605  -6.459
  721   HH22  ARG  93          2HH2      ARG  93   5.326  15.556  -8.161
  722    H    ARG  94           H        ARG  94   2.066  12.453  -0.854
  723    HA   ARG  94           HA       ARG  94   0.295  11.404   0.087
  724    HB2  ARG  94           HB2      ARG  94   0.855   9.514  -2.221
  725    HB3  ARG  94           HB3      ARG  94  -0.622   9.473  -1.247
  726    HG2  ARG  94           HG2      ARG  94   0.319  11.899  -2.830
  727    HG3  ARG  94           HG3      ARG  94  -0.900  10.729  -3.367
  728    HD2  ARG  94           2HD      ARG  94  -2.275  11.278  -1.369
  729    HD3  ARG  94           3HD      ARG  94  -1.076  12.502  -0.898
  730    HE   ARG  94           HE       ARG  94  -1.847  13.017  -3.571
  731   HH11  ARG  94          1HH1      ARG  94  -3.225  13.086  -0.315
  732   HH12  ARG  94          2HH1      ARG  94  -4.367  14.354  -0.698
  733   HH21  ARG  94          1HH2      ARG  94  -3.350  14.679  -4.039
  734   HH22  ARG  94          2HH2      ARG  94  -4.437  15.252  -2.796
  735    H    GLY  95           H        GLY  95  -0.635   9.091   0.762
  736    HA2  GLY  95           2HA      GLY  95   1.127   7.084   1.684
  737    HA3  GLY  95           3HA      GLY  95   0.931   8.274   2.985
  738    H5'    A  96           H5'        A  96   0.261 -11.195   1.101
  739   H5''    A  96          H5''        A  96  -1.064 -11.933   0.191
  740    H4'    A  96           H4'        A  96  -0.478 -12.301   3.184
  741    H3'    A  96           H3'        A  96   0.380 -13.700   0.727
  742    H2'    A  96           H2'        A  96  -0.640 -15.782   1.081
  743   HO2'    A  96          HO2'        A  96   0.049 -15.862   3.335
  744    H1'    A  96           H1'        A  96  -3.017 -15.042   2.084
  745    H8     A  96           H8         A  96  -3.197 -12.192   0.073
  746    H61    A  96           H61        A  96  -3.087 -15.579  -5.126
  747    H62    A  96           H62        A  96  -3.440 -13.998  -4.451
  748    H2     A  96           H2         A  96  -1.737 -18.153  -1.777
  749   HO5'    A  96          H5T         A  96  -1.520  -9.779   0.909
  750    H5'    U  97           H5'        U  97   2.300 -15.296   0.557
  751   H5''    U  97          H5''        U  97   4.034 -15.057   0.825
  752    H4'    U  97           H4'        U  97   4.105 -13.692  -1.288
  753    H3'    U  97           H3'        U  97   1.284 -13.928  -1.232
  754    H2'    U  97           H2'        U  97   0.770 -15.764  -2.519
  755   HO2'    U  97          HO2'        U  97   1.395 -14.464  -4.374
  756    H1'    U  97           H1'        U  97   3.177 -16.998  -3.100
  757    H3     U  97           H3         U  97   2.855 -20.435  -0.213
  758    H5     U  97           H5         U  97  -0.113 -17.750   1.055
  759    H6     U  97           H6         U  97   0.798 -16.102  -0.492
  760    H5'    C  98           H5'        C  98   4.755  -9.965  -2.752
  761   H5''    C  98          H5''        C  98   4.921 -11.610  -3.389
  762    H4'    C  98           H4'        C  98   6.055 -10.680  -0.723
  763    H3'    C  98           H3'        C  98   7.062  -9.704  -3.053
  764    H2'    C  98           H2'        C  98   7.019 -11.806  -4.193
  765   HO2'    C  98          HO2'        C  98   9.617 -11.461  -3.087
  766    H1'    C  98           H1'        C  98   8.410 -13.152  -1.883
  767    H41    C  98           H41        C  98   6.738 -17.899  -5.793
  768    H42    C  98           H42        C  98   5.077 -17.335  -5.873
  769    H5     C  98           H5         C  98   4.312 -15.323  -4.692
  770    H6     C  98           H6         C  98   5.025 -13.493  -3.243
  771    H5'    A  99           H5'        A  99   9.272  -6.087  -0.976
  772   H5''    A  99          H5''        A  99   7.676  -6.243  -1.744
  773    H4'    A  99           H4'        A  99  10.319  -6.023  -3.260
  774    H3'    A  99           H3'        A  99   9.036  -3.938  -1.899
  775    H2'    A  99           H2'        A  99   7.021  -4.124  -3.195
  776   HO2'    A  99          HO2'        A  99   7.073  -2.407  -4.679
  777    H1'    A  99           H1'        A  99   8.886  -4.600  -5.537
  778    H8     A  99           H8         A  99   7.202  -3.665  -7.216
  779    H61    A  99           H61        A  99   1.951  -6.983  -7.349
  780    H62    A  99           H62        A  99   2.898  -5.771  -8.178
  781    H2     A  99           H2         A  99   4.237  -8.120  -3.704
  782    H5'    A 100           H5'        A 100  12.810  -0.923  -4.267
  783   H5''    A 100          H5''        A 100  11.659  -2.018  -5.068
  784    H4'    A 100           H4'        A 100  14.372  -3.085  -5.245
  785    H3'    A 100           H3'        A 100  14.639  -0.426  -5.280
  786    H2'    A 100           H2'        A 100  12.599  -0.077  -6.440
  787   HO2'    A 100          HO2'        A 100  13.221   0.708  -8.552
  788    H1'    A 100           H1'        A 100  13.433  -1.966  -8.624
  789    H8     A 100           H8         A 100  10.303  -1.855  -6.301
  790    H61    A 100           H61        A 100   7.314   0.065 -11.391
  791    H62    A 100           H62        A 100   7.128  -0.435  -9.718
  792    H2     A 100           H2         A 100  11.627  -0.303 -12.375
  793    H5'    A 101           H5'        A 101  16.020   1.095  -7.117
  794   H5''    A 101          H5''        A 101  17.618   0.696  -7.778
  795    H4'    A 101           H4'        A 101  17.284   3.102  -7.382
  796    H3'    A 101           H3'        A 101  19.555   1.634  -6.904
  797   HO3'    A 101          H3T         A 101  20.542   3.745  -6.587
  798    H2'    A 101           H2'        A 101  19.198   1.236  -4.625
  799   HO2'    A 101          HO2'        A 101  21.182   2.389  -4.746
  800    H1'    A 101           H1'        A 101  18.237   4.055  -4.173
  801    H8     A 101           H8         A 101  17.626   0.275  -3.540
  802    H61    A 101           H61        A 101  15.985   2.072   2.177
  803    H62    A 101           H62        A 101  16.247   0.687   1.133
  804    H2     A 101           H2         A 101  16.759   5.704  -0.242