*HEADER    DNA BINDING PROTEIN                     27-JUN-03   1PVE              
*TITLE     SOLUTION STRUCTURE OF XPC BINDING DOMAIN OF HHR23B                    
*COMPND    MOL_ID: 1;                                                            
*COMPND   2 MOLECULE: UV EXCISION REPAIR PROTEIN RAD23 HOMOLOG B;                
*COMPND   3 CHAIN: A;                                                            
*COMPND   4 FRAGMENT: XPC BINDING DOMAIN;                                        
*COMPND   5 SYNONYM: HHR23B;                                                     
*COMPND   6 ENGINEERED: YES                                                      
*SOURCE    MOL_ID: 1;                                                            
*SOURCE   2 ORGANISM_SCIENTIFIC: HOMO SAPIENS;                                   
*SOURCE   3 ORGANISM_COMMON: HUMAN;                                              
*SOURCE   4 GENE: HH23B;                                                         
*SOURCE   5 EXPRESSION_SYSTEM: ESCHERICHIA COLI;                                 
*SOURCE   6 EXPRESSION_SYSTEM_COMMON: BACTERIA;                                  
*SOURCE   7 EXPRESSION_SYSTEM_STRAIN: BL21(DE3)PLYSS;                            
*SOURCE   8 EXPRESSION_SYSTEM_VECTOR_TYPE: PLASMID;                              
*SOURCE   9 EXPRESSION_SYSTEM_PLASMID: PET15B                                    
*KEYWDS    HHR23B, XPC BINDING DOMAIN, NMR SOLUTION STRUCTURE,                   
*KEYWDS   2 NUCLEOTIDE EXCISION REPAIR, CHAPS                                    
*EXPDTA    NMR, 20 STRUCTURES                                                    
*AUTHOR    B.K.KIM, K.-S.RYU, H.J.KIM, B.-S.CHOI                                 
*REVDAT   1   10-AUG-04 1PVE    0                                                

# 1132 atoms read from pdb file xpcb_ref.pdb.
# 11 ASN PHI:  (10 ARG C)-(11 ASN N)-(11 ASN CA)-(11 ASN C) -140.0 -100.0
 &rst     iat =   164,   166,   168,   178,
   r1 = -141.0, r2 = -140.0, r3 = -100.0, r4 = -99.0,
   rk2 =   2.0, rk3 =   2.0,    &end

# 18 MET PHI:  (17 GLN C)-(18 MET N)-(18 MET CA)-(18 MET C) -80.0 -40.0
 &rst     iat =   280,   282,   284,   297,
   r1 = -81.0, r2 = -80.0, r3 = -40.0, r4 = -39.0,
 &end

# 23 GLN PHI:  (22 ILE C)-(23 GLN N)-(23 GLN CA)-(23 GLN C) -80.0 -40.0
 &rst     iat =   376,   378,   380,   393,
   r1 = -81.0, r2 = -80.0, r3 = -40.0, r4 = -39.0,
 &end

# 25 ASN PHI:  (24 GLN C)-(25 ASN N)-(25 ASN CA)-(25 ASN C) -140.0 -100.0
 &rst     iat =   410,   412,   414,   424,
   r1 = -141.0, r2 = -140.0, r3 = -100.0, r4 = -99.0,
 &end

# 29 LEU PHI:  (28 LEU C)-(29 LEU N)-(29 LEU CA)-(29 LEU C) -80.0 -40.0
 &rst     iat =   468,   470,   472,   487,
   r1 = -81.0, r2 = -80.0, r3 = -40.0, r4 = -39.0,
 &end

# 33 LEU PHI:  (32 LEU C)-(33 LEU N)-(33 LEU CA)-(33 LEU C) -80.0 -40.0
 &rst     iat =   530,   532,   534,   549,
   r1 = -81.0, r2 = -80.0, r3 = -40.0, r4 = -39.0,
 &end

# 40 ASN PHI:  (39 GLU C)-(40 ASN N)-(40 ASN CA)-(40 ASN C) -140.0 -100.0
 &rst     iat =   648,   650,   652,   662,
   r1 = -141.0, r2 = -140.0, r3 = -100.0, r4 = -99.0,
 &end

# 50 HIS PHI:  (49 GLN C)-(50 HID N)-(50 HID CA)-(50 HID C) -140.0 -100.0
 &rst     iat =   812,   814,   816,   829,
   r1 = -141.0, r2 = -140.0, r3 = -100.0, r4 = -99.0,
 &end

# 51 GLN PHI:  (50 HID C)-(51 GLN N)-(51 GLN CA)-(51 GLN C) -80.0 -40.0
 &rst     iat =   829,   831,   833,   846,
   r1 = -81.0, r2 = -80.0, r3 = -40.0, r4 = -39.0,
 &end

# 52 GLU PHI:  (51 GLN C)-(52 GLU N)-(52 GLU CA)-(52 GLU C) -80.0 -40.0
 &rst     iat =   846,   848,   850,   861,
   r1 = -81.0, r2 = -80.0, r3 = -40.0, r4 = -39.0,
 &end

# 53 HIS PHI:  (52 GLU C)-(53 HID N)-(53 HID CA)-(53 HID C) -80.0 -40.0
 &rst     iat =   861,   863,   865,   878,
   r1 = -81.0, r2 = -80.0, r3 = -40.0, r4 = -39.0,
 &end

# 57 MET PHI:  (56 GLN C)-(57 MET N)-(57 MET CA)-(57 MET C) -80.0 -40.0
 &rst     iat =   934,   936,   938,   951,
   r1 = -81.0, r2 = -80.0, r3 = -40.0, r4 = -39.0,
 &end

# 60 GLU PHI:  (59 ASN C)-(60 GLU N)-(60 GLU CA)-(60 GLU C) -80.0 -40.0
 &rst     iat =   984,   986,   988,   999,
   r1 = -81.0, r2 = -80.0, r3 = -40.0, r4 = -39.0,
 &end

# 63 GLN PHI:  (62 VAL C)-(63 GLN N)-(63 GLN CA)-(63 GLN C) -140.0 -100.0
 &rst     iat =  1029,  1031,  1033,  1046,
   r1 = -141.0, r2 = -140.0, r3 = -100.0, r4 = -99.0,
 &end

# 7 GLU PHI:  (6 LEU C)-(7 GLU N)-(7 GLU CA)-(7 GLU C) -87.0 -39.0
 &rst     iat =    86,    88,    90,   101,
   r1 = -88.0, r2 = -87.0, r3 = -39.0, r4 = -38.0,
 &end

# 7 GLU PSI:  (7 GLU N)-(7 GLU CA)-(7 GLU C)-(8 PHE N) -67.0 -11.0
 &rst     iat =    88,    90,   101,   103,
   r1 = -68.0, r2 = -67.0, r3 = -11.0, r4 = -10.0,
 &end

# 8 PHE PHI:  (7 GLU C)-(8 PHE N)-(8 PHE CA)-(8 PHE C) -86.0 -42.0
 &rst     iat =   101,   103,   105,   121,
   r1 = -87.0, r2 = -86.0, r3 = -42.0, r4 = -41.0,
 &end

# 8 PHE PSI:  (8 PHE N)-(8 PHE CA)-(8 PHE C)-(9 LEU N) -70.0  -6.0
 &rst     iat =   103,   105,   121,   123,
   r1 = -71.0, r2 = -70.0, r3 =  -6.0, r4 =  -5.0,
 &end

# 9 LEU PHI:  (8 PHE C)-(9 LEU N)-(9 LEU CA)-(9 LEU C) -93.0 -37.0
 &rst     iat =   121,   123,   125,   140,
   r1 = -94.0, r2 = -93.0, r3 = -37.0, r4 = -36.0,
 &end

# 9 LEU PSI:  (9 LEU N)-(9 LEU CA)-(9 LEU C)-(10 ARG N) -63.0 -19.0
 &rst     iat =   123,   125,   140,   142,
   r1 = -64.0, r2 = -63.0, r3 = -19.0, r4 = -18.0,
 &end

# 10 ARG PHI:  (9 LEU C)-(10 ARG N)-(10 ARG CA)-(10 ARG C) -85.0 -37.0
 &rst     iat =   140,   142,   144,   164,
   r1 = -86.0, r2 = -85.0, r3 = -37.0, r4 = -36.0,
 &end

# 10 ARG PSI:  (10 ARG N)-(10 ARG CA)-(10 ARG C)-(11 ASN N) -73.0   7.0
 &rst     iat =   142,   144,   164,   166,
   r1 = -74.0, r2 = -73.0, r3 =   7.0, r4 =   8.0,
 &end

# 14 GLN PHI:  (13 PRO C)-(14 GLN N)-(14 GLN CA)-(14 GLN C) -124.0 -36.0
 &rst     iat =   209,   211,   213,   226,
   r1 = -125.0, r2 = -124.0, r3 = -36.0, r4 = -35.0,
 &end

# 14 GLN PSI:  (14 GLN N)-(14 GLN CA)-(14 GLN C)-(15 PHE N) -72.0  40.0
 &rst     iat =   211,   213,   226,   228,
   r1 = -73.0, r2 = -72.0, r3 =  40.0, r4 =  41.0,
 &end

# 17 GLN PHI:  (16 GLN C)-(17 GLN N)-(17 GLN CA)-(17 GLN C) -87.0 -43.0
 &rst     iat =   263,   265,   267,   280,
   r1 = -88.0, r2 = -87.0, r3 = -43.0, r4 = -42.0,
 &end

# 17 GLN PSI:  (17 GLN N)-(17 GLN CA)-(17 GLN C)-(18 MET N) -62.0 -14.0
 &rst     iat =   265,   267,   280,   282,
   r1 = -63.0, r2 = -62.0, r3 = -14.0, r4 = -13.0,
 &end

# 19 ARG PHI:  (18 MET C)-(19 ARG N)-(19 ARG CA)-(19 ARG C) -86.0 -34.0
 &rst     iat =   297,   299,   301,   321,
   r1 = -87.0, r2 = -86.0, r3 = -34.0, r4 = -33.0,
 &end

# 19 ARG PSI:  (19 ARG N)-(19 ARG CA)-(19 ARG C)-(20 GLN N) -68.0 -16.0
 &rst     iat =   299,   301,   321,   323,
   r1 = -69.0, r2 = -68.0, r3 = -16.0, r4 = -15.0,
 &end

# 20 GLN PHI:  (19 ARG C)-(20 GLN N)-(20 GLN CA)-(20 GLN C) -81.0 -45.0
 &rst     iat =   321,   323,   325,   338,
   r1 = -82.0, r2 = -81.0, r3 = -45.0, r4 = -44.0,
 &end

# 20 GLN PSI:  (20 GLN N)-(20 GLN CA)-(20 GLN C)-(21 ILE N) -67.0 -19.0
 &rst     iat =   323,   325,   338,   340,
   r1 = -68.0, r2 = -67.0, r3 = -19.0, r4 = -18.0,
 &end

# 21 ILE PHI:  (20 GLN C)-(21 ILE N)-(21 ILE CA)-(21 ILE C) -91.0 -43.0
 &rst     iat =   338,   340,   342,   357,
   r1 = -92.0, r2 = -91.0, r3 = -43.0, r4 = -42.0,
 &end

# 21 ILE PSI:  (21 ILE N)-(21 ILE CA)-(21 ILE C)-(22 ILE N) -58.0 -22.0
 &rst     iat =   340,   342,   357,   359,
   r1 = -59.0, r2 = -58.0, r3 = -22.0, r4 = -21.0,
 &end

# 22 ILE PHI:  (21 ILE C)-(22 ILE N)-(22 ILE CA)-(22 ILE C) -90.0 -42.0
 &rst     iat =   357,   359,   361,   376,
   r1 = -91.0, r2 = -90.0, r3 = -42.0, r4 = -41.0,
 &end

# 22 ILE PSI:  (22 ILE N)-(22 ILE CA)-(22 ILE C)-(23 GLN N) -68.0 -16.0
 &rst     iat =   359,   361,   376,   378,
   r1 = -69.0, r2 = -68.0, r3 = -16.0, r4 = -15.0,
 &end

# 24 GLN PHI:  (23 GLN C)-(24 GLN N)-(24 GLN CA)-(24 GLN C) -137.0 -25.0
 &rst     iat =   393,   395,   397,   410,
   r1 = -138.0, r2 = -137.0, r3 = -25.0, r4 = -24.0,
 &end

# 24 GLN PSI:  (24 GLN N)-(24 GLN CA)-(24 GLN C)-(25 ASN N) -75.0  29.0
 &rst     iat =   395,   397,   410,   412,
   r1 = -76.0, r2 = -75.0, r3 =  29.0, r4 =  30.0,
 &end

# 27 SER PHI:  (26 PRO C)-(27 SER N)-(27 SER CA)-(27 SER C) -124.0 -40.0
 &rst     iat =   438,   440,   442,   449,
   r1 = -125.0, r2 = -124.0, r3 = -40.0, r4 = -39.0,
 &end

# 27 SER PSI:  (27 SER N)-(27 SER CA)-(27 SER C)-(28 LEU N) -72.0  40.0
 &rst     iat =   440,   442,   449,   451,
   r1 = -73.0, r2 = -72.0, r3 =  40.0, r4 =  41.0,
 &end

# 28 LEU PHI:  (27 SER C)-(28 LEU N)-(28 LEU CA)-(28 LEU C) -101.0 -37.0
 &rst     iat =   449,   451,   453,   468,
   r1 = -102.0, r2 = -101.0, r3 = -37.0, r4 = -36.0,
 &end

# 31 ALA PHI:  (30 PRO C)-(31 ALA N)-(31 ALA CA)-(31 ALA C) -118.0 -34.0
 &rst     iat =   501,   503,   505,   511,
   r1 = -119.0, r2 = -118.0, r3 = -34.0, r4 = -33.0,
 &end

# 31 ALA PSI:  (31 ALA N)-(31 ALA CA)-(31 ALA C)-(32 LEU N) -83.0  29.0
 &rst     iat =   503,   505,   511,   513,
   r1 = -84.0, r2 = -83.0, r3 =  29.0, r4 =  30.0,
 &end

# 32 LEU PHI:  (31 ALA C)-(32 LEU N)-(32 LEU CA)-(32 LEU C) -86.0 -42.0
 &rst     iat =   511,   513,   515,   530,
   r1 = -87.0, r2 = -86.0, r3 = -42.0, r4 = -41.0,
 &end

# 32 LEU PSI:  (32 LEU N)-(32 LEU CA)-(32 LEU C)-(33 LEU N) -68.0  -8.0
 &rst     iat =   513,   515,   530,   532,
   r1 = -69.0, r2 = -68.0, r3 =  -8.0, r4 =  -7.0,
 &end

# 34 GLN PSI:  (34 GLN N)-(34 GLN CA)-(34 GLN C)-(35 GLN N) -66.0 -14.0
 &rst     iat =   551,   553,   566,   568,
   r1 = -67.0, r2 = -66.0, r3 = -14.0, r4 = -13.0,
 &end

# 35 GLN PHI:  (34 GLN C)-(35 GLN N)-(35 GLN CA)-(35 GLN C) -88.0 -44.0
 &rst     iat =   566,   568,   570,   583,
   r1 = -89.0, r2 = -88.0, r3 = -44.0, r4 = -43.0,
 &end

# 35 GLN PSI:  (35 GLN N)-(35 GLN CA)-(35 GLN C)-(36 ILE N) -62.0 -18.0
 &rst     iat =   568,   570,   583,   585,
   r1 = -63.0, r2 = -62.0, r3 = -18.0, r4 = -17.0,
 &end

# 36 ILE PHI:  (35 GLN C)-(36 ILE N)-(36 ILE CA)-(36 ILE C) -94.0 -42.0
 &rst     iat =   583,   585,   587,   602,
   r1 = -95.0, r2 = -94.0, r3 = -42.0, r4 = -41.0,
 &end

# 36 ILE PSI:  (36 ILE N)-(36 ILE CA)-(36 ILE C)-(37 GLY N) -55.0 -23.0
 &rst     iat =   585,   587,   602,   604,
   r1 = -56.0, r2 = -55.0, r3 = -23.0, r4 = -22.0,
 &end

# 38 ARG PHI:  (37 GLY C)-(38 ARG N)-(38 ARG CA)-(38 ARG C) -106.0 -30.0
 &rst     iat =   609,   611,   613,   633,
   r1 = -107.0, r2 = -106.0, r3 = -30.0, r4 = -29.0,
 &end

# 38 ARG PSI:  (38 ARG N)-(38 ARG CA)-(38 ARG C)-(39 GLU N) -64.0   0.0
 &rst     iat =   611,   613,   633,   635,
   r1 = -65.0, r2 = -64.0, r3 =   0.0, r4 =   1.0,
 &end

# 42 GLN PHI:  (41 PRO C)-(42 GLN N)-(42 GLN CA)-(42 GLN C) -111.0 -35.0
 &rst     iat =   676,   678,   680,   693,
   r1 = -112.0, r2 = -111.0, r3 = -35.0, r4 = -34.0,
 &end

# 42 GLN PSI:  (42 GLN N)-(42 GLN CA)-(42 GLN C)-(43 LEU N) -84.0  24.0
 &rst     iat =   678,   680,   693,   695,
   r1 = -85.0, r2 = -84.0, r3 =  24.0, r4 =  25.0,
 &end

# 43 LEU PHI:  (42 GLN C)-(43 LEU N)-(43 LEU CA)-(43 LEU C) -84.0 -44.0
 &rst     iat =   693,   695,   697,   712,
   r1 = -85.0, r2 = -84.0, r3 = -44.0, r4 = -43.0,
 &end

# 43 LEU PSI:  (43 LEU N)-(43 LEU CA)-(43 LEU C)-(44 LEU N) -76.0  -4.0
 &rst     iat =   695,   697,   712,   714,
   r1 = -77.0, r2 = -76.0, r3 =  -4.0, r4 =  -3.0,
 &end

# 45 GLN PHI:  (44 LEU C)-(45 GLN N)-(45 GLN CA)-(45 GLN C) -91.0 -43.0
 &rst     iat =   731,   733,   735,   748,
   r1 = -92.0, r2 = -91.0, r3 = -43.0, r4 = -42.0,
 &end

# 45 GLN PSI:  (45 GLN N)-(45 GLN CA)-(45 GLN C)-(46 GLN N) -61.0 -21.0
 &rst     iat =   733,   735,   748,   750,
   r1 = -62.0, r2 = -61.0, r3 = -21.0, r4 = -20.0,
 &end

# 46 GLN PHI:  (45 GLN C)-(46 GLN N)-(46 GLN CA)-(46 GLN C) -83.0 -47.0
 &rst     iat =   748,   750,   752,   765,
   r1 = -84.0, r2 = -83.0, r3 = -47.0, r4 = -46.0,
 &end

# 46 GLN PSI:  (46 GLN N)-(46 GLN CA)-(46 GLN C)-(47 ILE N) -63.0 -19.0
 &rst     iat =   750,   752,   765,   767,
   r1 = -64.0, r2 = -63.0, r3 = -19.0, r4 = -18.0,
 &end

# 47 ILE PHI:  (46 GLN C)-(47 ILE N)-(47 ILE CA)-(47 ILE C) -90.0 -46.0
 &rst     iat =   765,   767,   769,   784,
   r1 = -91.0, r2 = -90.0, r3 = -46.0, r4 = -45.0,
 &end

# 47 ILE PSI:  (47 ILE N)-(47 ILE CA)-(47 ILE C)-(48 SER N) -67.0 -19.0
 &rst     iat =   767,   769,   784,   786,
   r1 = -68.0, r2 = -67.0, r3 = -19.0, r4 = -18.0,
 &end

# 48 SER PHI:  (47 ILE C)-(48 SER N)-(48 SER CA)-(48 SER C) -89.0 -37.0
 &rst     iat =   784,   786,   788,   795,
   r1 = -90.0, r2 = -89.0, r3 = -37.0, r4 = -36.0,
 &end

# 48 SER PSI:  (48 SER N)-(48 SER CA)-(48 SER C)-(49 GLN N) -71.0   1.0
 &rst     iat =   786,   788,   795,   797,
   r1 = -72.0, r2 = -71.0, r3 =   1.0, r4 =   2.0,
 &end

# 54 PHE PHI:  (53 HID C)-(54 PHE N)-(54 PHE CA)-(54 PHE C) -87.0 -47.0
 &rst     iat =   878,   880,   882,   898,
   r1 = -88.0, r2 = -87.0, r3 = -47.0, r4 = -46.0,
 &end

# 54 PHE PSI:  (54 PHE N)-(54 PHE CA)-(54 PHE C)-(55 ILE N) -59.0 -23.0
 &rst     iat =   880,   882,   898,   900,
   r1 = -60.0, r2 = -59.0, r3 = -23.0, r4 = -22.0,
 &end

# 55 ILE PHI:  (54 PHE C)-(55 ILE N)-(55 ILE CA)-(55 ILE C) -90.0 -42.0
 &rst     iat =   898,   900,   902,   917,
   r1 = -91.0, r2 = -90.0, r3 = -42.0, r4 = -41.0,
 &end

# 55 ILE PSI:  (55 ILE N)-(55 ILE CA)-(55 ILE C)-(56 GLN N) -69.0 -13.0
 &rst     iat =   900,   902,   917,   919,
   r1 = -70.0, r2 = -69.0, r3 = -13.0, r4 = -12.0,
 &end

# 56 GLN PHI:  (55 ILE C)-(56 GLN N)-(56 GLN CA)-(56 GLN C) -87.0 -35.0
 &rst     iat =   917,   919,   921,   934,
   r1 = -88.0, r2 = -87.0, r3 = -35.0, r4 = -34.0,
 &end

# 56 GLN PSI:  (56 GLN N)-(56 GLN CA)-(56 GLN C)-(57 MET N) -66.0 -14.0
 &rst     iat =   919,   921,   934,   936,
   r1 = -67.0, r2 = -66.0, r3 = -14.0, r4 = -13.0,
 &end

# 58 LEU PHI:  (57 MET C)-(58 LEU N)-(58 LEU CA)-(58 LEU C) -88.0 -44.0
 &rst     iat =   951,   953,   955,   970,
   r1 = -89.0, r2 = -88.0, r3 = -44.0, r4 = -43.0,
 &end

# 58 LEU PSI:  (58 LEU N)-(58 LEU CA)-(58 LEU C)-(59 ASN N) -61.0 -13.0
 &rst     iat =   953,   955,   970,   972,
   r1 = -62.0, r2 = -61.0, r3 = -13.0, r4 = -12.0,
 &end

#
#    3 HIS  HA       3 HIS  HB2    3.350   (#SUP   1.00 )
 &rst
  ixpk= 1, nxpk= 0, iat=  24,  26, r1= 1.30, r2= 1.80, r3= 3.35, r4= 3.85, 
      rk2=20.0, rk3=20.0, ir6=1, ialtd=0,
 &end
#
#    3 HIS  HA       3 HIS  HB3    3.300   (#SUP   1.00 )
 &rst
  ixpk= 1, nxpk= 0, iat=  24,  27, r1= 1.30, r2= 1.80, r3= 3.30, r4= 3.80,  &end
#
#    4 MET  HA       4 MET  HB2    3.600   (#SUP   3.87 )
 &rst
  ixpk= 3, nxpk= 0, iat=  41,  43, r1= 1.30, r2= 1.80, r3= 3.60, r4= 4.10,  &end
#
#    4 MET  HA       4 MET  HB3    3.890   (#SUP   3.87 )
 &rst
  ixpk= 3, nxpk= 0, iat=  41,  44, r1= 1.30, r2= 1.80, r3= 3.89, r4= 4.39,  &end
#
#    4 MET  HA       4 MET  HG3    3.850   (#SUP   3.89 )
 &rst
  ixpk= 3, nxpk= 0, iat=  41,  47, r1= 1.30, r2= 1.80, r3= 3.85, r4= 4.35,  &end
#
#    4 MET  HA       5 PRO  HD2    3.370   (#SUP   2.84 )
 &rst
  ixpk= 2, nxpk= 0, iat=  41,  57, r1= 1.30, r2= 1.80, r3= 3.37, r4= 3.87,  &end
#
#    4 MET  HA       5 PRO  HD3    3.620   (#SUP   3.81 )
 &rst
  ixpk= 3, nxpk= 0, iat=  41,  58, r1= 1.30, r2= 1.80, r3= 3.62, r4= 4.12,  &end
#
#    4 MET  HB2      4 MET  HG2    3.110   (#SUP   3.00 )
 &rst
  ixpk= 3, nxpk= 0, iat=  43,  46, r1= 1.30, r2= 1.80, r3= 3.11, r4= 3.61,  &end
#
#    4 MET  HB2      4 MET  HG3    2.960   (#SUP   2.96 )
 &rst
  ixpk= 2, nxpk= 0, iat=  43,  47, r1= 1.30, r2= 1.80, r3= 2.96, r4= 3.46,  &end
#
#    4 MET  HB3      4 MET  HG2    2.930   (#SUP   3.00 )
 &rst
  ixpk= 3, nxpk= 0, iat=  44,  46, r1= 1.30, r2= 1.80, r3= 2.93, r4= 3.43,  &end
#
#    4 MET  HB3      4 MET  HG3    3.050   (#SUP   2.96 )
 &rst
  ixpk= 2, nxpk= 0, iat=  44,  47, r1= 1.30, r2= 1.80, r3= 3.05, r4= 3.55,  &end
#
#    4 MET  HG2      4 MET  HG3    2.460   (#SUP   2.96 )
 &rst
  ixpk= 2, nxpk= 0, iat=  46,  47, r1= 1.30, r2= 1.80, r3= 2.46, r4= 2.96,  &end
#
#    5 PRO  HA       5 PRO  HB2    3.340   (#SUP   4.90 )
 &rst
  ixpk= 4, nxpk= 0, iat=  66,  63, r1= 1.30, r2= 1.80, r3= 3.34, r4= 3.84,  &end
#
#    5 PRO  HA       5 PRO  HB3    3.790   (#SUP   4.90 )
 &rst
  ixpk= 4, nxpk= 0, iat=  66,  64, r1= 1.30, r2= 1.80, r3= 3.79, r4= 4.29,  &end
#
#    5 PRO  HA       5 PRO  HD3    5.080   (#SUP   6.31 )
 &rst
  ixpk= 6, nxpk= 0, iat=  66,  58, r1= 1.30, r2= 1.80, r3= 5.08, r4= 5.58,  &end
#
#    5 PRO  HA       5 PRO  HG2    3.800   (#SUP   5.61 )
 &rst
  ixpk= 5, nxpk= 0, iat=  66,  60, r1= 1.30, r2= 1.80, r3= 3.80, r4= 4.30,  &end
#
#    5 PRO  HA       5 PRO  HG3    4.290   (#SUP   5.31 )
 &rst
  ixpk= 5, nxpk= 0, iat=  66,  61, r1= 1.30, r2= 1.80, r3= 4.29, r4= 4.79,  &end
#
#    5 PRO  HB2      5 PRO  HB3    2.830   (#SUP   3.00 )
 &rst
  ixpk= 3, nxpk= 0, iat=  63,  64, r1= 1.30, r2= 1.80, r3= 2.83, r4= 3.33,  &end
#
#    5 PRO  HB2      5 PRO  HG2    3.290   (#SUP   5.18 )
 &rst
  ixpk= 5, nxpk= 0, iat=  63,  60, r1= 1.30, r2= 1.80, r3= 3.29, r4= 3.79,  &end
#
#    5 PRO  HB2      5 PRO  HG3    3.500   (#SUP   4.90 )
 &rst
  ixpk= 4, nxpk= 0, iat=  63,  61, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#    5 PRO  HB3      5 PRO  HG2    3.410   (#SUP   5.18 )
 &rst
  ixpk= 5, nxpk= 0, iat=  64,  60, r1= 1.30, r2= 1.80, r3= 3.41, r4= 3.91,  &end
#
#    5 PRO  HB3      5 PRO  HG3    3.210   (#SUP   4.90 )
 &rst
  ixpk= 4, nxpk= 0, iat=  64,  61, r1= 1.30, r2= 1.80, r3= 3.21, r4= 3.71,  &end
#
#    5 PRO  HD2      5 PRO  HD3    2.700   (#SUP   3.97 )
 &rst
  ixpk= 3, nxpk= 0, iat=  57,  58, r1= 1.30, r2= 1.80, r3= 2.70, r4= 3.20,  &end
#
#    5 PRO  HD2      5 PRO  HG2    3.520   (#SUP   5.57 )
 &rst
  ixpk= 5, nxpk= 0, iat=  57,  60, r1= 1.30, r2= 1.80, r3= 3.52, r4= 4.02,  &end
#
#    5 PRO  HD2      5 PRO  HG3    3.690   (#SUP   5.29 )
 &rst
  ixpk= 5, nxpk= 0, iat=  57,  61, r1= 1.30, r2= 1.80, r3= 3.69, r4= 4.19,  &end
#
#    5 PRO  HD3      5 PRO  HG2    3.750   (#SUP   5.69 )
 &rst
  ixpk= 5, nxpk= 0, iat=  58,  60, r1= 1.30, r2= 1.80, r3= 3.75, r4= 4.25,  &end
#
#    5 PRO  HD3      5 PRO  HG3    3.440   (#SUP   5.39 )
 &rst
  ixpk= 5, nxpk= 0, iat=  58,  61, r1= 1.30, r2= 1.80, r3= 3.44, r4= 3.94,  &end
#
#    5 PRO  HG2      5 PRO  HG3    2.620   (#SUP   5.31 )
 &rst
  ixpk= 5, nxpk= 0, iat=  60,  61, r1= 1.30, r2= 1.80, r3= 2.62, r4= 3.12,  &end
#
#    5 PRO  HG2      6 LEU  QD1    3.960   (#SUP   3.66 )
 &rst
  ixpk= 3, nxpk= 0, iat=  60,  -1, r1= 1.30, r2= 1.80, r3= 4.76, r4= 5.26,
 igr2=  79,  80,  81,
 &end
#
#    6 LEU  HA       6 LEU  HB2    4.270   (#SUP   4.63 )
 &rst
  ixpk= 4, nxpk= 0, iat=  72,  74, r1= 1.30, r2= 1.80, r3= 4.27, r4= 4.77,  &end
#
#    6 LEU  HA       6 LEU  HB3    3.320   (#SUP   3.25 )
 &rst
  ixpk= 3, nxpk= 0, iat=  72,  75, r1= 1.30, r2= 1.80, r3= 3.32, r4= 3.82,  &end
#
#    6 LEU  HA       6 LEU  QD2    3.430   (#SUP   4.74 )
 &rst
  ixpk= 4, nxpk= 0, iat=  72,  -1, r1= 1.30, r2= 1.80, r3= 4.12, r4= 4.62,
 igr2=  83,  84,  85,
 &end
#
#    6 LEU  HB2      6 LEU  HB3    2.710   (#SUP   4.75 )
 &rst
  ixpk= 4, nxpk= 0, iat=  74,  75, r1= 1.30, r2= 1.80, r3= 2.71, r4= 3.21,  &end
#
#    6 LEU  HB2      6 LEU  HG     3.350   (#SUP   4.68 )
 &rst
  ixpk= 4, nxpk= 0, iat=  74,  77, r1= 1.30, r2= 1.80, r3= 3.35, r4= 3.85,  &end
#
#    6 LEU  HB2      6 LEU  QD1    3.380   (#SUP   3.89 )
 &rst
  ixpk= 3, nxpk= 0, iat=  74,  -1, r1= 1.30, r2= 1.80, r3= 4.06, r4= 4.56,
 igr2=  79,  80,  81,
 &end
#
#    6 LEU  HB2      6 LEU  QD2    3.680   (#SUP   4.97 )
 &rst
  ixpk= 4, nxpk= 0, iat=  74,  -1, r1= 1.30, r2= 1.80, r3= 4.42, r4= 4.92,
 igr2=  83,  84,  85,
 &end
#
#    6 LEU  HB2      9 LEU  QD1    3.770   (#SUP   2.08 )
 &rst
  ixpk= 2, nxpk= 0, iat=  74,  -1, r1= 1.30, r2= 1.80, r3= 4.53, r4= 5.03,
 igr2= 133, 134, 135,
 &end
#
#    6 LEU  HB3      9 LEU  QD1    4.070   (#SUP   1.30 )
 &rst
  ixpk= 1, nxpk= 0, iat=  75,  -1, r1= 1.30, r2= 1.80, r3= 4.89, r4= 5.39,
 igr2= 133, 134, 135,
 &end
#
#    6 LEU  HG       6 LEU  QD1    2.750   (#SUP   2.85 )
 &rst
  ixpk= 2, nxpk= 0, iat=  77,  -1, r1= 1.30, r2= 1.80, r3= 3.30, r4= 3.80,
 igr2=  79,  80,  81,
 &end
#
#    6 LEU  HG       6 LEU  QD2    3.300   (#SUP   3.71 )
 &rst
  ixpk= 3, nxpk= 0, iat=  77,  -1, r1= 1.30, r2= 1.80, r3= 3.96, r4= 4.46,
 igr2=  83,  84,  85,
 &end
#
#    6 LEU  QD1      6 LEU  QD2    3.100   (#SUP   3.07 )
 &rst
  ixpk= 3, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.47, r4= 4.97,
 igr1=  79,  80,  81,
 igr2=  83,  84,  85,
 &end
#
#    6 LEU  QD1     47 ILE  HA     3.640   (#SUP   2.86 )
 &rst
  ixpk= 2, nxpk= 0, iat=  -1, 770, r1= 1.30, r2= 1.80, r3= 4.37, r4= 4.87,
 igr1=  79,  80,  81,
 &end
#
#    6 LEU  QD1     47 ILE  HG13   4.820   (#SUP   2.96 )
 &rst
  ixpk= 2, nxpk= 0, iat=  -1, 779, r1= 1.30, r2= 1.80, r3= 5.79, r4= 6.29,
 igr1=  79,  80,  81,
 &end
#
#    6 LEU  QD1     47 ILE  QG2    4.220   (#SUP   1.50 )
 &rst
  ixpk= 1, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.09, r4= 6.59,
 igr1=  79,  80,  81,
 igr2= 774, 775, 776,
 &end
#
#    6 LEU  QD1     50 HIS  HB2    4.820   (#SUP   1.50 )
 &rst
  ixpk= 1, nxpk= 0, iat=  -1, 819, r1= 1.30, r2= 1.80, r3= 5.79, r4= 6.29,
 igr1=  79,  80,  81,
 &end
#
#    6 LEU  QD1     50 HIS  HB3    3.870   (#SUP   2.96 )
 &rst
  ixpk= 2, nxpk= 0, iat=  -1, 820, r1= 1.30, r2= 1.80, r3= 4.65, r4= 5.15,
 igr1=  79,  80,  81,
 &end
#
#    6 LEU  QD1     53 HIS  QB     3.800   (#SUP   1.66 )
 &rst
  ixpk= 1, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.12, r4= 5.62,
 igr1=  79,  80,  81,
 igr2= 868, 869,
 &end
#
#    6 LEU  QD1     54 PHE  HA     3.700   (#SUP   2.59 )
 &rst
  ixpk= 2, nxpk= 0, iat=  -1, 883, r1= 1.30, r2= 1.80, r3= 4.44, r4= 4.94,
 igr1=  79,  80,  81,
 &end
#
#    6 LEU  QD1     54 PHE  HB2    4.400   (#SUP   2.59 )
 &rst
  ixpk= 2, nxpk= 0, iat=  -1, 885, r1= 1.30, r2= 1.80, r3= 5.28, r4= 5.78,
 igr1=  79,  80,  81,
 &end
#
#    6 LEU  QD1     54 PHE  HB3    3.690   (#SUP   2.59 )
 &rst
  ixpk= 2, nxpk= 0, iat=  -1, 886, r1= 1.30, r2= 1.80, r3= 4.43, r4= 4.93,
 igr1=  79,  80,  81,
 &end
#
#    6 LEU  QD2     46 GLN  HB2    4.440   (#SUP   3.15 )
 &rst
  ixpk= 3, nxpk= 0, iat=  -1, 755, r1= 1.30, r2= 1.80, r3= 5.33, r4= 5.83,
 igr1=  83,  84,  85,
 &end
#
#    6 LEU  QD2     46 GLN  HB3    3.900   (#SUP   3.15 )
 &rst
  ixpk= 3, nxpk= 0, iat=  -1, 756, r1= 1.30, r2= 1.80, r3= 4.68, r4= 5.18,
 igr1=  83,  84,  85,
 &end
#
#    6 LEU  QD2     47 ILE  HA     3.760   (#SUP   5.31 )
 &rst
  ixpk= 5, nxpk= 0, iat=  -1, 770, r1= 1.30, r2= 1.80, r3= 4.52, r4= 5.02,
 igr1=  83,  84,  85,
 &end
#
#    6 LEU  QD2     47 ILE  HG12   4.160   (#SUP   3.61 )
 &rst
  ixpk= 3, nxpk= 0, iat=  -1, 778, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50,
 igr1=  83,  84,  85,
 &end
#
#    6 LEU  QD2     47 ILE  HG13   3.790   (#SUP   4.87 )
 &rst
  ixpk= 4, nxpk= 0, iat=  -1, 779, r1= 1.30, r2= 1.80, r3= 4.55, r4= 5.05,
 igr1=  83,  84,  85,
 &end
#
#    6 LEU  QD2     50 HIS  HB3    4.360   (#SUP   0.75 )
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 820, r1= 1.30, r2= 1.80, r3= 5.24, r4= 5.74,
 igr1=  83,  84,  85,
 &end
#
#    7 GLU- HA       7 GLU- HB2    3.470   (#SUP   3.25 )
 &rst
  ixpk= 3, nxpk= 0, iat=  91,  93, r1= 1.30, r2= 1.80, r3= 3.47, r4= 3.97,  &end
#
#    7 GLU- HA       7 GLU- HB3    3.380   (#SUP   3.97 )
 &rst
  ixpk= 3, nxpk= 0, iat=  91,  94, r1= 1.30, r2= 1.80, r3= 3.38, r4= 3.88,  &end
#
#    7 GLU- HA       7 GLU- QG     3.640   (#SUP   3.31 )
 &rst
  ixpk= 3, nxpk= 0, iat=  91,  -1, r1= 1.30, r2= 1.80, r3= 4.09, r4= 4.59,
 igr2=  96,  97,
 &end
#
#    7 GLU- HA      10 ARG+ QB     3.360   (#SUP   1.50 )
 &rst
  ixpk= 1, nxpk= 0, iat=  91,  -1, r1= 1.30, r2= 1.80, r3= 3.77, r4= 4.27,
 igr2= 147, 148,
 &end
#
#    7 GLU- HB2      7 GLU- QG     3.000   (#SUP   2.96 )
 &rst
  ixpk= 2, nxpk= 0, iat=  93,  -1, r1= 1.30, r2= 1.80, r3= 3.37, r4= 3.87,
 igr2=  96,  97,
 &end
#
#    7 GLU- HB3      7 GLU- QG     2.970   (#SUP   3.30 )
 &rst
  ixpk= 3, nxpk= 0, iat=  94,  -1, r1= 1.30, r2= 1.80, r3= 3.33, r4= 3.83,
 igr2=  96,  97,
 &end
#
#    8 PHE  HA       8 PHE  HB2    3.290   (#SUP   3.00 )
 &rst
  ixpk= 3, nxpk= 0, iat= 106, 108, r1= 1.30, r2= 1.80, r3= 3.29, r4= 3.79,  &end
#
#    8 PHE  HA       8 PHE  HB3    3.320   (#SUP   3.00 )
 &rst
  ixpk= 3, nxpk= 0, iat= 106, 109, r1= 1.30, r2= 1.80, r3= 3.32, r4= 3.82,  &end
#
#    8 PHE  HB2      8 PHE  HB3    2.550   (#SUP   3.00 )
 &rst
  ixpk= 3, nxpk= 0, iat= 108, 109, r1= 1.30, r2= 1.80, r3= 2.55, r4= 3.05,  &end
#
#    9 LEU  HA       9 LEU  HB2    3.980   (#SUP   5.80 )
 &rst
  ixpk= 5, nxpk= 0, iat= 126, 128, r1= 1.30, r2= 1.80, r3= 3.98, r4= 4.48,  &end
#
#    9 LEU  HA       9 LEU  HB3    3.690   (#SUP   5.62 )
 &rst
  ixpk= 5, nxpk= 0, iat= 126, 129, r1= 1.30, r2= 1.80, r3= 3.69, r4= 4.19,  &end
#
#    9 LEU  HA       9 LEU  HG     4.410   (#SUP   4.76 )
 &rst
  ixpk= 4, nxpk= 0, iat= 126, 131, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,  &end
#
#    9 LEU  HA       9 LEU  QD1    4.110   (#SUP   5.03 )
 &rst
  ixpk= 5, nxpk= 0, iat= 126,  -1, r1= 1.30, r2= 1.80, r3= 4.94, r4= 5.44,
 igr2= 133, 134, 135,
 &end
#
#    9 LEU  HA       9 LEU  QD2    3.400   (#SUP   5.13 )
 &rst
  ixpk= 5, nxpk= 0, iat= 126,  -1, r1= 1.30, r2= 1.80, r3= 4.08, r4= 4.58,
 igr2= 137, 138, 139,
 &end
#
#    9 LEU  HA      12 GLN  HG2    4.050   (#SUP   2.25 )
 &rst
  ixpk= 2, nxpk= 0, iat= 126, 188, r1= 1.30, r2= 1.80, r3= 4.05, r4= 4.55,  &end
#
#    9 LEU  HA      12 GLN  HG3    4.020   (#SUP   2.25 )
 &rst
  ixpk= 2, nxpk= 0, iat= 126, 189, r1= 1.30, r2= 1.80, r3= 4.02, r4= 4.52,  &end
#
#    9 LEU  HA      12 GLN  QB     4.390   (#SUP   2.25 )
 &rst
  ixpk= 2, nxpk= 0, iat= 126,  -1, r1= 1.30, r2= 1.80, r3= 4.93, r4= 5.43,
 igr2= 185, 186,
 &end
#
#    9 LEU  HB2      9 LEU  QD1    3.510   (#SUP   2.31 )
 &rst
  ixpk= 2, nxpk= 0, iat= 128,  -1, r1= 1.30, r2= 1.80, r3= 4.22, r4= 4.72,
 igr2= 133, 134, 135,
 &end
#
#    9 LEU  QD1     43 LEU  QD1    3.780   (#SUP   0.75 )
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.45, r4= 5.95,
 igr1= 133, 134, 135,
 igr2= 705, 706, 707,
 &end
#
#    9 LEU  QD2     43 LEU  QD1    3.660   (#SUP   0.75 )
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.28, r4= 5.78,
 igr1= 137, 138, 139,
 igr2= 705, 706, 707,
 &end
#
#   10 ARG+ HA      10 ARG+ QB     3.260   (#SUP   4.40 )
 &rst
  ixpk= 4, nxpk= 0, iat= 145,  -1, r1= 1.30, r2= 1.80, r3= 3.66, r4= 4.16,
 igr2= 147, 148,
 &end
#
#   10 ARG+ HA      10 ARG+ QG     3.570   (#SUP   4.14 )
 &rst
  ixpk= 4, nxpk= 0, iat= 145,  -1, r1= 1.30, r2= 1.80, r3= 4.01, r4= 4.51,
 igr2= 150, 151,
 &end
#
#   10 ARG+ HD2     10 ARG+ HD3    2.520   (#SUP   2.00 )
 &rst
  ixpk= 2, nxpk= 0, iat= 153, 154, r1= 1.30, r2= 1.80, r3= 2.52, r4= 3.02,  &end
#
#   10 ARG+ HD2     10 ARG+ QB     3.620   (#SUP   3.55 )
 &rst
  ixpk= 3, nxpk= 0, iat= 153,  -1, r1= 1.30, r2= 1.80, r3= 4.06, r4= 4.56,
 igr2= 147, 148,
 &end
#
#   10 ARG+ HD2     10 ARG+ QG     3.280   (#SUP   3.29 )
 &rst
  ixpk= 3, nxpk= 0, iat= 153,  -1, r1= 1.30, r2= 1.80, r3= 3.68, r4= 4.18,
 igr2= 150, 151,
 &end
#
#   10 ARG+ HD3     10 ARG+ QB     3.580   (#SUP   3.55 )
 &rst
  ixpk= 3, nxpk= 0, iat= 154,  -1, r1= 1.30, r2= 1.80, r3= 4.02, r4= 4.52,
 igr2= 147, 148,
 &end
#
#   10 ARG+ HD3     10 ARG+ QG     3.520   (#SUP   3.29 )
 &rst
  ixpk= 3, nxpk= 0, iat= 154,  -1, r1= 1.30, r2= 1.80, r3= 3.95, r4= 4.45,
 igr2= 150, 151,
 &end
#
#   10 ARG+ QB      10 ARG+ QG     2.710   (#SUP   6.15 )
 &rst
  ixpk= 6, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 3.41, r4= 3.91,
 igr1= 147, 148,
 igr2= 150, 151,
 &end
#
#   11 ASN  HB2     11 ASN  HB3    2.450   (#SUP   3.30 )
 &rst
  ixpk= 3, nxpk= 0, iat= 171, 172, r1= 1.30, r2= 1.80, r3= 2.45, r4= 2.95,  &end
#
#   12 GLN  HG2     12 GLN  HG3    2.530   (#SUP   1.93 )
 &rst
  ixpk= 1, nxpk= 0, iat= 188, 189, r1= 1.30, r2= 1.80, r3= 2.53, r4= 3.03,  &end
#
#   12 GLN  HG2     12 GLN  QB     3.130   (#SUP   1.93 )
 &rst
  ixpk= 1, nxpk= 0, iat= 188,  -1, r1= 1.30, r2= 1.80, r3= 3.51, r4= 4.01,
 igr2= 185, 186,
 &end
#
#   13 PRO  HA      13 PRO  HB2    3.280   (#SUP   3.87 )
 &rst
  ixpk= 3, nxpk= 0, iat= 208, 205, r1= 1.30, r2= 1.80, r3= 3.28, r4= 3.78,  &end
#
#   13 PRO  HA      13 PRO  HB3    3.630   (#SUP   4.90 )
 &rst
  ixpk= 4, nxpk= 0, iat= 208, 206, r1= 1.30, r2= 1.80, r3= 3.63, r4= 4.13,  &end
#
#   13 PRO  HB2     13 PRO  HD2    3.680   (#SUP   5.31 )
 &rst
  ixpk= 5, nxpk= 0, iat= 205, 199, r1= 1.30, r2= 1.80, r3= 3.68, r4= 4.18,  &end
#
#   13 PRO  HB2     13 PRO  HG2    3.000   (#SUP   5.00 )
 &rst
  ixpk= 5, nxpk= 0, iat= 205, 202, r1= 1.30, r2= 1.80, r3= 3.00, r4= 3.50,  &end
#
#   13 PRO  HB2     13 PRO  HG3    3.140   (#SUP   5.00 )
 &rst
  ixpk= 5, nxpk= 0, iat= 205, 203, r1= 1.30, r2= 1.80, r3= 3.14, r4= 3.64,  &end
#
#   13 PRO  HB3     13 PRO  HD2    3.830   (#SUP   5.31 )
 &rst
  ixpk= 5, nxpk= 0, iat= 206, 199, r1= 1.30, r2= 1.80, r3= 3.83, r4= 4.33,  &end
#
#   13 PRO  HB3     13 PRO  HD3    4.120   (#SUP   5.31 )
 &rst
  ixpk= 5, nxpk= 0, iat= 206, 200, r1= 1.30, r2= 1.80, r3= 4.12, r4= 4.62,  &end
#
#   13 PRO  HB3     13 PRO  HG3    2.400   (#SUP   5.00 )
 &rst
  ixpk= 5, nxpk= 0, iat= 206, 203, r1= 1.30, r2= 1.80, r3= 2.40, r4= 2.90,  &end
#
#   13 PRO  HD2     13 PRO  HD3    2.720   (#SUP   4.97 )
 &rst
  ixpk= 4, nxpk= 0, iat= 199, 200, r1= 1.30, r2= 1.80, r3= 2.72, r4= 3.22,  &end
#
#   13 PRO  HD2     13 PRO  HG2    3.250   (#SUP   5.31 )
 &rst
  ixpk= 5, nxpk= 0, iat= 199, 202, r1= 1.30, r2= 1.80, r3= 3.25, r4= 3.75,  &end
#
#   13 PRO  HD2     13 PRO  HG3    3.750   (#SUP   4.31 )
 &rst
  ixpk= 4, nxpk= 0, iat= 199, 203, r1= 1.30, r2= 1.80, r3= 3.75, r4= 4.25,  &end
#
#   13 PRO  HD3     13 PRO  HG2    3.290   (#SUP   5.31 )
 &rst
  ixpk= 5, nxpk= 0, iat= 200, 202, r1= 1.30, r2= 1.80, r3= 3.29, r4= 3.79,  &end
#
#   13 PRO  HD3     13 PRO  HG3    3.490   (#SUP   4.30 )
 &rst
  ixpk= 4, nxpk= 0, iat= 200, 203, r1= 1.30, r2= 1.80, r3= 3.49, r4= 3.99,  &end
#
#   13 PRO  HG2     13 PRO  HG3    2.400   (#SUP   5.00 )
 &rst
  ixpk= 5, nxpk= 0, iat= 202, 203, r1= 1.30, r2= 1.80, r3= 2.40, r4= 2.90,  &end
#
#   14 GLN  HA      14 GLN  QB     3.120   (#SUP   2.80 )
 &rst
  ixpk= 2, nxpk= 0, iat= 214,  -1, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,
 igr2= 216, 217,
 &end
#
#   14 GLN  HA      14 GLN  QG     3.380   (#SUP   2.56 )
 &rst
  ixpk= 2, nxpk= 0, iat= 214,  -1, r1= 1.30, r2= 1.80, r3= 3.79, r4= 4.29,
 igr2= 219, 220,
 &end
#
#   14 GLN  QB      14 GLN  QG     2.590   (#SUP   2.70 )
 &rst
  ixpk= 2, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 3.26, r4= 3.76,
 igr1= 216, 217,
 igr2= 219, 220,
 &end
#
#   15 PHE  HA      15 PHE  HB2    4.090   (#SUP   3.00 )
 &rst
  ixpk= 3, nxpk= 0, iat= 231, 233, r1= 1.30, r2= 1.80, r3= 4.09, r4= 4.59,  &end
#
#   15 PHE  HA      15 PHE  HB3    3.580   (#SUP   3.00 )
 &rst
  ixpk= 3, nxpk= 0, iat= 231, 234, r1= 1.30, r2= 1.80, r3= 3.58, r4= 4.08,  &end
#
#   15 PHE  HA      18 MET  HG2    3.670   (#SUP   1.70 )
 &rst
  ixpk= 1, nxpk= 0, iat= 231, 290, r1= 1.30, r2= 1.80, r3= 3.67, r4= 4.17,  &end
#
#   15 PHE  HA      18 MET  HG3    3.570   (#SUP   1.70 )
 &rst
  ixpk= 1, nxpk= 0, iat= 231, 291, r1= 1.30, r2= 1.80, r3= 3.57, r4= 4.07,  &end
#
#   15 PHE  HB2     15 PHE  HB3    2.750   (#SUP   3.00 )
 &rst
  ixpk= 3, nxpk= 0, iat= 233, 234, r1= 1.30, r2= 1.80, r3= 2.75, r4= 3.25,  &end
#
#   16 GLN  HA      16 GLN  QB     2.980   (#SUP   2.57 )
 &rst
  ixpk= 2, nxpk= 0, iat= 251,  -1, r1= 1.30, r2= 1.80, r3= 3.34, r4= 3.84,
 igr2= 253, 254,
 &end
#
#   16 GLN  HA      16 GLN  QG     3.710   (#SUP   2.53 )
 &rst
  ixpk= 2, nxpk= 0, iat= 251,  -1, r1= 1.30, r2= 1.80, r3= 4.16, r4= 4.66,
 igr2= 256, 257,
 &end
#
#   16 GLN  QB      16 GLN  QG     2.560   (#SUP   2.55 )
 &rst
  ixpk= 2, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 3.23, r4= 3.73,
 igr1= 253, 254,
 igr2= 256, 257,
 &end
#
#   17 GLN  HA      17 GLN  HB2    3.280   (#SUP   4.97 )
 &rst
  ixpk= 4, nxpk= 0, iat= 268, 270, r1= 1.30, r2= 1.80, r3= 3.28, r4= 3.78,  &end
#
#   17 GLN  HA      17 GLN  HB3    3.370   (#SUP   4.26 )
 &rst
  ixpk= 4, nxpk= 0, iat= 268, 271, r1= 1.30, r2= 1.80, r3= 3.37, r4= 3.87,  &end
#
#   17 GLN  HA      17 GLN  HG2    3.660   (#SUP   4.94 )
 &rst
  ixpk= 4, nxpk= 0, iat= 268, 273, r1= 1.30, r2= 1.80, r3= 3.66, r4= 4.16,  &end
#
#   17 GLN  HA      17 GLN  HG3    3.430   (#SUP   5.11 )
 &rst
  ixpk= 5, nxpk= 0, iat= 268, 274, r1= 1.30, r2= 1.80, r3= 3.43, r4= 3.93,  &end
#
#   17 GLN  HA      20 GLN  QB     3.330   (#SUP   1.50 )
 &rst
  ixpk= 1, nxpk= 0, iat= 268,  -1, r1= 1.30, r2= 1.80, r3= 3.74, r4= 4.24,
 igr2= 328, 329,
 &end
#
#   17 GLN  HB2     17 GLN  HB3    2.400   (#SUP   3.31 )
 &rst
  ixpk= 3, nxpk= 0, iat= 270, 271, r1= 1.30, r2= 1.80, r3= 2.40, r4= 2.90,  &end
#
#   17 GLN  HB2     17 GLN  HG2    3.500   (#SUP   3.94 )
 &rst
  ixpk= 3, nxpk= 0, iat= 270, 273, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   17 GLN  HB3     17 GLN  HG2    3.860   (#SUP   3.62 )
 &rst
  ixpk= 3, nxpk= 0, iat= 271, 273, r1= 1.30, r2= 1.80, r3= 3.86, r4= 4.36,  &end
#
#   17 GLN  HB3     21 ILE  QD1    4.010   (#SUP   0.56 )
 &rst
  ixpk= 0, nxpk= 0, iat= 271,  -1, r1= 1.30, r2= 1.80, r3= 4.82, r4= 5.32,
 igr2= 354, 355, 356,
 &end
#
#   18 MET  HA      18 MET  HB2    3.770   (#SUP   4.31 )
 &rst
  ixpk= 4, nxpk= 0, iat= 285, 287, r1= 1.30, r2= 1.80, r3= 3.77, r4= 4.27,  &end
#
#   18 MET  HA      18 MET  HB3    3.990   (#SUP   4.97 )
 &rst
  ixpk= 4, nxpk= 0, iat= 285, 288, r1= 1.30, r2= 1.80, r3= 3.99, r4= 4.49,  &end
#
#   18 MET  HA      18 MET  HG2    3.900   (#SUP   5.00 )
 &rst
  ixpk= 5, nxpk= 0, iat= 285, 290, r1= 1.30, r2= 1.80, r3= 3.90, r4= 4.40,  &end
#
#   18 MET  HA      18 MET  HG3    3.900   (#SUP   5.00 )
 &rst
  ixpk= 5, nxpk= 0, iat= 285, 291, r1= 1.30, r2= 1.80, r3= 3.90, r4= 4.40,  &end
#
#   18 MET  HA      21 ILE  HB     3.460   (#SUP   1.50 )
 &rst
  ixpk= 1, nxpk= 0, iat= 285, 345, r1= 1.30, r2= 1.80, r3= 3.46, r4= 3.96,  &end
#
#   18 MET  HA      21 ILE  QD1    3.480   (#SUP   2.63 )
 &rst
  ixpk= 2, nxpk= 0, iat= 285,  -1, r1= 1.30, r2= 1.80, r3= 4.18, r4= 4.68,
 igr2= 354, 355, 356,
 &end
#
#   18 MET  HA      32 LEU  QD2    3.540   (#SUP   3.23 )
 &rst
  ixpk= 3, nxpk= 0, iat= 285,  -1, r1= 1.30, r2= 1.80, r3= 4.25, r4= 4.75,
 igr2= 527, 528, 529,
 &end
#
#   18 MET  HB2     18 MET  HB3    2.720   (#SUP   4.30 )
 &rst
  ixpk= 4, nxpk= 0, iat= 287, 288, r1= 1.30, r2= 1.80, r3= 2.72, r4= 3.22,  &end
#
#   18 MET  HB2     18 MET  HG2    3.080   (#SUP   4.42 )
 &rst
  ixpk= 4, nxpk= 0, iat= 287, 290, r1= 1.30, r2= 1.80, r3= 3.08, r4= 3.58,  &end
#
#   18 MET  HB2     18 MET  HG3    3.020   (#SUP   4.31 )
 &rst
  ixpk= 4, nxpk= 0, iat= 287, 291, r1= 1.30, r2= 1.80, r3= 3.02, r4= 3.52,  &end
#
#   18 MET  HB2     32 LEU  QD1    4.100   (#SUP   2.24 )
 &rst
  ixpk= 2, nxpk= 0, iat= 287,  -1, r1= 1.30, r2= 1.80, r3= 4.92, r4= 5.42,
 igr2= 523, 524, 525,
 &end
#
#   18 MET  HB2     32 LEU  QD2    4.150   (#SUP   5.02 )
 &rst
  ixpk= 5, nxpk= 0, iat= 287,  -1, r1= 1.30, r2= 1.80, r3= 4.98, r4= 5.48,
 igr2= 527, 528, 529,
 &end
#
#   18 MET  HB3     18 MET  HG2    2.890   (#SUP   5.00 )
 &rst
  ixpk= 5, nxpk= 0, iat= 288, 290, r1= 1.30, r2= 1.80, r3= 2.89, r4= 3.39,  &end
#
#   18 MET  HB3     18 MET  HG3    3.200   (#SUP   4.97 )
 &rst
  ixpk= 4, nxpk= 0, iat= 288, 291, r1= 1.30, r2= 1.80, r3= 3.20, r4= 3.70,  &end
#
#   18 MET  HB3     21 ILE  QD1    3.680   (#SUP   0.99 )
 &rst
  ixpk= 0, nxpk= 0, iat= 288,  -1, r1= 1.30, r2= 1.80, r3= 4.42, r4= 4.92,
 igr2= 354, 355, 356,
 &end
#
#   18 MET  HB3     32 LEU  QD1    4.190   (#SUP   2.24 )
 &rst
  ixpk= 2, nxpk= 0, iat= 288,  -1, r1= 1.30, r2= 1.80, r3= 5.03, r4= 5.53,
 igr2= 523, 524, 525,
 &end
#
#   18 MET  HB3     32 LEU  QD2    4.110   (#SUP   5.02 )
 &rst
  ixpk= 5, nxpk= 0, iat= 288,  -1, r1= 1.30, r2= 1.80, r3= 4.94, r4= 5.44,
 igr2= 527, 528, 529,
 &end
#
#   18 MET  HG2     18 MET  HG3    2.760   (#SUP   5.00 )
 &rst
  ixpk= 5, nxpk= 0, iat= 290, 291, r1= 1.30, r2= 1.80, r3= 2.76, r4= 3.26,  &end
#
#   18 MET  HG3     32 LEU  QD2    3.690   (#SUP   3.23 )
 &rst
  ixpk= 3, nxpk= 0, iat= 291,  -1, r1= 1.30, r2= 1.80, r3= 4.43, r4= 4.93,
 igr2= 527, 528, 529,
 &end
#
#   18 MET  HG3     58 LEU  QD2    3.900   (#SUP   1.49 )
 &rst
  ixpk= 1, nxpk= 0, iat= 291,  -1, r1= 1.30, r2= 1.80, r3= 4.68, r4= 5.18,
 igr2= 967, 968, 969,
 &end
#
#   19 ARG+ HA      19 ARG+ HG2    3.230   (#SUP   4.63 )
 &rst
  ixpk= 4, nxpk= 0, iat= 302, 307, r1= 1.30, r2= 1.80, r3= 3.23, r4= 3.73,  &end
#
#   19 ARG+ HA      19 ARG+ HG3    3.800   (#SUP   4.63 )
 &rst
  ixpk= 4, nxpk= 0, iat= 302, 308, r1= 1.30, r2= 1.80, r3= 3.80, r4= 4.30,  &end
#
#   19 ARG+ HA      19 ARG+ QB     3.220   (#SUP   4.87 )
 &rst
  ixpk= 4, nxpk= 0, iat= 302,  -1, r1= 1.30, r2= 1.80, r3= 3.61, r4= 4.11,
 igr2= 304, 305,
 &end
#
#   19 ARG+ HA      22 ILE  HB     3.680   (#SUP   2.49 )
 &rst
  ixpk= 2, nxpk= 0, iat= 302, 364, r1= 1.30, r2= 1.80, r3= 3.68, r4= 4.18,  &end
#
#   19 ARG+ HA      22 ILE  QD1    4.420   (#SUP   2.49 )
 &rst
  ixpk= 2, nxpk= 0, iat= 302,  -1, r1= 1.30, r2= 1.80, r3= 5.31, r4= 5.81,
 igr2= 373, 374, 375,
 &end
#
#   19 ARG+ HA      22 ILE  QG2    4.190   (#SUP   2.49 )
 &rst
  ixpk= 2, nxpk= 0, iat= 302,  -1, r1= 1.30, r2= 1.80, r3= 5.03, r4= 5.53,
 igr2= 366, 367, 368,
 &end
#
#   19 ARG+ HA      58 LEU  QD2    3.790   (#SUP   2.27 )
 &rst
  ixpk= 2, nxpk= 0, iat= 302,  -1, r1= 1.30, r2= 1.80, r3= 4.55, r4= 5.05,
 igr2= 967, 968, 969,
 &end
#
#   19 ARG+ HD2     19 ARG+ HD3    2.660   (#SUP   4.00 )
 &rst
  ixpk= 4, nxpk= 0, iat= 310, 311, r1= 1.30, r2= 1.80, r3= 2.66, r4= 3.16,  &end
#
#   19 ARG+ HD2     19 ARG+ HG2    3.580   (#SUP   4.92 )
 &rst
  ixpk= 4, nxpk= 0, iat= 310, 307, r1= 1.30, r2= 1.80, r3= 3.58, r4= 4.08,  &end
#
#   19 ARG+ HD2     19 ARG+ HG3    3.500   (#SUP   4.92 )
 &rst
  ixpk= 4, nxpk= 0, iat= 310, 308, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   19 ARG+ HD2     19 ARG+ QB     3.760   (#SUP   4.38 )
 &rst
  ixpk= 4, nxpk= 0, iat= 310,  -1, r1= 1.30, r2= 1.80, r3= 4.22, r4= 4.72,
 igr2= 304, 305,
 &end
#
#   19 ARG+ HD2     58 LEU  HA     3.850   (#SUP   1.50 )
 &rst
  ixpk= 1, nxpk= 0, iat= 310, 956, r1= 1.30, r2= 1.80, r3= 3.85, r4= 4.35,  &end
#
#   19 ARG+ HD3     19 ARG+ HG2    3.820   (#SUP   4.92 )
 &rst
  ixpk= 4, nxpk= 0, iat= 311, 307, r1= 1.30, r2= 1.80, r3= 3.82, r4= 4.32,  &end
#
#   19 ARG+ HD3     19 ARG+ HG3    3.620   (#SUP   4.92 )
 &rst
  ixpk= 4, nxpk= 0, iat= 311, 308, r1= 1.30, r2= 1.80, r3= 3.62, r4= 4.12,  &end
#
#   19 ARG+ HD3     19 ARG+ QB     4.080   (#SUP   4.38 )
 &rst
  ixpk= 4, nxpk= 0, iat= 311,  -1, r1= 1.30, r2= 1.80, r3= 4.58, r4= 5.08,
 igr2= 304, 305,
 &end
#
#   19 ARG+ HD3     58 LEU  HA     3.810   (#SUP   1.50 )
 &rst
  ixpk= 1, nxpk= 0, iat= 311, 956, r1= 1.30, r2= 1.80, r3= 3.81, r4= 4.31,  &end
#
#   19 ARG+ HG2     19 ARG+ QB     3.320   (#SUP   5.98 )
 &rst
  ixpk= 5, nxpk= 0, iat= 307,  -1, r1= 1.30, r2= 1.80, r3= 3.73, r4= 4.23,
 igr2= 304, 305,
 &end
#
#   19 ARG+ HG2     32 LEU  QD1    3.860   (#SUP   1.61 )
# &rst
#  ixpk= 1, nxpk= 0, iat= 307,  -1, r1= 1.30, r2= 1.80, r3= 5.081, r4= 5.14,
# igr2= 523, 524, 525,
# &end
#
#   19 ARG+ HG2     32 LEU  QD2    3.740   (#SUP   2.31 )
 &rst
  ixpk= 2, nxpk= 0, iat= 307,  -1, r1= 1.30, r2= 1.80, r3= 4.49, r4= 4.99,
 igr2= 527, 528, 529,
 &end
#
#   19 ARG+ HG2     58 LEU  HA     3.650   (#SUP   2.91 )
 &rst
  ixpk= 2, nxpk= 0, iat= 307, 956, r1= 1.30, r2= 1.80, r3= 3.65, r4= 4.15,  &end
#
#   19 ARG+ HG2     58 LEU  QD2    3.840   (#SUP   4.10 )
 &rst
  ixpk= 4, nxpk= 0, iat= 307,  -1, r1= 1.30, r2= 1.80, r3= 4.61, r4= 5.11,
 igr2= 967, 968, 969,
 &end
#
#   19 ARG+ HG3     19 ARG+ QB     3.060   (#SUP   5.98 )
 &rst
  ixpk= 5, nxpk= 0, iat= 308,  -1, r1= 1.30, r2= 1.80, r3= 3.43, r4= 3.93,
 igr2= 304, 305,
 &end
#
#   19 ARG+ QB      58 LEU  QD2    4.580   (#SUP   2.27 )
 &rst
  ixpk= 2, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 304, 305,
 igr2= 967, 968, 969,
 &end
#
#   20 GLN  HA      20 GLN  HG2    3.790   (#SUP   4.63 )
 &rst
  ixpk= 4, nxpk= 0, iat= 326, 331, r1= 1.30, r2= 1.80, r3= 3.79, r4= 4.29,  &end
#
#   20 GLN  HA      20 GLN  HG3    3.730   (#SUP   4.58 )
 &rst
  ixpk= 4, nxpk= 0, iat= 326, 332, r1= 1.30, r2= 1.80, r3= 3.73, r4= 4.23,  &end
#
#   20 GLN  HA      20 GLN  QB     2.900   (#SUP   4.19 )
 &rst
  ixpk= 4, nxpk= 0, iat= 326,  -1, r1= 1.30, r2= 1.80, r3= 3.26, r4= 3.76,
 igr2= 328, 329,
 &end
#
#   20 GLN  HA      62 VAL  QG1    4.460   (#SUP   1.83 )
 &rst
  ixpk= 1, nxpk= 0, iat= 326,  -1, r1= 1.30, r2= 1.80, r3= 5.36, r4= 5.86,
 igr2=1022,1023,1024,
 &end
#
#   20 GLN  HA      62 VAL  QG2    5.040   (#SUP   1.84 )
 &rst
  ixpk= 1, nxpk= 0, iat= 326,  -1, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55,
 igr2=1026,1027,1028,
 &end
#
#   20 GLN  HG2     20 GLN  QB     2.810   (#SUP   3.84 )
 &rst
  ixpk= 3, nxpk= 0, iat= 331,  -1, r1= 1.30, r2= 1.80, r3= 3.15, r4= 3.65,
 igr2= 328, 329,
 &end
#
#   20 GLN  QB      21 ILE  HA     3.800   (#SUP   4.85 )
 &rst
  ixpk= 4, nxpk= 0, iat=  -1, 343, r1= 1.30, r2= 1.80, r3= 4.27, r4= 4.77,
 igr1= 328, 329,
 &end
#
#   21 ILE  HA      21 ILE  HB     3.440   (#SUP   6.20 )
 &rst
  ixpk= 6, nxpk= 0, iat= 343, 345, r1= 1.30, r2= 1.80, r3= 3.44, r4= 3.94,  &end
#
#   21 ILE  HA      21 ILE  HG12   3.400   (#SUP   6.47 )
 &rst
  ixpk= 6, nxpk= 0, iat= 343, 351, r1= 1.30, r2= 1.80, r3= 3.40, r4= 3.90,  &end
#
#   21 ILE  HA      21 ILE  HG13   3.350   (#SUP   5.21 )
 &rst
  ixpk= 5, nxpk= 0, iat= 343, 352, r1= 1.30, r2= 1.80, r3= 3.35, r4= 3.85,  &end
#
#   21 ILE  HA      21 ILE  QD1    3.900   (#SUP   3.94 )
 &rst
  ixpk= 3, nxpk= 0, iat= 343,  -1, r1= 1.30, r2= 1.80, r3= 4.68, r4= 5.18,
 igr2= 354, 355, 356,
 &end
#
#   21 ILE  HA      21 ILE  QG2    3.030   (#SUP   4.52 )
 &rst
  ixpk= 4, nxpk= 0, iat= 343,  -1, r1= 1.30, r2= 1.80, r3= 3.64, r4= 4.14,
 igr2= 347, 348, 349,
 &end
#
#   21 ILE  HB      21 ILE  HG12   3.240   (#SUP   6.28 )
 &rst
  ixpk= 6, nxpk= 0, iat= 345, 351, r1= 1.30, r2= 1.80, r3= 3.24, r4= 3.74,  &end
#
#   21 ILE  HB      21 ILE  HG13   3.540   (#SUP   5.31 )
 &rst
  ixpk= 5, nxpk= 0, iat= 345, 352, r1= 1.30, r2= 1.80, r3= 3.54, r4= 4.04,  &end
#
#   21 ILE  HB      21 ILE  QD1    3.330   (#SUP   4.04 )
 &rst
  ixpk= 4, nxpk= 0, iat= 345,  -1, r1= 1.30, r2= 1.80, r3= 4.00, r4= 4.50,
 igr2= 354, 355, 356,
 &end
#
#   21 ILE  HB      21 ILE  QG2    2.920   (#SUP   4.62 )
 &rst
  ixpk= 4, nxpk= 0, iat= 345,  -1, r1= 1.30, r2= 1.80, r3= 3.51, r4= 4.01,
 igr2= 347, 348, 349,
 &end
#
#   21 ILE  HG12    21 ILE  HG13   2.550   (#SUP   5.61 )
 &rst
  ixpk= 5, nxpk= 0, iat= 351, 352, r1= 1.30, r2= 1.80, r3= 2.55, r4= 3.05,  &end
#
#   21 ILE  HG12    21 ILE  QD1    3.000   (#SUP   4.21 )
 &rst
  ixpk= 4, nxpk= 0, iat= 351,  -1, r1= 1.30, r2= 1.80, r3= 3.60, r4= 4.10,
 igr2= 354, 355, 356,
 &end
#
#   21 ILE  HG12    21 ILE  QG2    3.250   (#SUP   5.04 )
 &rst
  ixpk= 5, nxpk= 0, iat= 351,  -1, r1= 1.30, r2= 1.80, r3= 3.90, r4= 4.40,
 igr2= 347, 348, 349,
 &end
#
#   21 ILE  HG13    21 ILE  QD1    2.900   (#SUP   3.62 )
 &rst
  ixpk= 3, nxpk= 0, iat= 352,  -1, r1= 1.30, r2= 1.80, r3= 3.48, r4= 3.98,
 igr2= 354, 355, 356,
 &end
#
#   21 ILE  HG13    21 ILE  QG2    3.360   (#SUP   4.44 )
 &rst
  ixpk= 4, nxpk= 0, iat= 352,  -1, r1= 1.30, r2= 1.80, r3= 4.04, r4= 4.54,
 igr2= 347, 348, 349,
 &end
#
#   22 ILE  HA      22 ILE  HB     3.520   (#SUP   5.00 )
 &rst
  ixpk= 5, nxpk= 0, iat= 362, 364, r1= 1.30, r2= 1.80, r3= 3.52, r4= 4.02,  &end
#
#   22 ILE  HA      22 ILE  QD1    3.270   (#SUP   5.00 )
 &rst
  ixpk= 5, nxpk= 0, iat= 362,  -1, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr2= 373, 374, 375,
 &end
#
#   22 ILE  HA      22 ILE  QG1    3.420   (#SUP   5.00 )
 &rst
  ixpk= 5, nxpk= 0, iat= 362,  -1, r1= 1.30, r2= 1.80, r3= 3.84, r4= 4.34,
 igr2= 370, 371,
 &end
#
#   22 ILE  HA      22 ILE  QG2    3.210   (#SUP   5.44 )
 &rst
  ixpk= 5, nxpk= 0, iat= 362,  -1, r1= 1.30, r2= 1.80, r3= 3.86, r4= 4.36,
 igr2= 366, 367, 368,
 &end
#
#   22 ILE  HA      26 PRO  HA     3.690   (#SUP   2.13 )
 &rst
  ixpk= 2, nxpk= 0, iat= 362, 437, r1= 1.30, r2= 1.80, r3= 3.69, r4= 4.19,  &end
#
#   22 ILE  HB      22 ILE  QD1    3.350   (#SUP   5.00 )
 &rst
  ixpk= 5, nxpk= 0, iat= 364,  -1, r1= 1.30, r2= 1.80, r3= 4.02, r4= 4.52,
 igr2= 373, 374, 375,
 &end
#
#   22 ILE  HB      22 ILE  QG1    2.980   (#SUP   5.00 )
 &rst
  ixpk= 5, nxpk= 0, iat= 364,  -1, r1= 1.30, r2= 1.80, r3= 3.34, r4= 3.84,
 igr2= 370, 371,
 &end
#
#   22 ILE  HB      22 ILE  QG2    2.920   (#SUP   5.44 )
 &rst
  ixpk= 5, nxpk= 0, iat= 364,  -1, r1= 1.30, r2= 1.80, r3= 3.51, r4= 4.01,
 igr2= 366, 367, 368,
 &end
#
#   22 ILE  HB      58 LEU  QD2    4.450   (#SUP   2.82 )
 &rst
  ixpk= 2, nxpk= 0, iat= 364,  -1, r1= 1.30, r2= 1.80, r3= 5.34, r4= 5.84,
 igr2= 967, 968, 969,
 &end
#
#   22 ILE  QD1     22 ILE  QG1    2.940   (#SUP   5.00 )
 &rst
  ixpk= 5, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 3.96, r4= 4.46,
 igr1= 373, 374, 375,
 igr2= 370, 371,
 &end
#
#   22 ILE  QD1     22 ILE  QG2    3.040   (#SUP   5.44 )
 &rst
  ixpk= 5, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.38, r4= 4.88,
 igr1= 373, 374, 375,
 igr2= 366, 367, 368,
 &end
#
#   22 ILE  QD1     26 PRO  HA     4.170   (#SUP   1.50 )
 &rst
  ixpk= 1, nxpk= 0, iat=  -1, 437, r1= 1.30, r2= 1.80, r3= 5.01, r4= 5.51,
 igr1= 373, 374, 375,
 &end
#
#   22 ILE  QD1     28 LEU  HB2    3.890   (#SUP   3.11 )
 &rst
  ixpk= 3, nxpk= 0, iat=  -1, 456, r1= 1.30, r2= 1.80, r3= 4.67, r4= 5.17,
 igr1= 373, 374, 375,
 &end
#
#   22 ILE  QD1     28 LEU  HB3    3.660   (#SUP   2.60 )
 &rst
  ixpk= 2, nxpk= 0, iat=  -1, 457, r1= 1.30, r2= 1.80, r3= 4.40, r4= 4.90,
 igr1= 373, 374, 375,
 &end
#
#   22 ILE  QD1     29 LEU  HA     3.560   (#SUP   4.81 )
 &rst
  ixpk= 4, nxpk= 0, iat=  -1, 473, r1= 1.30, r2= 1.80, r3= 4.28, r4= 4.78,
 igr1= 373, 374, 375,
 &end
#
#   22 ILE  QD1     29 LEU  HB2    4.360   (#SUP   4.81 )
 &rst
  ixpk= 4, nxpk= 0, iat=  -1, 475, r1= 1.30, r2= 1.80, r3= 5.24, r4= 5.74,
 igr1= 373, 374, 375,
 &end
#
#   22 ILE  QD1     29 LEU  QD1    3.420   (#SUP   4.11 )
 &rst
  ixpk= 4, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.93, r4= 5.43,
 igr1= 373, 374, 375,
 igr2= 480, 481, 482,
 &end
#
#   22 ILE  QD1     32 LEU  HB2    3.520   (#SUP   1.71 )
 &rst
  ixpk= 1, nxpk= 0, iat=  -1, 518, r1= 1.30, r2= 1.80, r3= 4.23, r4= 4.73,
 igr1= 373, 374, 375,
 &end
#
#   22 ILE  QD1     32 LEU  HB3    3.630   (#SUP   1.71 )
 &rst
  ixpk= 1, nxpk= 0, iat=  -1, 519, r1= 1.30, r2= 1.80, r3= 4.36, r4= 4.86,
 igr1= 373, 374, 375,
 &end
#
#   22 ILE  QD1     58 LEU  QD2    3.850   (#SUP   2.96 )
 &rst
  ixpk= 2, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.55, r4= 6.05,
 igr1= 373, 374, 375,
 igr2= 967, 968, 969,
 &end
#
#   22 ILE  QG1     22 ILE  QG2    3.030   (#SUP   5.44 )
 &rst
  ixpk= 5, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.08, r4= 4.58,
 igr1= 370, 371,
 igr2= 366, 367, 368,
 &end
#
#   22 ILE  QG1     58 LEU  QD2    3.670   (#SUP   2.96 )
 &rst
  ixpk= 2, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.95, r4= 5.45,
 igr1= 370, 371,
 igr2= 967, 968, 969,
 &end
#
#   22 ILE  QG2     23 GLN  HA     4.240   (#SUP   5.38 )
 &rst
  ixpk= 5, nxpk= 0, iat=  -1, 381, r1= 1.30, r2= 1.80, r3= 5.09, r4= 5.59,
 igr1= 366, 367, 368,
 &end
#
#   22 ILE  QG2     26 PRO  HA     3.580   (#SUP   3.25 )
 &rst
  ixpk= 3, nxpk= 0, iat=  -1, 437, r1= 1.30, r2= 1.80, r3= 4.30, r4= 4.80,
 igr1= 366, 367, 368,
 &end
#
#   22 ILE  QG2     26 PRO  HB2    3.900   (#SUP   0.95 )
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 434, r1= 1.30, r2= 1.80, r3= 4.68, r4= 5.18,
 igr1= 366, 367, 368,
 &end
#
#   22 ILE  QG2     29 LEU  HA     3.960   (#SUP   3.87 )
 &rst
  ixpk= 3, nxpk= 0, iat=  -1, 473, r1= 1.30, r2= 1.80, r3= 4.76, r4= 5.26,
 igr1= 366, 367, 368,
 &end
#
#   22 ILE  QG2     29 LEU  HB2    3.590   (#SUP   3.87 )
 &rst
  ixpk= 3, nxpk= 0, iat=  -1, 475, r1= 1.30, r2= 1.80, r3= 4.31, r4= 4.81,
 igr1= 366, 367, 368,
 &end
#
#   22 ILE  QG2     29 LEU  HB3    3.550   (#SUP   2.25 )
 &rst
  ixpk= 2, nxpk= 0, iat=  -1, 476, r1= 1.30, r2= 1.80, r3= 4.26, r4= 4.76,
 igr1= 366, 367, 368,
 &end
#
#   22 ILE  QG2     58 LEU  QD1    3.080   (#SUP   0.68 )
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.44, r4= 4.94,
 igr1= 366, 367, 368,
 igr2= 963, 964, 965,
 &end
#
#   22 ILE  QG2     58 LEU  QD2    3.380   (#SUP   4.57 )
 &rst
  ixpk= 4, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.87, r4= 5.37,
 igr1= 366, 367, 368,
 igr2= 967, 968, 969,
 &end
#
#   23 GLN  HA      23 GLN  HG2    5.310   (#SUP   4.39 )
 &rst
  ixpk= 4, nxpk= 0, iat= 381, 386, r1= 1.30, r2= 1.80, r3= 5.31, r4= 5.81,  &end
#
#   23 GLN  HA      23 GLN  HG3    3.910   (#SUP   4.39 )
 &rst
  ixpk= 4, nxpk= 0, iat= 381, 387, r1= 1.30, r2= 1.80, r3= 3.91, r4= 4.41,  &end
#
#   23 GLN  HA      23 GLN  QB     4.040   (#SUP   5.36 )
 &rst
  ixpk= 5, nxpk= 0, iat= 381,  -1, r1= 1.30, r2= 1.80, r3= 4.53, r4= 5.03,
 igr2= 383, 384,
 &end
#
#   23 GLN  HG2     23 GLN  HG3    2.590   (#SUP   5.00 )
 &rst
  ixpk= 5, nxpk= 0, iat= 386, 387, r1= 1.30, r2= 1.80, r3= 2.59, r4= 3.09,  &end
#
#   23 GLN  HG2     23 GLN  QB     5.500   (#SUP   5.55 )
 &rst
  ixpk= 5, nxpk= 0, iat= 386,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2= 383, 384,
 &end
#
#   23 GLN  HG3     23 GLN  QB     3.120   (#SUP   5.55 )
 &rst
  ixpk= 5, nxpk= 0, iat= 387,  -1, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,
 igr2= 383, 384,
 &end
#
#   24 GLN  HA      24 GLN  HB2    3.390   (#SUP   4.97 )
 &rst
  ixpk= 4, nxpk= 0, iat= 398, 400, r1= 1.30, r2= 1.80, r3= 3.39, r4= 3.89,  &end
#
#   24 GLN  HA      24 GLN  HB3    3.370   (#SUP   4.70 )
 &rst
  ixpk= 4, nxpk= 0, iat= 398, 401, r1= 1.30, r2= 1.80, r3= 3.37, r4= 3.87,  &end
#
#   24 GLN  HA      24 GLN  HG2    4.140   (#SUP   4.26 )
 &rst
  ixpk= 4, nxpk= 0, iat= 398, 403, r1= 1.30, r2= 1.80, r3= 4.14, r4= 4.64,  &end
#
#   24 GLN  HA      24 GLN  HG3    3.990   (#SUP   4.97 )
 &rst
  ixpk= 4, nxpk= 0, iat= 398, 404, r1= 1.30, r2= 1.80, r3= 3.99, r4= 4.49,  &end
#
#   24 GLN  HB2     24 GLN  HG2    2.630   (#SUP   4.31 )
 &rst
  ixpk= 4, nxpk= 0, iat= 400, 403, r1= 1.30, r2= 1.80, r3= 2.971, r4= 3.13,  &end
#
#   24 GLN  HB2     24 GLN  HG3    3.830   (#SUP   5.00 )
 &rst
  ixpk= 5, nxpk= 0, iat= 400, 404, r1= 1.30, r2= 1.80, r3= 3.83, r4= 4.33,  &end
#
#   24 GLN  HB3     24 GLN  HG2    3.390   (#SUP   4.24 )
 &rst
  ixpk= 4, nxpk= 0, iat= 401, 403, r1= 1.30, r2= 1.80, r3= 3.39, r4= 3.89,  &end
#
#   24 GLN  HB3     24 GLN  HG3    3.260   (#SUP   4.78 )
 &rst
  ixpk= 4, nxpk= 0, iat= 401, 404, r1= 1.30, r2= 1.80, r3= 3.26, r4= 3.76,  &end
#
#   25 ASN  HA      25 ASN  HB2    3.780   (#SUP   3.52 )
 &rst
  ixpk= 3, nxpk= 0, iat= 415, 417, r1= 1.30, r2= 1.80, r3= 3.78, r4= 4.28,  &end
#
#   25 ASN  HA      25 ASN  HB3    3.630   (#SUP   3.52 )
 &rst
  ixpk= 3, nxpk= 0, iat= 415, 418, r1= 1.30, r2= 1.80, r3= 3.63, r4= 4.13,  &end
#
#   25 ASN  HA      26 PRO  HD2    2.990   (#SUP   3.41 )
 &rst
  ixpk= 3, nxpk= 0, iat= 415, 428, r1= 1.30, r2= 1.80, r3= 2.99, r4= 3.49,  &end
#
#   25 ASN  HA      26 PRO  HD3    3.330   (#SUP   4.41 )
 &rst
  ixpk= 4, nxpk= 0, iat= 415, 429, r1= 1.30, r2= 1.80, r3= 3.33, r4= 3.83,  &end
#
#   25 ASN  HB2     25 ASN  HB3    2.410   (#SUP   4.00 )
 &rst
  ixpk= 4, nxpk= 0, iat= 417, 418, r1= 1.30, r2= 1.80, r3= 2.41, r4= 2.91,  &end
#
#   25 ASN  HB2     28 LEU  HG     3.620   (#SUP   4.97 )
 &rst
  ixpk= 4, nxpk= 0, iat= 417, 459, r1= 1.30, r2= 1.80, r3= 3.62, r4= 4.12,  &end
#
#   25 ASN  HB2     28 LEU  QD1    3.450   (#SUP   4.97 )
 &rst
  ixpk= 4, nxpk= 0, iat= 417,  -1, r1= 1.30, r2= 1.80, r3= 4.14, r4= 4.64,
 igr2= 461, 462, 463,
 &end
#
#   25 ASN  HB3     28 LEU  HG     3.990   (#SUP   4.97 )
 &rst
  ixpk= 4, nxpk= 0, iat= 418, 459, r1= 1.30, r2= 1.80, r3= 3.99, r4= 4.49,  &end
#
#   25 ASN  HB3     28 LEU  QD1    3.580   (#SUP   4.97 )
 &rst
  ixpk= 4, nxpk= 0, iat= 418,  -1, r1= 1.30, r2= 1.80, r3= 4.30, r4= 4.80,
 igr2= 461, 462, 463,
 &end
#
#   26 PRO  HA      26 PRO  HB2    3.450   (#SUP   5.33 )
 &rst
  ixpk= 5, nxpk= 0, iat= 437, 434, r1= 1.30, r2= 1.80, r3= 3.45, r4= 3.95,  &end
#
#   26 PRO  HA      26 PRO  HB3    3.800   (#SUP   3.66 )
 &rst
  ixpk= 3, nxpk= 0, iat= 437, 435, r1= 1.30, r2= 1.80, r3= 3.80, r4= 4.30,  &end
#
#   26 PRO  HB2     26 PRO  HB3    2.400   (#SUP   5.91 )
 &rst
  ixpk= 5, nxpk= 0, iat= 434, 435, r1= 1.30, r2= 1.80, r3= 2.40, r4= 2.90,  &end
#
#   26 PRO  HB2     26 PRO  HD2    3.920   (#SUP   6.40 )
 &rst
  ixpk= 6, nxpk= 0, iat= 434, 428, r1= 1.30, r2= 1.80, r3= 4.053, r4= 4.42,  &end
#
#   26 PRO  HB2     26 PRO  HD3    4.020   (#SUP   6.76 )
 &rst
  ixpk= 6, nxpk= 0, iat= 434, 429, r1= 1.30, r2= 1.80, r3= 4.02, r4= 4.52,  &end
#
#   26 PRO  HB2     26 PRO  HG2    4.320   (#SUP   5.61 )
 &rst
  ixpk= 5, nxpk= 0, iat= 434, 431, r1= 1.30, r2= 1.80, r3= 4.32, r4= 4.82,  &end
#
#   26 PRO  HB2     26 PRO  HG3    3.370   (#SUP   5.91 )
 &rst
  ixpk= 5, nxpk= 0, iat= 434, 432, r1= 1.30, r2= 1.80, r3= 3.37, r4= 3.87,  &end
#
#   26 PRO  HB3     26 PRO  HD3    4.320   (#SUP   6.70 )
 &rst
  ixpk= 6, nxpk= 0, iat= 435, 429, r1= 1.30, r2= 1.80, r3= 4.32, r4= 4.82,  &end
#
#   26 PRO  HB3     26 PRO  HG2    2.830   (#SUP   5.61 )
 &rst
  ixpk= 5, nxpk= 0, iat= 435, 431, r1= 1.30, r2= 1.80, r3= 2.994, r4= 3.33,  &end
#
#   26 PRO  HD2     26 PRO  HD3    2.600   (#SUP   6.28 )
 &rst
  ixpk= 6, nxpk= 0, iat= 428, 429, r1= 1.30, r2= 1.80, r3= 2.60, r4= 3.10,  &end
#
#   26 PRO  HD2     26 PRO  HG2    3.090   (#SUP   5.07 )
 &rst
  ixpk= 5, nxpk= 0, iat= 428, 431, r1= 1.30, r2= 1.80, r3= 3.09, r4= 3.59,  &end
#
#   26 PRO  HD2     26 PRO  HG3    3.430   (#SUP   4.44 )
 &rst
  ixpk= 4, nxpk= 0, iat= 428, 432, r1= 1.30, r2= 1.80, r3= 3.43, r4= 3.93,  &end
#
#   26 PRO  HD3     26 PRO  HG2    3.520   (#SUP   5.38 )
 &rst
  ixpk= 5, nxpk= 0, iat= 429, 431, r1= 1.30, r2= 1.80, r3= 3.52, r4= 4.02,  &end
#
#   26 PRO  HD3     26 PRO  HG3    3.350   (#SUP   5.69 )
 &rst
  ixpk= 5, nxpk= 0, iat= 429, 432, r1= 1.30, r2= 1.80, r3= 3.35, r4= 3.85,  &end
#
#   26 PRO  HG2     26 PRO  HG3    2.400   (#SUP   4.61 )
 &rst
  ixpk= 4, nxpk= 0, iat= 431, 432, r1= 1.30, r2= 1.80, r3= 2.40, r4= 2.90,  &end
#
#   27 SER  HA      27 SER  QB     3.020   (#SUP   2.00 )
 &rst
  ixpk= 2, nxpk= 0, iat= 443,  -1, r1= 1.30, r2= 1.80, r3= 3.39, r4= 3.89,
 igr2= 445, 446,
 &end
#
#   28 LEU  HA      28 LEU  HB2    3.870   (#SUP   6.00 )
 &rst
  ixpk= 6, nxpk= 0, iat= 454, 456, r1= 1.30, r2= 1.80, r3= 3.87, r4= 4.37,  &end
#
#   28 LEU  HA      28 LEU  HB3    3.630   (#SUP   5.27 )
 &rst
  ixpk= 5, nxpk= 0, iat= 454, 457, r1= 1.30, r2= 1.80, r3= 3.63, r4= 4.13,  &end
#
#   28 LEU  HA      28 LEU  HG     3.630   (#SUP   5.27 )
 &rst
  ixpk= 5, nxpk= 0, iat= 454, 459, r1= 1.30, r2= 1.80, r3= 3.63, r4= 4.13,  &end
#
#   28 LEU  HA      28 LEU  QD1    4.070   (#SUP   5.31 )
 &rst
  ixpk= 5, nxpk= 0, iat= 454,  -1, r1= 1.30, r2= 1.80, r3= 4.89, r4= 5.39,
 igr2= 461, 462, 463,
 &end
#
#   28 LEU  HA      28 LEU  QD2    3.160   (#SUP   5.99 )
 &rst
  ixpk= 5, nxpk= 0, iat= 454,  -1, r1= 1.30, r2= 1.80, r3= 3.79, r4= 4.29,
 igr2= 465, 466, 467,
 &end
#
#   28 LEU  HA      31 ALA  QB     3.440   (#SUP   2.83 )
 &rst
  ixpk= 2, nxpk= 0, iat= 454,  -1, r1= 1.30, r2= 1.80, r3= 4.13, r4= 4.63,
 igr2= 508, 509, 510,
 &end
#
#   28 LEU  HB2     28 LEU  HB3    2.710   (#SUP   5.27 )
 &rst
  ixpk= 5, nxpk= 0, iat= 456, 457, r1= 1.30, r2= 1.80, r3= 2.71, r4= 3.21,  &end
#
#   28 LEU  HB2     28 LEU  HG     3.270   (#SUP   5.27 )
 &rst
  ixpk= 5, nxpk= 0, iat= 456, 459, r1= 1.30, r2= 1.80, r3= 3.27, r4= 3.77,  &end
#
#   28 LEU  HB2     28 LEU  QD1    3.160   (#SUP   5.31 )
 &rst
  ixpk= 5, nxpk= 0, iat= 456,  -1, r1= 1.30, r2= 1.80, r3= 3.79, r4= 4.29,
 igr2= 461, 462, 463,
 &end
#
#   28 LEU  HB2     28 LEU  QD2    3.660   (#SUP   6.00 )
 &rst
  ixpk= 6, nxpk= 0, iat= 456,  -1, r1= 1.30, r2= 1.80, r3= 4.40, r4= 4.90,
 igr2= 465, 466, 467,
 &end
#
#   28 LEU  HB3     28 LEU  QD1    3.210   (#SUP   4.97 )
 &rst
  ixpk= 4, nxpk= 0, iat= 457,  -1, r1= 1.30, r2= 1.80, r3= 3.86, r4= 4.36,
 igr2= 461, 462, 463,
 &end
#
#   28 LEU  HB3     28 LEU  QD2    3.290   (#SUP   5.27 )
 &rst
  ixpk= 5, nxpk= 0, iat= 457,  -1, r1= 1.30, r2= 1.80, r3= 3.95, r4= 4.45,
 igr2= 465, 466, 467,
 &end
#
#   28 LEU  HG      28 LEU  QD1    3.190   (#SUP   4.97 )
 &rst
  ixpk= 4, nxpk= 0, iat= 459,  -1, r1= 1.30, r2= 1.80, r3= 3.83, r4= 4.33,
 igr2= 461, 462, 463,
 &end
#
#   28 LEU  HG      28 LEU  QD2    5.500   (#SUP   5.27 )
 &rst
  ixpk= 5, nxpk= 0, iat= 459,  -1, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr2= 465, 466, 467,
 &end
#
#   28 LEU  QD1     28 LEU  QD2    3.000   (#SUP   5.31 )
 &rst
  ixpk= 5, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.33, r4= 4.83,
 igr1= 461, 462, 463,
 igr2= 465, 466, 467,
 &end
#
#   28 LEU  QD1     31 ALA  QB     3.460   (#SUP   1.50 )
 &rst
  ixpk= 1, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.99, r4= 5.49,
 igr1= 461, 462, 463,
 igr2= 508, 509, 510,
 &end
#
#   28 LEU  QD2     31 ALA  QB     3.410   (#SUP   2.83 )
 &rst
  ixpk= 2, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.92, r4= 5.42,
 igr1= 465, 466, 467,
 igr2= 508, 509, 510,
 &end
#
#   29 LEU  HA      29 LEU  HB2    3.670   (#SUP   6.40 )
 &rst
  ixpk= 6, nxpk= 0, iat= 473, 475, r1= 1.30, r2= 1.80, r3= 3.67, r4= 4.17,  &end
#
#   29 LEU  HA      29 LEU  HB3    3.380   (#SUP   5.31 )
 &rst
  ixpk= 5, nxpk= 0, iat= 473, 476, r1= 1.30, r2= 1.80, r3= 3.38, r4= 3.88,  &end
#
#   29 LEU  HA      29 LEU  HG     3.480   (#SUP   3.08 )
 &rst
  ixpk= 3, nxpk= 0, iat= 473, 478, r1= 1.30, r2= 1.80, r3= 3.48, r4= 3.98,  &end
#
#   29 LEU  HA      29 LEU  QD1    3.100   (#SUP   3.31 )
 &rst
  ixpk= 3, nxpk= 0, iat= 473,  -1, r1= 1.30, r2= 1.80, r3= 3.72, r4= 4.22,
 igr2= 480, 481, 482,
 &end
#
#   29 LEU  HB2     29 LEU  HB3    2.660   (#SUP   5.44 )
 &rst
  ixpk= 5, nxpk= 0, iat= 475, 476, r1= 1.30, r2= 1.80, r3= 2.66, r4= 3.16,  &end
#
#   29 LEU  HB2     29 LEU  QD1    3.610   (#SUP   5.17 )
 &rst
  ixpk= 5, nxpk= 0, iat= 475,  -1, r1= 1.30, r2= 1.80, r3= 4.34, r4= 4.84,
 igr2= 480, 481, 482,
 &end
#
#   29 LEU  HB2     29 LEU  QD2    3.270   (#SUP   4.68 )
 &rst
  ixpk= 4, nxpk= 0, iat= 475,  -1, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr2= 484, 485, 486,
 &end
#
#   29 LEU  HB2     30 PRO  HD2    3.550   (#SUP   5.64 )
 &rst
  ixpk= 5, nxpk= 0, iat= 475, 491, r1= 1.30, r2= 1.80, r3= 3.837, r4= 4.05,  &end
#
#   29 LEU  HB2     30 PRO  HD3    3.130   (#SUP   6.52 )
 &rst
  ixpk= 6, nxpk= 0, iat= 475, 492, r1= 1.30, r2= 1.80, r3= 3.503, r4= 3.63,  &end
#
#   29 LEU  HB3     29 LEU  QD1    3.150   (#SUP   4.75 )
 &rst
  ixpk= 4, nxpk= 0, iat= 476,  -1, r1= 1.30, r2= 1.80, r3= 3.875, r4= 4.28,
 igr2= 480, 481, 482,
 &end
#
#   29 LEU  HB3     29 LEU  QD2    3.000   (#SUP   4.27 )
 &rst
  ixpk= 4, nxpk= 0, iat= 476,  -1, r1= 1.30, r2= 1.80, r3= 3.60, r4= 4.10,
 igr2= 484, 485, 486,
 &end
#
#   29 LEU  HB3     30 PRO  HD3    3.550   (#SUP   5.97 )
 &rst
  ixpk= 5, nxpk= 0, iat= 476, 492, r1= 1.30, r2= 1.80, r3= 3.55, r4= 4.05,  &end
#
#   29 LEU  HG      29 LEU  QD1    3.440   (#SUP   2.81 )
 &rst
  ixpk= 2, nxpk= 0, iat= 478,  -1, r1= 1.30, r2= 1.80, r3= 4.13, r4= 4.63,
 igr2= 480, 481, 482,
 &end
#
#   29 LEU  HG      33 LEU  QD1    3.670   (#SUP   0.33 )
 &rst
  ixpk= 0, nxpk= 0, iat= 478,  -1, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,
 igr2= 542, 543, 544,
 &end
#
#   29 LEU  QD1     33 LEU  HG     3.440   (#SUP   3.24 )
 &rst
  ixpk= 3, nxpk= 0, iat=  -1, 540, r1= 1.30, r2= 1.80, r3= 4.13, r4= 4.63,
 igr1= 480, 481, 482,
 &end
#
#   29 LEU  QD1     33 LEU  QD2    3.480   (#SUP   2.45 )
 &rst
  ixpk= 2, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.02, r4= 5.52,
 igr1= 480, 481, 482,
 igr2= 546, 547, 548,
 &end
#
#   29 LEU  QD1     58 LEU  QD1    3.430   (#SUP   0.70 )
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.95, r4= 5.45,
 igr1= 480, 481, 482,
 igr2= 963, 964, 965,
 &end
#
#   29 LEU  QD2     30 PRO  HD3    3.950   (#SUP   4.47 )
 &rst
  ixpk= 4, nxpk= 0, iat=  -1, 492, r1= 1.30, r2= 1.80, r3= 4.74, r4= 5.24,
 igr1= 484, 485, 486,
 &end
#
#   29 LEU  QD2     58 LEU  QD1    4.000   (#SUP   0.73 )
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.77, r4= 6.27,
 igr1= 484, 485, 486,
 igr2= 963, 964, 965,
 &end
#
#   30 PRO  HA      30 PRO  HB2    3.130   (#SUP   3.97 )
 &rst
  ixpk= 3, nxpk= 0, iat= 500, 497, r1= 1.30, r2= 1.80, r3= 3.13, r4= 3.63,  &end
#
#   30 PRO  HA      30 PRO  HB3    3.030   (#SUP   6.12 )
 &rst
  ixpk= 6, nxpk= 0, iat= 500, 498, r1= 1.30, r2= 1.80, r3= 3.03, r4= 3.53,  &end
#
#   30 PRO  HA      30 PRO  HG2    4.100   (#SUP   6.08 )
 &rst
  ixpk= 6, nxpk= 0, iat= 500, 494, r1= 1.30, r2= 1.80, r3= 4.10, r4= 4.60,  &end
#
#   30 PRO  HA      30 PRO  HG3    3.690   (#SUP   5.24 )
 &rst
  ixpk= 5, nxpk= 0, iat= 500, 495, r1= 1.30, r2= 1.80, r3= 3.69, r4= 4.19,  &end
#
#   30 PRO  HA      33 LEU  HB2    3.930   (#SUP   3.69 )
 &rst
  ixpk= 3, nxpk= 0, iat= 500, 537, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,  &end
#
#   30 PRO  HA      33 LEU  HB3    4.370   (#SUP   4.42 )
 &rst
  ixpk= 4, nxpk= 0, iat= 500, 538, r1= 1.30, r2= 1.80, r3= 4.37, r4= 4.87,  &end
#
#   30 PRO  HA      33 LEU  HG     4.340   (#SUP   4.77 )
 &rst
  ixpk= 4, nxpk= 0, iat= 500, 540, r1= 1.30, r2= 1.80, r3= 4.34, r4= 4.84,  &end
#
#   30 PRO  HA      33 LEU  QD1    3.740   (#SUP   4.89 )
 &rst
  ixpk= 4, nxpk= 0, iat= 500,  -1, r1= 1.30, r2= 1.80, r3= 4.49, r4= 4.99,
 igr2= 542, 543, 544,
 &end
#
#   30 PRO  HB2     30 PRO  HB3    2.560   (#SUP   6.19 )
 &rst
  ixpk= 6, nxpk= 0, iat= 497, 498, r1= 1.30, r2= 1.80, r3= 2.56, r4= 3.06,  &end
#
#   30 PRO  HB2     30 PRO  HG2    3.230   (#SUP   6.21 )
 &rst
  ixpk= 6, nxpk= 0, iat= 497, 494, r1= 1.30, r2= 1.80, r3= 3.23, r4= 3.73,  &end
#
#   30 PRO  HB2     30 PRO  HG3    2.880   (#SUP   5.58 )
 &rst
  ixpk= 5, nxpk= 0, iat= 497, 495, r1= 1.30, r2= 1.80, r3= 2.88, r4= 3.38,  &end
#
#   30 PRO  HB3     30 PRO  HD2    4.260   (#SUP   6.98 )
 &rst
  ixpk= 6, nxpk= 0, iat= 498, 491, r1= 1.30, r2= 1.80, r3= 4.26, r4= 4.76,  &end
#
#   30 PRO  HB3     30 PRO  HD3    4.290   (#SUP   7.74 )
 &rst
  ixpk= 7, nxpk= 0, iat= 498, 492, r1= 1.30, r2= 1.80, r3= 4.29, r4= 4.79,  &end
#
#   30 PRO  HB3     30 PRO  HG2    2.750   (#SUP   6.67 )
 &rst
  ixpk= 6, nxpk= 0, iat= 498, 494, r1= 1.30, r2= 1.80, r3= 2.75, r4= 3.25,  &end
#
#   30 PRO  HB3     31 ALA  QB     4.810   (#SUP   3.80 )
 &rst
  ixpk= 3, nxpk= 0, iat= 498,  -1, r1= 1.30, r2= 1.80, r3= 5.78, r4= 6.28,
 igr2= 508, 509, 510,
 &end
#
#   30 PRO  HD2     30 PRO  HD3    2.710   (#SUP   6.75 )
 &rst
  ixpk= 6, nxpk= 0, iat= 491, 492, r1= 1.30, r2= 1.80, r3= 2.71, r4= 3.21,  &end
#
#   30 PRO  HD2     30 PRO  HG2    3.400   (#SUP   7.04 )
 &rst
  ixpk= 7, nxpk= 0, iat= 491, 494, r1= 1.30, r2= 1.80, r3= 3.40, r4= 3.90,  &end
#
#   30 PRO  HD2     30 PRO  HG3    3.570   (#SUP   6.65 )
 &rst
  ixpk= 6, nxpk= 0, iat= 491, 495, r1= 1.30, r2= 1.80, r3= 3.57, r4= 4.07,  &end
#
#   30 PRO  HD3     30 PRO  HG2    3.550   (#SUP   7.83 )
 &rst
  ixpk= 7, nxpk= 0, iat= 492, 494, r1= 1.30, r2= 1.80, r3= 3.55, r4= 4.05,  &end
#
#   30 PRO  HD3     30 PRO  HG3    3.370   (#SUP   7.41 )
 &rst
  ixpk= 7, nxpk= 0, iat= 492, 495, r1= 1.30, r2= 1.80, r3= 3.37, r4= 3.87,  &end
#
#   30 PRO  HG2     30 PRO  HG3    2.540   (#SUP   5.87 )
 &rst
  ixpk= 5, nxpk= 0, iat= 494, 495, r1= 1.30, r2= 1.80, r3= 2.54, r4= 3.04,  &end
#
#   30 PRO  HG2     31 ALA  QB     4.370   (#SUP   4.11 )
 &rst
  ixpk= 4, nxpk= 0, iat= 494,  -1, r1= 1.30, r2= 1.80, r3= 5.37, r4= 5.75,
 igr2= 508, 509, 510,
 &end
#
#   31 ALA  HA      31 ALA  QB     2.810   (#SUP   2.40 )
 &rst
  ixpk= 2, nxpk= 0, iat= 506,  -1, r1= 1.30, r2= 1.80, r3= 3.37, r4= 3.87,
 igr2= 508, 509, 510,
 &end
#
#   32 LEU  HA      32 LEU  HB2    3.270   (#SUP   5.00 )
 &rst
  ixpk= 5, nxpk= 0, iat= 516, 518, r1= 1.30, r2= 1.80, r3= 3.27, r4= 3.77,  &end
#
#   32 LEU  HA      32 LEU  HB3    3.280   (#SUP   5.96 )
 &rst
  ixpk= 5, nxpk= 0, iat= 516, 519, r1= 1.30, r2= 1.80, r3= 3.28, r4= 3.78,  &end
#
#   32 LEU  HA      32 LEU  HG     3.300   (#SUP   4.26 )
 &rst
  ixpk= 4, nxpk= 0, iat= 516, 521, r1= 1.30, r2= 1.80, r3= 3.30, r4= 3.80,  &end
#
#   32 LEU  HA      32 LEU  QD1    3.540   (#SUP   5.85 )
 &rst
  ixpk= 5, nxpk= 0, iat= 516,  -1, r1= 1.30, r2= 1.80, r3= 4.25, r4= 4.75,
 igr2= 523, 524, 525,
 &end
#
#   32 LEU  HA      32 LEU  QD2    4.000   (#SUP   4.69 )
 &rst
  ixpk= 4, nxpk= 0, iat= 516,  -1, r1= 1.30, r2= 1.80, r3= 4.80, r4= 5.30,
 igr2= 527, 528, 529,
 &end
#
#   32 LEU  HA      35 GLN  QB     3.640   (#SUP   2.96 )
 &rst
  ixpk= 2, nxpk= 0, iat= 516,  -1, r1= 1.30, r2= 1.80, r3= 4.09, r4= 4.59,
 igr2= 573, 574,
 &end
#
#   32 LEU  HA      35 GLN  QG     4.010   (#SUP   2.96 )
 &rst
  ixpk= 2, nxpk= 0, iat= 516,  -1, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,
 igr2= 576, 577,
 &end
#
#   32 LEU  HB2     32 LEU  HB3    2.580   (#SUP   5.29 )
 &rst
  ixpk= 5, nxpk= 0, iat= 518, 519, r1= 1.30, r2= 1.80, r3= 2.58, r4= 3.08,  &end
#
#   32 LEU  HB2     32 LEU  HG     2.850   (#SUP   4.26 )
 &rst
  ixpk= 4, nxpk= 0, iat= 518, 521, r1= 1.30, r2= 1.80, r3= 2.999, r4= 3.35,  &end
#
#   32 LEU  HB2     32 LEU  QD1    3.480   (#SUP   5.18 )
 &rst
  ixpk= 5, nxpk= 0, iat= 518,  -1, r1= 1.30, r2= 1.80, r3= 4.18, r4= 4.68,
 igr2= 523, 524, 525,
 &end
#
#   32 LEU  HB2     32 LEU  QD2    3.400   (#SUP   4.69 )
 &rst
  ixpk= 4, nxpk= 0, iat= 518,  -1, r1= 1.30, r2= 1.80, r3= 4.08, r4= 4.58,
 igr2= 527, 528, 529,
 &end
#
#   32 LEU  HB3     32 LEU  QD1    3.110   (#SUP   5.81 )
 &rst
  ixpk= 5, nxpk= 0, iat= 519,  -1, r1= 1.30, r2= 1.80, r3= 3.873, r4= 4.23,
 igr2= 523, 524, 525,
 &end
#
#   32 LEU  HG      32 LEU  QD1    2.950   (#SUP   4.71 )
 &rst
  ixpk= 4, nxpk= 0, iat= 521,  -1, r1= 1.30, r2= 1.80, r3= 3.54, r4= 4.04,
 igr2= 523, 524, 525,
 &end
#
#   32 LEU  HG      32 LEU  QD2    3.310   (#SUP   4.22 )
 &rst
  ixpk= 4, nxpk= 0, iat= 521,  -1, r1= 1.30, r2= 1.80, r3= 3.98, r4= 4.48,
 igr2= 527, 528, 529,
 &end
#
#   32 LEU  HG      36 ILE  QD1    3.480   (#SUP   1.63 )
 &rst
  ixpk= 1, nxpk= 0, iat= 521,  -1, r1= 1.30, r2= 1.80, r3= 4.18, r4= 4.68,
 igr2= 599, 600, 601,
 &end
#
#   32 LEU  QD1     35 GLN  QB     4.100   (#SUP   3.25 )
 &rst
  ixpk= 3, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.53, r4= 6.03,
 igr1= 523, 524, 525,
 igr2= 573, 574,
 &end
#
#   32 LEU  QD1     35 GLN  QG     4.200   (#SUP   3.25 )
 &rst
  ixpk= 3, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.66, r4= 6.16,
 igr1= 523, 524, 525,
 igr2= 576, 577,
 &end
#
#   32 LEU  QD1     36 ILE  HG12   3.810   (#SUP   0.71 )
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 596, r1= 1.30, r2= 1.80, r3= 4.58, r4= 5.08,
 igr1= 523, 524, 525,
 &end
#
#   33 LEU  HA      33 LEU  HB2    3.220   (#SUP   5.99 )
 &rst
  ixpk= 5, nxpk= 0, iat= 535, 537, r1= 1.30, r2= 1.80, r3= 3.22, r4= 3.72,  &end
#
#   33 LEU  HA      33 LEU  HB3    3.410   (#SUP   6.20 )
 &rst
  ixpk= 6, nxpk= 0, iat= 535, 538, r1= 1.30, r2= 1.80, r3= 3.41, r4= 3.91,  &end
#
#   33 LEU  HA      33 LEU  HG     3.770   (#SUP   5.95 )
 &rst
  ixpk= 5, nxpk= 0, iat= 535, 540, r1= 1.30, r2= 1.80, r3= 3.77, r4= 4.27,  &end
#
#   33 LEU  HA      33 LEU  QD1    4.560   (#SUP   6.24 )
 &rst
  ixpk= 6, nxpk= 0, iat= 535,  -1, r1= 1.30, r2= 1.80, r3= 5.48, r4= 5.98,
 igr2= 542, 543, 544,
 &end
#
#   33 LEU  HA      33 LEU  QD2    2.980   (#SUP   5.93 )
 &rst
  ixpk= 5, nxpk= 0, iat= 535,  -1, r1= 1.30, r2= 1.80, r3= 3.58, r4= 4.08,
 igr2= 546, 547, 548,
 &end
#
#   33 LEU  HA      36 ILE  HB     3.420   (#SUP   2.75 )
 &rst
  ixpk= 2, nxpk= 0, iat= 535, 590, r1= 1.30, r2= 1.80, r3= 3.42, r4= 3.92,  &end
#
#   33 LEU  HA      36 ILE  QD1    3.620   (#SUP   4.00 )
 &rst
  ixpk= 4, nxpk= 0, iat= 535,  -1, r1= 1.30, r2= 1.80, r3= 4.35, r4= 4.85,
 igr2= 599, 600, 601,
 &end
#
#   33 LEU  HB2     33 LEU  HB3    2.610   (#SUP   6.19 )
 &rst
  ixpk= 6, nxpk= 0, iat= 537, 538, r1= 1.30, r2= 1.80, r3= 2.61, r4= 3.11,  &end
#
#   33 LEU  HB2     33 LEU  HG     3.350   (#SUP   5.97 )
 &rst
  ixpk= 5, nxpk= 0, iat= 537, 540, r1= 1.30, r2= 1.80, r3= 3.35, r4= 3.85,  &end
#
#   33 LEU  HB2     33 LEU  QD1    3.300   (#SUP   6.23 )
 &rst
  ixpk= 6, nxpk= 0, iat= 537,  -1, r1= 1.30, r2= 1.80, r3= 3.96, r4= 4.46,
 igr2= 542, 543, 544,
 &end
#
#   33 LEU  HB2     33 LEU  QD2    3.300   (#SUP   5.92 )
 &rst
  ixpk= 5, nxpk= 0, iat= 537,  -1, r1= 1.30, r2= 1.80, r3= 3.96, r4= 4.46,
 igr2= 546, 547, 548,
 &end
#
#   33 LEU  HB3     33 LEU  HG     3.650   (#SUP   6.17 )
 &rst
  ixpk= 6, nxpk= 0, iat= 538, 540, r1= 1.30, r2= 1.80, r3= 3.65, r4= 4.15,  &end
#
#   33 LEU  HB3     33 LEU  QD1    3.260   (#SUP   6.43 )
 &rst
  ixpk= 6, nxpk= 0, iat= 538,  -1, r1= 1.30, r2= 1.80, r3= 3.92, r4= 4.42,
 igr2= 542, 543, 544,
 &end
#
#   33 LEU  HB3     33 LEU  QD2    3.380   (#SUP   6.13 )
 &rst
  ixpk= 6, nxpk= 0, iat= 538,  -1, r1= 1.30, r2= 1.80, r3= 4.06, r4= 4.56,
 igr2= 546, 547, 548,
 &end
#
#   33 LEU  HB3     36 ILE  QD1    4.400   (#SUP   1.06 )
 &rst
  ixpk= 1, nxpk= 0, iat= 538,  -1, r1= 1.30, r2= 1.80, r3= 5.28, r4= 5.78,
 igr2= 599, 600, 601,
 &end
#
#   33 LEU  HG      33 LEU  QD2    3.220   (#SUP   5.91 )
 &rst
  ixpk= 5, nxpk= 0, iat= 540,  -1, r1= 1.30, r2= 1.80, r3= 3.87, r4= 4.37,
 igr2= 546, 547, 548,
 &end
#
#   33 LEU  QD1     33 LEU  QD2    2.990   (#SUP   6.17 )
 &rst
  ixpk= 6, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.31, r4= 4.81,
 igr1= 542, 543, 544,
 igr2= 546, 547, 548,
 &end
#
#   33 LEU  QD1     47 ILE  QG2    4.500   (#SUP   0.75 )
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.49, r4= 6.99,
 igr1= 542, 543, 544,
 igr2= 774, 775, 776,
 &end
#
#   33 LEU  QD2     47 ILE  HB     3.710   (#SUP   1.50 )
 &rst
  ixpk= 1, nxpk= 0, iat=  -1, 772, r1= 1.30, r2= 1.80, r3= 4.46, r4= 4.96,
 igr1= 546, 547, 548,
 &end
#
#   33 LEU  QD2     47 ILE  QD1    3.680   (#SUP   1.50 )
 &rst
  ixpk= 1, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.31, r4= 5.81,
 igr1= 546, 547, 548,
 igr2= 781, 782, 783,
 &end
#
#   33 LEU  QD2     47 ILE  QG2    3.410   (#SUP   2.96 )
 &rst
  ixpk= 2, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.92, r4= 5.42,
 igr1= 546, 547, 548,
 igr2= 774, 775, 776,
 &end
#
#   35 GLN  HA      35 GLN  QB     3.160   (#SUP   3.62 )
 &rst
  ixpk= 3, nxpk= 0, iat= 571,  -1, r1= 1.30, r2= 1.80, r3= 3.55, r4= 4.05,
 igr2= 573, 574,
 &end
#
#   35 GLN  HA      35 GLN  QG     3.410   (#SUP   3.62 )
 &rst
  ixpk= 3, nxpk= 0, iat= 571,  -1, r1= 1.30, r2= 1.80, r3= 3.83, r4= 4.33,
 igr2= 576, 577,
 &end
#
#   35 GLN  HA      38 ARG+ HG2    4.260   (#SUP   2.49 )
 &rst
  ixpk= 2, nxpk= 0, iat= 571, 619, r1= 1.30, r2= 1.80, r3= 4.26, r4= 4.76,  &end
#
#   35 GLN  HA      38 ARG+ QB     3.170   (#SUP   3.53 )
 &rst
  ixpk= 3, nxpk= 0, iat= 571,  -1, r1= 1.30, r2= 1.80, r3= 3.56, r4= 4.06,
 igr2= 616, 617,
 &end
#
#   35 GLN  QB      35 GLN  QG     2.500   (#SUP   5.00 )
 &rst
  ixpk= 5, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 3.15, r4= 3.65,
 igr1= 573, 574,
 igr2= 576, 577,
 &end
#
#   35 GLN  QG      38 ARG+ QB     3.950   (#SUP   1.56 )
 &rst
  ixpk= 1, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.98, r4= 5.48,
 igr1= 576, 577,
 igr2= 616, 617,
 &end
#
#   36 ILE  HA      36 ILE  HB     3.610   (#SUP   6.66 )
 &rst
  ixpk= 6, nxpk= 0, iat= 588, 590, r1= 1.30, r2= 1.80, r3= 3.61, r4= 4.11,  &end
#
#   36 ILE  HA      36 ILE  HG12   3.960   (#SUP   5.27 )
 &rst
  ixpk= 5, nxpk= 0, iat= 588, 596, r1= 1.30, r2= 1.80, r3= 3.96, r4= 4.46,  &end
#
#   36 ILE  HA      36 ILE  HG13   3.620   (#SUP   5.31 )
 &rst
  ixpk= 5, nxpk= 0, iat= 588, 597, r1= 1.30, r2= 1.80, r3= 3.62, r4= 4.12,  &end
#
#   36 ILE  HA      36 ILE  QD1    3.810   (#SUP   4.75 )
 &rst
  ixpk= 4, nxpk= 0, iat= 588,  -1, r1= 1.30, r2= 1.80, r3= 4.58, r4= 5.08,
 igr2= 599, 600, 601,
 &end
#
#   36 ILE  HA      36 ILE  QG2    3.210   (#SUP   5.63 )
 &rst
  ixpk= 5, nxpk= 0, iat= 588,  -1, r1= 1.30, r2= 1.80, r3= 3.86, r4= 4.36,
 igr2= 592, 593, 594,
 &end
#
#   36 ILE  HB      36 ILE  HG13   4.120   (#SUP   5.52 )
 &rst
  ixpk= 5, nxpk= 0, iat= 590, 597, r1= 1.30, r2= 1.80, r3= 4.12, r4= 4.62,  &end
#
#   36 ILE  HB      36 ILE  QD1    3.160   (#SUP   4.97 )
 &rst
  ixpk= 4, nxpk= 0, iat= 590,  -1, r1= 1.30, r2= 1.80, r3= 3.79, r4= 4.29,
 igr2= 599, 600, 601,
 &end
#
#   36 ILE  HB      36 ILE  QG2    2.890   (#SUP   5.50 )
 &rst
  ixpk= 5, nxpk= 0, iat= 590,  -1, r1= 1.30, r2= 1.80, r3= 3.47, r4= 3.97,
 igr2= 592, 593, 594,
 &end
#
#   36 ILE  HG12    36 ILE  HG13   2.740   (#SUP   4.97 )
 &rst
  ixpk= 4, nxpk= 0, iat= 596, 597, r1= 1.30, r2= 1.80, r3= 2.74, r4= 3.24,  &end
#
#   36 ILE  HG12    36 ILE  QD1    2.880   (#SUP   4.30 )
 &rst
  ixpk= 4, nxpk= 0, iat= 596,  -1, r1= 1.30, r2= 1.80, r3= 3.46, r4= 3.96,
 igr2= 599, 600, 601,
 &end
#
#   36 ILE  HG12    36 ILE  QG2    3.470   (#SUP   4.74 )
 &rst
  ixpk= 4, nxpk= 0, iat= 596,  -1, r1= 1.30, r2= 1.80, r3= 4.17, r4= 4.67,
 igr2= 592, 593, 594,
 &end
#
#   36 ILE  HG13    36 ILE  QD1    2.920   (#SUP   4.31 )
 &rst
  ixpk= 4, nxpk= 0, iat= 597,  -1, r1= 1.30, r2= 1.80, r3= 3.51, r4= 4.01,
 igr2= 599, 600, 601,
 &end
#
#   36 ILE  HG13    36 ILE  QG2    3.230   (#SUP   4.76 )
 &rst
  ixpk= 4, nxpk= 0, iat= 597,  -1, r1= 1.30, r2= 1.80, r3= 3.88, r4= 4.38,
 igr2= 592, 593, 594,
 &end
#
#   36 ILE  QG2     40 ASN  HB2    3.720   (#SUP   1.50 )
 &rst
  ixpk= 1, nxpk= 0, iat=  -1, 655, r1= 1.30, r2= 1.80, r3= 4.47, r4= 4.97,
 igr1= 592, 593, 594,
 &end
#
#   36 ILE  QG2     40 ASN  HB3    4.210   (#SUP   1.50 )
 &rst
  ixpk= 1, nxpk= 0, iat=  -1, 656, r1= 1.30, r2= 1.80, r3= 5.06, r4= 5.56,
 igr1= 592, 593, 594,
 &end
#
#   36 ILE  QG2     43 LEU  HB2    3.780   (#SUP   3.20 )
 &rst
  ixpk= 3, nxpk= 0, iat=  -1, 700, r1= 1.30, r2= 1.80, r3= 4.54, r4= 5.04,
 igr1= 592, 593, 594,
 &end
#
#   36 ILE  QG2     43 LEU  HG     3.440   (#SUP   2.20 )
 &rst
  ixpk= 2, nxpk= 0, iat=  -1, 703, r1= 1.30, r2= 1.80, r3= 4.13, r4= 4.63,
 igr1= 592, 593, 594,
 &end
#
#   36 ILE  QG2     43 LEU  QD2    2.960   (#SUP   3.03 )
 &rst
  ixpk= 3, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.27, r4= 4.77,
 igr1= 592, 593, 594,
 igr2= 709, 710, 711,
 &end
#
#   36 ILE  QG2     44 LEU  HA     3.720   (#SUP   1.89 )
 &rst
  ixpk= 1, nxpk= 0, iat=  -1, 717, r1= 1.30, r2= 1.80, r3= 4.47, r4= 4.97,
 igr1= 592, 593, 594,
 &end
#
#   36 ILE  QG2     44 LEU  HB3    3.590   (#SUP   3.79 )
 &rst
  ixpk= 3, nxpk= 0, iat=  -1, 720, r1= 1.30, r2= 1.80, r3= 4.31, r4= 4.81,
 igr1= 592, 593, 594,
 &end
#
#   37 GLY  HA2     37 GLY  HA3    2.690   (#SUP   2.00 )
 &rst
  ixpk= 2, nxpk= 0, iat= 607, 608, r1= 1.30, r2= 1.80, r3= 2.69, r4= 3.19,  &end
#
#   37 GLY  HA2     41 PRO  HA     4.320   (#SUP   0.75 )
 &rst
  ixpk= 0, nxpk= 0, iat= 607, 675, r1= 1.30, r2= 1.80, r3= 4.32, r4= 4.82,  &end
#
#   37 GLY  HA2     44 LEU  HB2    3.770   (#SUP   3.87 )
 &rst
  ixpk= 3, nxpk= 0, iat= 607, 719, r1= 1.30, r2= 1.80, r3= 3.77, r4= 4.27,  &end
#
#   37 GLY  HA2     44 LEU  HB3    3.790   (#SUP   4.23 )
 &rst
  ixpk= 4, nxpk= 0, iat= 607, 720, r1= 1.30, r2= 1.80, r3= 3.79, r4= 4.29,  &end
#
#   37 GLY  HA2     44 LEU  QD1    3.370   (#SUP   4.58 )
 &rst
  ixpk= 4, nxpk= 0, iat= 607,  -1, r1= 1.30, r2= 1.80, r3= 4.05, r4= 4.55,
 igr2= 724, 725, 726,
 &end
#
#   37 GLY  HA2     44 LEU  QD2    4.230   (#SUP   3.35 )
 &rst
  ixpk= 3, nxpk= 0, iat= 607,  -1, r1= 1.30, r2= 1.80, r3= 5.08, r4= 5.58,
 igr2= 728, 729, 730,
 &end
#
#   37 GLY  HA3     41 PRO  HA     4.070   (#SUP   0.75 )
 &rst
  ixpk= 0, nxpk= 0, iat= 608, 675, r1= 1.30, r2= 1.80, r3= 4.07, r4= 4.57,  &end
#
#   37 GLY  HA3     44 LEU  HB2    3.720   (#SUP   2.00 )
 &rst
  ixpk= 2, nxpk= 0, iat= 608, 719, r1= 1.30, r2= 1.80, r3= 3.72, r4= 4.22,  &end
#
#   37 GLY  HA3     44 LEU  QD1    3.510   (#SUP   2.63 )
 &rst
  ixpk= 2, nxpk= 0, iat= 608,  -1, r1= 1.30, r2= 1.80, r3= 4.22, r4= 4.72,
 igr2= 724, 725, 726,
 &end
#
#   38 ARG+ HA      38 ARG+ HG2    3.860   (#SUP   4.75 )
 &rst
  ixpk= 4, nxpk= 0, iat= 614, 619, r1= 1.30, r2= 1.80, r3= 3.86, r4= 4.36,  &end
#
#   38 ARG+ HA      38 ARG+ HG3    3.620   (#SUP   3.80 )
 &rst
  ixpk= 3, nxpk= 0, iat= 614, 620, r1= 1.30, r2= 1.80, r3= 3.62, r4= 4.12,  &end
#
#   38 ARG+ HA      38 ARG+ QB     3.020   (#SUP   3.95 )
 &rst
  ixpk= 3, nxpk= 0, iat= 614,  -1, r1= 1.30, r2= 1.80, r3= 3.39, r4= 3.89,
 igr2= 616, 617,
 &end
#
#   38 ARG+ HD2     38 ARG+ HG2    3.510   (#SUP   3.94 )
 &rst
  ixpk= 3, nxpk= 0, iat= 622, 619, r1= 1.30, r2= 1.80, r3= 3.51, r4= 4.01,  &end
#
#   38 ARG+ HD2     38 ARG+ HG3    3.460   (#SUP   3.61 )
 &rst
  ixpk= 3, nxpk= 0, iat= 622, 620, r1= 1.30, r2= 1.80, r3= 3.46, r4= 3.96,  &end
#
#   38 ARG+ HD2     38 ARG+ QB     3.390   (#SUP   3.65 )
 &rst
  ixpk= 3, nxpk= 0, iat= 622,  -1, r1= 1.30, r2= 1.80, r3= 3.81, r4= 4.31,
 igr2= 616, 617,
 &end
#
#   38 ARG+ HD3     38 ARG+ HG2    3.410   (#SUP   3.94 )
 &rst
  ixpk= 3, nxpk= 0, iat= 623, 619, r1= 1.30, r2= 1.80, r3= 3.41, r4= 3.91,  &end
#
#   38 ARG+ HD3     38 ARG+ HG3    3.210   (#SUP   3.61 )
 &rst
  ixpk= 3, nxpk= 0, iat= 623, 620, r1= 1.30, r2= 1.80, r3= 3.21, r4= 3.71,  &end
#
#   38 ARG+ HD3     38 ARG+ QB     3.420   (#SUP   3.65 )
 &rst
  ixpk= 3, nxpk= 0, iat= 623,  -1, r1= 1.30, r2= 1.80, r3= 3.84, r4= 4.34,
 igr2= 616, 617,
 &end
#
#   38 ARG+ HG2     38 ARG+ HG3    2.650   (#SUP   5.16 )
 &rst
  ixpk= 5, nxpk= 0, iat= 619, 620, r1= 1.30, r2= 1.80, r3= 2.65, r4= 3.15,  &end
#
#   38 ARG+ HG2     38 ARG+ QB     2.800   (#SUP   5.31 )
 &rst
  ixpk= 5, nxpk= 0, iat= 619,  -1, r1= 1.30, r2= 1.80, r3= 3.14, r4= 3.64,
 igr2= 616, 617,
 &end
#
#   38 ARG+ HG3     38 ARG+ QB     3.000   (#SUP   4.85 )
 &rst
  ixpk= 4, nxpk= 0, iat= 620,  -1, r1= 1.30, r2= 1.80, r3= 3.37, r4= 3.87,
 igr2= 616, 617,
 &end
#
#   39 GLU- HA      39 GLU- HB2    3.310   (#SUP   5.00 )
 &rst
  ixpk= 5, nxpk= 0, iat= 638, 640, r1= 1.30, r2= 1.80, r3= 3.31, r4= 3.81,  &end
#
#   39 GLU- HA      39 GLU- HB3    3.670   (#SUP   5.00 )
 &rst
  ixpk= 5, nxpk= 0, iat= 638, 641, r1= 1.30, r2= 1.80, r3= 3.67, r4= 4.17,  &end
#
#   39 GLU- HA      39 GLU- HG2    3.790   (#SUP   4.27 )
 &rst
  ixpk= 4, nxpk= 0, iat= 638, 643, r1= 1.30, r2= 1.80, r3= 3.79, r4= 4.29,  &end
#
#   39 GLU- HA      39 GLU- HG3    3.670   (#SUP   4.31 )
 &rst
  ixpk= 4, nxpk= 0, iat= 638, 644, r1= 1.30, r2= 1.80, r3= 3.67, r4= 4.17,  &end
#
#   39 GLU- HB2     39 GLU- HB3    2.620   (#SUP   5.00 )
 &rst
  ixpk= 5, nxpk= 0, iat= 640, 641, r1= 1.30, r2= 1.80, r3= 2.62, r4= 3.12,  &end
#
#   39 GLU- HB2     39 GLU- HG2    3.010   (#SUP   4.27 )
 &rst
  ixpk= 4, nxpk= 0, iat= 640, 643, r1= 1.30, r2= 1.80, r3= 3.01, r4= 3.51,  &end
#
#   39 GLU- HB2     39 GLU- HG3    3.180   (#SUP   4.31 )
 &rst
  ixpk= 4, nxpk= 0, iat= 640, 644, r1= 1.30, r2= 1.80, r3= 3.18, r4= 3.68,  &end
#
#   39 GLU- HB3     39 GLU- HG2    3.400   (#SUP   4.27 )
 &rst
  ixpk= 4, nxpk= 0, iat= 641, 643, r1= 1.30, r2= 1.80, r3= 3.40, r4= 3.90,  &end
#
#   39 GLU- HB3     39 GLU- HG3    3.390   (#SUP   4.31 )
 &rst
  ixpk= 4, nxpk= 0, iat= 641, 644, r1= 1.30, r2= 1.80, r3= 3.39, r4= 3.89,  &end
#
#   39 GLU- HG2     39 GLU- HG3    2.400   (#SUP   3.96 )
 &rst
  ixpk= 3, nxpk= 0, iat= 643, 644, r1= 1.30, r2= 1.80, r3= 2.40, r4= 2.90,  &end
#
#   40 ASN  HA      40 ASN  HB2    3.640   (#SUP   4.20 )
 &rst
  ixpk= 4, nxpk= 0, iat= 653, 655, r1= 1.30, r2= 1.80, r3= 3.64, r4= 4.14,  &end
#
#   40 ASN  HA      40 ASN  HB3    3.260   (#SUP   4.20 )
 &rst
  ixpk= 4, nxpk= 0, iat= 653, 656, r1= 1.30, r2= 1.80, r3= 3.26, r4= 3.76,  &end
#
#   40 ASN  HA      41 PRO  HD2    3.130   (#SUP   4.42 )
 &rst
  ixpk= 4, nxpk= 0, iat= 653, 666, r1= 1.30, r2= 1.80, r3= 3.13, r4= 3.63,  &end
#
#   40 ASN  HA      41 PRO  HD3    3.440   (#SUP   4.99 )
 &rst
  ixpk= 4, nxpk= 0, iat= 653, 667, r1= 1.30, r2= 1.80, r3= 3.44, r4= 3.94,  &end
#
#   40 ASN  HB2     40 ASN  HB3    2.520   (#SUP   4.00 )
 &rst
  ixpk= 4, nxpk= 0, iat= 655, 656, r1= 1.30, r2= 1.80, r3= 2.52, r4= 3.02,  &end
#
#   40 ASN  HB2     43 LEU  HB2    3.920   (#SUP   3.87 )
 &rst
  ixpk= 3, nxpk= 0, iat= 655, 700, r1= 1.30, r2= 1.80, r3= 3.92, r4= 4.42,  &end
#
#   40 ASN  HB2     43 LEU  HB3    4.350   (#SUP   4.82 )
 &rst
  ixpk= 4, nxpk= 0, iat= 655, 701, r1= 1.30, r2= 1.80, r3= 4.35, r4= 4.85,  &end
#
#   40 ASN  HB2     43 LEU  QD2    4.020   (#SUP   4.86 )
 &rst
  ixpk= 4, nxpk= 0, iat= 655,  -1, r1= 1.30, r2= 1.80, r3= 4.83, r4= 5.33,
 igr2= 709, 710, 711,
 &end
#
#   40 ASN  HB3     43 LEU  HB2    4.380   (#SUP   2.00 )
 &rst
  ixpk= 2, nxpk= 0, iat= 656, 700, r1= 1.30, r2= 1.80, r3= 4.38, r4= 4.88,  &end
#
#   41 PRO  HA      41 PRO  HB2    3.250   (#SUP   5.00 )
 &rst
  ixpk= 5, nxpk= 0, iat= 675, 672, r1= 1.30, r2= 1.80, r3= 3.25, r4= 3.75,  &end
#
#   41 PRO  HA      41 PRO  HB3    3.420   (#SUP   5.98 )
 &rst
  ixpk= 5, nxpk= 0, iat= 675, 673, r1= 1.30, r2= 1.80, r3= 3.42, r4= 3.92,  &end
#
#   41 PRO  HA      41 PRO  HD3    4.650   (#SUP   6.83 )
 &rst
  ixpk= 6, nxpk= 0, iat= 675, 667, r1= 1.30, r2= 1.80, r3= 4.65, r4= 5.15,  &end
#
#   41 PRO  HA      41 PRO  HG2    3.760   (#SUP   5.59 )
 &rst
  ixpk= 5, nxpk= 0, iat= 675, 669, r1= 1.30, r2= 1.80, r3= 3.76, r4= 4.26,  &end
#
#   41 PRO  HA      44 LEU  HB3    4.180   (#SUP   0.69 )
 &rst
  ixpk= 0, nxpk= 0, iat= 675, 720, r1= 1.30, r2= 1.80, r3= 4.18, r4= 4.68,  &end
#
#   41 PRO  HA      44 LEU  QD1    3.990   (#SUP   0.75 )
 &rst
  ixpk= 0, nxpk= 0, iat= 675,  -1, r1= 1.30, r2= 1.80, r3= 4.79, r4= 5.29,
 igr2= 724, 725, 726,
 &end
#
#   41 PRO  HB2     41 PRO  HB3    2.580   (#SUP   5.98 )
 &rst
  ixpk= 5, nxpk= 0, iat= 672, 673, r1= 1.30, r2= 1.80, r3= 2.58, r4= 3.08,  &end
#
#   41 PRO  HB2     41 PRO  HD3    4.110   (#SUP   6.33 )
 &rst
  ixpk= 6, nxpk= 0, iat= 672, 667, r1= 1.30, r2= 1.80, r3= 4.11, r4= 4.61,  &end
#
#   41 PRO  HB2     41 PRO  HG2    2.920   (#SUP   5.61 )
 &rst
  ixpk= 5, nxpk= 0, iat= 672, 669, r1= 1.30, r2= 1.80, r3= 2.92, r4= 3.42,  &end
#
#   41 PRO  HB2     41 PRO  HG3    3.480   (#SUP   5.00 )
 &rst
  ixpk= 5, nxpk= 0, iat= 672, 670, r1= 1.30, r2= 1.80, r3= 3.48, r4= 3.98,  &end
#
#   41 PRO  HB3     41 PRO  HD2    3.740   (#SUP   6.76 )
 &rst
  ixpk= 6, nxpk= 0, iat= 673, 666, r1= 1.30, r2= 1.80, r3= 3.74, r4= 4.24,  &end
#
#   41 PRO  HB3     41 PRO  HD3    4.330   (#SUP   6.41 )
 &rst
  ixpk= 6, nxpk= 0, iat= 673, 667, r1= 1.30, r2= 1.80, r3= 4.33, r4= 4.83,  &end
#
#   41 PRO  HB3     41 PRO  HG3    3.000   (#SUP   5.31 )
 &rst
  ixpk= 5, nxpk= 0, iat= 673, 670, r1= 1.30, r2= 1.80, r3= 3.00, r4= 3.50,  &end
#
#   41 PRO  HD2     41 PRO  HD3    2.670   (#SUP   7.27 )
 &rst
  ixpk= 7, nxpk= 0, iat= 666, 667, r1= 1.30, r2= 1.80, r3= 2.67, r4= 3.17,  &end
#
#   41 PRO  HD2     41 PRO  HG2    3.370   (#SUP   6.38 )
 &rst
  ixpk= 6, nxpk= 0, iat= 666, 669, r1= 1.30, r2= 1.80, r3= 3.37, r4= 3.87,  &end
#
#   41 PRO  HD2     41 PRO  HG3    3.460   (#SUP   5.08 )
 &rst
  ixpk= 5, nxpk= 0, iat= 666, 670, r1= 1.30, r2= 1.80, r3= 3.46, r4= 3.96,  &end
#
#   41 PRO  HD3     41 PRO  HG2    3.340   (#SUP   6.02 )
 &rst
  ixpk= 6, nxpk= 0, iat= 667, 669, r1= 1.30, r2= 1.80, r3= 3.34, r4= 3.84,  &end
#
#   41 PRO  HD3     41 PRO  HG3    3.420   (#SUP   5.69 )
 &rst
  ixpk= 5, nxpk= 0, iat= 667, 670, r1= 1.30, r2= 1.80, r3= 3.42, r4= 3.92,  &end
#
#   41 PRO  HG2     41 PRO  HG3    2.400   (#SUP   5.19 )
 &rst
  ixpk= 5, nxpk= 0, iat= 669, 670, r1= 1.30, r2= 1.80, r3= 2.40, r4= 2.90,  &end
#
#   42 GLN  HA      42 GLN  HB2    3.080   (#SUP   3.86 )
 &rst
  ixpk= 3, nxpk= 0, iat= 681, 683, r1= 1.30, r2= 1.80, r3= 3.08, r4= 3.58,  &end
#
#   42 GLN  HA      42 GLN  HB3    3.360   (#SUP   3.97 )
 &rst
  ixpk= 3, nxpk= 0, iat= 681, 684, r1= 1.30, r2= 1.80, r3= 3.36, r4= 3.86,  &end
#
#   42 GLN  HA      42 GLN  QG     3.390   (#SUP   3.96 )
 &rst
  ixpk= 3, nxpk= 0, iat= 681,  -1, r1= 1.30, r2= 1.80, r3= 3.81, r4= 4.31,
 igr2= 686, 687,
 &end
#
#   42 GLN  HB3     42 GLN  QG     3.060   (#SUP   3.00 )
 &rst
  ixpk= 3, nxpk= 0, iat= 684,  -1, r1= 1.30, r2= 1.80, r3= 3.43, r4= 3.93,
 igr2= 686, 687,
 &end
#
#   43 LEU  HA      43 LEU  HB2    3.990   (#SUP   5.98 )
 &rst
  ixpk= 5, nxpk= 0, iat= 698, 700, r1= 1.30, r2= 1.80, r3= 3.99, r4= 4.49,  &end
#
#   43 LEU  HA      43 LEU  HB3    3.460   (#SUP   4.79 )
 &rst
  ixpk= 4, nxpk= 0, iat= 698, 701, r1= 1.30, r2= 1.80, r3= 3.46, r4= 3.96,  &end
#
#   43 LEU  HA      43 LEU  QD1    3.180   (#SUP   5.31 )
 &rst
  ixpk= 5, nxpk= 0, iat= 698,  -1, r1= 1.30, r2= 1.80, r3= 3.82, r4= 4.32,
 igr2= 705, 706, 707,
 &end
#
#   43 LEU  HA      43 LEU  QD2    4.010   (#SUP   5.31 )
 &rst
  ixpk= 5, nxpk= 0, iat= 698,  -1, r1= 1.30, r2= 1.80, r3= 4.82, r4= 5.32,
 igr2= 709, 710, 711,
 &end
#
#   43 LEU  HA      46 GLN  HB2    3.810   (#SUP   4.07 )
 &rst
  ixpk= 4, nxpk= 0, iat= 698, 755, r1= 1.30, r2= 1.80, r3= 3.81, r4= 4.31,  &end
#
#   43 LEU  HA      46 GLN  HB3    3.750   (#SUP   4.10 )
 &rst
  ixpk= 4, nxpk= 0, iat= 698, 756, r1= 1.30, r2= 1.80, r3= 3.75, r4= 4.25,  &end
#
#   43 LEU  HB2     43 LEU  HB3    2.710   (#SUP   5.77 )
 &rst
  ixpk= 5, nxpk= 0, iat= 700, 701, r1= 1.30, r2= 1.80, r3= 2.71, r4= 3.21,  &end
#
#   43 LEU  HB2     43 LEU  HG     2.960   (#SUP   4.79 )
 &rst
  ixpk= 4, nxpk= 0, iat= 700, 703, r1= 1.30, r2= 1.80, r3= 2.96, r4= 3.46,  &end
#
#   43 LEU  HB2     43 LEU  QD1    3.660   (#SUP   5.31 )
 &rst
  ixpk= 5, nxpk= 0, iat= 700,  -1, r1= 1.30, r2= 1.80, r3= 4.40, r4= 4.90,
 igr2= 705, 706, 707,
 &end
#
#   43 LEU  HB2     43 LEU  QD2    3.860   (#SUP   5.31 )
 &rst
  ixpk= 5, nxpk= 0, iat= 700,  -1, r1= 1.30, r2= 1.80, r3= 4.64, r4= 5.14,
 igr2= 709, 710, 711,
 &end
#
#   43 LEU  HB3     43 LEU  QD2    3.080   (#SUP   5.24 )
 &rst
  ixpk= 5, nxpk= 0, iat= 701,  -1, r1= 1.30, r2= 1.80, r3= 3.70, r4= 4.20,
 igr2= 709, 710, 711,
 &end
#
#   43 LEU  HG      43 LEU  QD1    3.170   (#SUP   3.47 )
 &rst
  ixpk= 3, nxpk= 0, iat= 703,  -1, r1= 1.30, r2= 1.80, r3= 3.81, r4= 4.31,
 igr2= 705, 706, 707,
 &end
#
#   43 LEU  HG      43 LEU  QD2    3.100   (#SUP   4.38 )
 &rst
  ixpk= 4, nxpk= 0, iat= 703,  -1, r1= 1.30, r2= 1.80, r3= 3.72, r4= 4.22,
 igr2= 709, 710, 711,
 &end
#
#   43 LEU  HG      47 ILE  QD1    3.550   (#SUP   2.15 )
 &rst
  ixpk= 2, nxpk= 0, iat= 703,  -1, r1= 1.30, r2= 1.80, r3= 4.26, r4= 4.76,
 igr2= 781, 782, 783,
 &end
#
#   43 LEU  QD1     43 LEU  QD2    2.950   (#SUP   5.00 )
 &rst
  ixpk= 5, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.25, r4= 4.75,
 igr1= 705, 706, 707,
 igr2= 709, 710, 711,
 &end
#
#   43 LEU  QD1     46 GLN  HB2    3.860   (#SUP   4.54 )
 &rst
  ixpk= 4, nxpk= 0, iat=  -1, 755, r1= 1.30, r2= 1.80, r3= 4.64, r4= 5.14,
 igr1= 705, 706, 707,
 &end
#
#   43 LEU  QD1     46 GLN  HB3    4.270   (#SUP   4.54 )
 &rst
  ixpk= 4, nxpk= 0, iat=  -1, 756, r1= 1.30, r2= 1.80, r3= 5.13, r4= 5.63,
 igr1= 705, 706, 707,
 &end
#
#   43 LEU  QD1     47 ILE  HG12   4.130   (#SUP   2.21 )
 &rst
  ixpk= 2, nxpk= 0, iat=  -1, 778, r1= 1.30, r2= 1.80, r3= 4.96, r4= 5.46,
 igr1= 705, 706, 707,
 &end
#
#   43 LEU  QD1     47 ILE  QD1    3.690   (#SUP   6.29 )
 &rst
  ixpk= 6, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.32, r4= 5.82,
 igr1= 705, 706, 707,
 igr2= 781, 782, 783,
 &end
#
#   43 LEU  QD2     47 ILE  QD1    3.780   (#SUP   2.16 )
 &rst
  ixpk= 2, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.45, r4= 5.95,
 igr1= 709, 710, 711,
 igr2= 781, 782, 783,
 &end
#
#   44 LEU  HA      44 LEU  HB2    3.630   (#SUP   5.94 )
 &rst
  ixpk= 5, nxpk= 0, iat= 717, 719, r1= 1.30, r2= 1.80, r3= 3.63, r4= 4.13,  &end
#
#   44 LEU  HA      44 LEU  HB3    3.600   (#SUP   5.94 )
 &rst
  ixpk= 5, nxpk= 0, iat= 717, 720, r1= 1.30, r2= 1.80, r3= 3.60, r4= 4.10,  &end
#
#   44 LEU  HA      44 LEU  HG     3.900   (#SUP   5.28 )
 &rst
  ixpk= 5, nxpk= 0, iat= 717, 722, r1= 1.30, r2= 1.80, r3= 3.90, r4= 4.40,  &end
#
#   44 LEU  HA      44 LEU  QD1    3.600   (#SUP   5.22 )
 &rst
  ixpk= 5, nxpk= 0, iat= 717,  -1, r1= 1.30, r2= 1.80, r3= 4.32, r4= 4.82,
 igr2= 724, 725, 726,
 &end
#
#   44 LEU  HA      44 LEU  QD2    2.990   (#SUP   5.76 )
 &rst
  ixpk= 5, nxpk= 0, iat= 717,  -1, r1= 1.30, r2= 1.80, r3= 3.59, r4= 4.09,
 igr2= 728, 729, 730,
 &end
#
#   44 LEU  HA      47 ILE  HB     3.210   (#SUP   3.83 )
 &rst
  ixpk= 3, nxpk= 0, iat= 717, 772, r1= 1.30, r2= 1.80, r3= 3.21, r4= 3.71,  &end
#
#   44 LEU  HA      47 ILE  QD1    3.620   (#SUP   4.97 )
 &rst
  ixpk= 4, nxpk= 0, iat= 717,  -1, r1= 1.30, r2= 1.80, r3= 4.35, r4= 4.85,
 igr2= 781, 782, 783,
 &end
#
#   44 LEU  HA      47 ILE  QG2    4.690   (#SUP   3.83 )
 &rst
  ixpk= 3, nxpk= 0, iat= 717,  -1, r1= 1.30, r2= 1.80, r3= 5.63, r4= 6.13,
 igr2= 774, 775, 776,
 &end
#
#   44 LEU  HB2     44 LEU  HB3    2.710   (#SUP   6.00 )
 &rst
  ixpk= 6, nxpk= 0, iat= 719, 720, r1= 1.30, r2= 1.80, r3= 2.71, r4= 3.21,  &end
#
#   44 LEU  HB2     44 LEU  HG     3.460   (#SUP   5.27 )
 &rst
  ixpk= 5, nxpk= 0, iat= 719, 722, r1= 1.30, r2= 1.80, r3= 3.46, r4= 3.96,  &end
#
#   44 LEU  HB2     44 LEU  QD1    3.250   (#SUP   5.15 )
 &rst
  ixpk= 5, nxpk= 0, iat= 719,  -1, r1= 1.30, r2= 1.80, r3= 3.90, r4= 4.40,
 igr2= 724, 725, 726,
 &end
#
#   44 LEU  HB2     44 LEU  QD2    3.260   (#SUP   5.78 )
 &rst
  ixpk= 5, nxpk= 0, iat= 719,  -1, r1= 1.30, r2= 1.80, r3= 3.92, r4= 4.42,
 igr2= 728, 729, 730,
 &end
#
#   44 LEU  HB3     44 LEU  HG     3.580   (#SUP   5.27 )
 &rst
  ixpk= 5, nxpk= 0, iat= 720, 722, r1= 1.30, r2= 1.80, r3= 3.58, r4= 4.08,  &end
#
#   44 LEU  HB3     44 LEU  QD1    3.900   (#SUP   5.15 )
 &rst
  ixpk= 5, nxpk= 0, iat= 720,  -1, r1= 1.30, r2= 1.80, r3= 4.68, r4= 5.18,
 igr2= 724, 725, 726,
 &end
#
#   44 LEU  HB3     44 LEU  QD2    3.420   (#SUP   5.79 )
 &rst
  ixpk= 5, nxpk= 0, iat= 720,  -1, r1= 1.30, r2= 1.80, r3= 4.11, r4= 4.61,
 igr2= 728, 729, 730,
 &end
#
#   44 LEU  HG      44 LEU  QD2    2.920   (#SUP   4.11 )
 &rst
  ixpk= 4, nxpk= 0, iat= 722,  -1, r1= 1.30, r2= 1.80, r3= 3.51, r4= 4.01,
 igr2= 728, 729, 730,
 &end
#
#   44 LEU  QD2     47 ILE  HB     3.550   (#SUP   4.74 )
 &rst
  ixpk= 4, nxpk= 0, iat=  -1, 772, r1= 1.30, r2= 1.80, r3= 4.26, r4= 4.76,
 igr1= 728, 729, 730,
 &end
#
#   44 LEU  QD2     47 ILE  QD1    3.540   (#SUP   5.83 )
 &rst
  ixpk= 5, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.11, r4= 5.61,
 igr1= 728, 729, 730,
 igr2= 781, 782, 783,
 &end
#
#   44 LEU  QD2     47 ILE  QG2    3.620   (#SUP   4.74 )
 &rst
  ixpk= 4, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.22, r4= 5.72,
 igr1= 728, 729, 730,
 igr2= 774, 775, 776,
 &end
#
#   45 GLN  HA      45 GLN  HG2    4.080   (#SUP   3.72 )
 &rst
  ixpk= 3, nxpk= 0, iat= 736, 741, r1= 1.30, r2= 1.80, r3= 4.08, r4= 4.58,  &end
#
#   45 GLN  HA      45 GLN  HG3    4.100   (#SUP   3.65 )
 &rst
  ixpk= 3, nxpk= 0, iat= 736, 742, r1= 1.30, r2= 1.80, r3= 4.10, r4= 4.60,  &end
#
#   45 GLN  HA      45 GLN  QB     2.780   (#SUP   4.62 )
 &rst
  ixpk= 4, nxpk= 0, iat= 736,  -1, r1= 1.30, r2= 1.80, r3= 3.12, r4= 3.62,
 igr2= 738, 739,
 &end
#
#   45 GLN  HG2     45 GLN  HG3    2.400   (#SUP   2.93 )
 &rst
  ixpk= 2, nxpk= 0, iat= 741, 742, r1= 1.30, r2= 1.80, r3= 2.40, r4= 2.90,  &end
#
#   45 GLN  HG2     45 GLN  QB     2.450   (#SUP   3.50 )
 &rst
  ixpk= 3, nxpk= 0, iat= 741,  -1, r1= 1.30, r2= 1.80, r3= 2.75, r4= 3.25,
 igr2= 738, 739,
 &end
#
#   46 GLN  HA      46 GLN  HB2    3.490   (#SUP   5.03 )
 &rst
  ixpk= 5, nxpk= 0, iat= 753, 755, r1= 1.30, r2= 1.80, r3= 3.49, r4= 3.99,  &end
#
#   46 GLN  HA      46 GLN  HB3    3.380   (#SUP   5.18 )
 &rst
  ixpk= 5, nxpk= 0, iat= 753, 756, r1= 1.30, r2= 1.80, r3= 3.38, r4= 3.88,  &end
#
#   46 GLN  HA      46 GLN  HG2    3.630   (#SUP   5.54 )
 &rst
  ixpk= 5, nxpk= 0, iat= 753, 758, r1= 1.30, r2= 1.80, r3= 3.63, r4= 4.13,  &end
#
#   46 GLN  HA      46 GLN  HG3    3.470   (#SUP   5.31 )
 &rst
  ixpk= 5, nxpk= 0, iat= 753, 759, r1= 1.30, r2= 1.80, r3= 3.47, r4= 3.97,  &end
#
#   46 GLN  HA      49 GLN  HB2    3.740   (#SUP   1.50 )
 &rst
  ixpk= 1, nxpk= 0, iat= 753, 802, r1= 1.30, r2= 1.80, r3= 3.74, r4= 4.24,  &end
#
#   46 GLN  HA      49 GLN  HB3    4.020   (#SUP   1.50 )
 &rst
  ixpk= 1, nxpk= 0, iat= 753, 803, r1= 1.30, r2= 1.80, r3= 4.02, r4= 4.52,  &end
#
#   46 GLN  HB3     46 GLN  HG2    3.410   (#SUP   2.94 )
 &rst
  ixpk= 2, nxpk= 0, iat= 756, 758, r1= 1.30, r2= 1.80, r3= 3.41, r4= 3.91,  &end
#
#   47 ILE  HA      47 ILE  HB     3.720   (#SUP   6.21 )
 &rst
  ixpk= 6, nxpk= 0, iat= 770, 772, r1= 1.30, r2= 1.80, r3= 3.72, r4= 4.22,  &end
#
#   47 ILE  HA      47 ILE  HG12   3.710   (#SUP   5.27 )
 &rst
  ixpk= 5, nxpk= 0, iat= 770, 778, r1= 1.30, r2= 1.80, r3= 3.71, r4= 4.21,  &end
#
#   47 ILE  HA      47 ILE  HG13   3.290   (#SUP   4.43 )
 &rst
  ixpk= 4, nxpk= 0, iat= 770, 779, r1= 1.30, r2= 1.80, r3= 3.29, r4= 3.79,  &end
#
#   47 ILE  HA      47 ILE  QD1    3.710   (#SUP   6.01 )
 &rst
  ixpk= 6, nxpk= 0, iat= 770,  -1, r1= 1.30, r2= 1.80, r3= 4.46, r4= 4.96,
 igr2= 781, 782, 783,
 &end
#
#   47 ILE  HA      47 ILE  QG2    3.500   (#SUP   6.65 )
 &rst
  ixpk= 6, nxpk= 0, iat= 770,  -1, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
 igr2= 774, 775, 776,
 &end
#
#   47 ILE  HB      47 ILE  QD1    3.320   (#SUP   5.51 )
 &rst
  ixpk= 5, nxpk= 0, iat= 772,  -1, r1= 1.30, r2= 1.80, r3= 3.99, r4= 4.49,
 igr2= 781, 782, 783,
 &end
#
#   47 ILE  HB      47 ILE  QG2    3.190   (#SUP   6.82 )
 &rst
  ixpk= 6, nxpk= 0, iat= 772,  -1, r1= 1.30, r2= 1.80, r3= 3.83, r4= 4.33,
 igr2= 774, 775, 776,
 &end
#
#   47 ILE  HG12    47 ILE  HG13   2.800   (#SUP   3.25 )
 &rst
  ixpk= 3, nxpk= 0, iat= 778, 779, r1= 1.30, r2= 1.80, r3= 2.80, r4= 3.30,  &end
#
#   47 ILE  HG12    47 ILE  QD1    2.870   (#SUP   5.42 )
 &rst
  ixpk= 5, nxpk= 0, iat= 778,  -1, r1= 1.30, r2= 1.80, r3= 3.45, r4= 3.95,
 igr2= 781, 782, 783,
 &end
#
#   47 ILE  HG12    47 ILE  QG2    3.580   (#SUP   5.89 )
 &rst
  ixpk= 5, nxpk= 0, iat= 778,  -1, r1= 1.30, r2= 1.80, r3= 4.30, r4= 4.80,
 igr2= 774, 775, 776,
 &end
#
#   47 ILE  HG13    47 ILE  QG2    3.840   (#SUP   5.00 )
 &rst
  ixpk= 5, nxpk= 0, iat= 779,  -1, r1= 1.30, r2= 1.80, r3= 4.61, r4= 5.11,
 igr2= 774, 775, 776,
 &end
#
#   47 ILE  QD1     47 ILE  QG2    3.140   (#SUP   6.65 )
 &rst
  ixpk= 6, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.53, r4= 5.03,
 igr1= 781, 782, 783,
 igr2= 774, 775, 776,
 &end
#
#   47 ILE  QG2     48 SER  HA     4.290   (#SUP   3.91 )
 &rst
  ixpk= 3, nxpk= 0, iat=  -1, 789, r1= 1.30, r2= 1.80, r3= 5.15, r4= 5.65,
 igr1= 774, 775, 776,
 &end
#
#   47 ILE  QG2     54 PHE  HB2    4.200   (#SUP   1.50 )
 &rst
  ixpk= 1, nxpk= 0, iat=  -1, 885, r1= 1.30, r2= 1.80, r3= 5.04, r4= 5.54,
 igr1= 774, 775, 776,
 &end
#
#   47 ILE  QG2     54 PHE  HB3    3.940   (#SUP   1.50 )
 &rst
  ixpk= 1, nxpk= 0, iat=  -1, 886, r1= 1.30, r2= 1.80, r3= 4.73, r4= 5.23,
 igr1= 774, 775, 776,
 &end
#
#   48 SER  HA      48 SER  HB2    3.150   (#SUP   2.91 )
 &rst
  ixpk= 2, nxpk= 0, iat= 789, 791, r1= 1.30, r2= 1.80, r3= 3.15, r4= 3.65,  &end
#
#   48 SER  HA      51 GLN  HB2    3.920   (#SUP   1.50 )
 &rst
  ixpk= 1, nxpk= 0, iat= 789, 836, r1= 1.30, r2= 1.80, r3= 3.92, r4= 4.42,  &end
#
#   48 SER  HA      51 GLN  HB3    4.590   (#SUP   1.50 )
 &rst
  ixpk= 1, nxpk= 0, iat= 789, 837, r1= 1.30, r2= 1.80, r3= 4.59, r4= 5.09,  &end
#
#   48 SER  HA      51 GLN  QG     3.620   (#SUP   1.49 )
 &rst
  ixpk= 1, nxpk= 0, iat= 789,  -1, r1= 1.30, r2= 1.80, r3= 4.06, r4= 4.56,
 igr2= 839, 840,
 &end
#
#   49 GLN  HA      49 GLN  HB2    3.440   (#SUP   5.00 )
 &rst
  ixpk= 5, nxpk= 0, iat= 800, 802, r1= 1.30, r2= 1.80, r3= 3.44, r4= 3.94,  &end
#
#   49 GLN  HA      49 GLN  HB3    3.320   (#SUP   5.00 )
 &rst
  ixpk= 5, nxpk= 0, iat= 800, 803, r1= 1.30, r2= 1.80, r3= 3.32, r4= 3.82,  &end
#
#   49 GLN  HA      49 GLN  HG2    3.790   (#SUP   4.61 )
 &rst
  ixpk= 4, nxpk= 0, iat= 800, 805, r1= 1.30, r2= 1.80, r3= 3.79, r4= 4.29,  &end
#
#   49 GLN  HA      49 GLN  HG3    3.710   (#SUP   5.08 )
 &rst
  ixpk= 5, nxpk= 0, iat= 800, 806, r1= 1.30, r2= 1.80, r3= 3.71, r4= 4.21,  &end
#
#   49 GLN  HB2     49 GLN  HB3    2.460   (#SUP   5.00 )
 &rst
  ixpk= 5, nxpk= 0, iat= 802, 803, r1= 1.30, r2= 1.80, r3= 2.46, r4= 2.96,  &end
#
#   49 GLN  HB2     49 GLN  HG2    3.670   (#SUP   4.61 )
 &rst
  ixpk= 4, nxpk= 0, iat= 802, 805, r1= 1.30, r2= 1.80, r3= 3.67, r4= 4.17,  &end
#
#   49 GLN  HB2     49 GLN  HG3    3.160   (#SUP   5.08 )
 &rst
  ixpk= 5, nxpk= 0, iat= 802, 806, r1= 1.30, r2= 1.80, r3= 3.16, r4= 3.66,  &end
#
#   49 GLN  HB3     49 GLN  HG2    3.460   (#SUP   4.61 )
 &rst
  ixpk= 4, nxpk= 0, iat= 803, 805, r1= 1.30, r2= 1.80, r3= 3.46, r4= 3.96,  &end
#
#   49 GLN  HB3     49 GLN  HG3    3.350   (#SUP   5.08 )
 &rst
  ixpk= 5, nxpk= 0, iat= 803, 806, r1= 1.30, r2= 1.80, r3= 3.35, r4= 3.85,  &end
#
#   50 HIS  HA      50 HIS  HB2    3.460   (#SUP   3.00 )
 &rst
  ixpk= 3, nxpk= 0, iat= 817, 819, r1= 1.30, r2= 1.80, r3= 3.46, r4= 3.96,  &end
#
#   50 HIS  HA      50 HIS  HB3    3.670   (#SUP   3.00 )
 &rst
  ixpk= 3, nxpk= 0, iat= 817, 820, r1= 1.30, r2= 1.80, r3= 3.67, r4= 4.17,  &end
#
#   50 HIS  HB2     50 HIS  HB3    2.710   (#SUP   3.00 )
 &rst
  ixpk= 3, nxpk= 0, iat= 819, 820, r1= 1.30, r2= 1.80, r3= 2.71, r4= 3.21,  &end
#
#   51 GLN  HA      51 GLN  HB2    3.350   (#SUP   4.20 )
 &rst
  ixpk= 4, nxpk= 0, iat= 834, 836, r1= 1.30, r2= 1.80, r3= 3.35, r4= 3.85,  &end
#
#   51 GLN  HA      51 GLN  HB3    3.440   (#SUP   4.77 )
 &rst
  ixpk= 4, nxpk= 0, iat= 834, 837, r1= 1.30, r2= 1.80, r3= 3.44, r4= 3.94,  &end
#
#   51 GLN  HA      51 GLN  QG     3.410   (#SUP   4.89 )
 &rst
  ixpk= 4, nxpk= 0, iat= 834,  -1, r1= 1.30, r2= 1.80, r3= 3.83, r4= 4.33,
 igr2= 839, 840,
 &end
#
#   51 GLN  HA      54 PHE  HB2    3.600   (#SUP   2.30 )
 &rst
  ixpk= 2, nxpk= 0, iat= 834, 885, r1= 1.30, r2= 1.80, r3= 3.60, r4= 4.10,  &end
#
#   51 GLN  HA      54 PHE  HB3    3.670   (#SUP   2.30 )
 &rst
  ixpk= 2, nxpk= 0, iat= 834, 886, r1= 1.30, r2= 1.80, r3= 3.67, r4= 4.17,  &end
#
#   51 GLN  HB2     51 GLN  HB3    2.520   (#SUP   5.17 )
 &rst
  ixpk= 5, nxpk= 0, iat= 836, 837, r1= 1.30, r2= 1.80, r3= 2.52, r4= 3.02,  &end
#
#   51 GLN  HB2     51 GLN  QG     2.920   (#SUP   5.57 )
 &rst
  ixpk= 5, nxpk= 0, iat= 836,  -1, r1= 1.30, r2= 1.80, r3= 3.28, r4= 3.78,
 igr2= 839, 840,
 &end
#
#   51 GLN  HB3     51 GLN  QG     3.040   (#SUP   5.50 )
 &rst
  ixpk= 5, nxpk= 0, iat= 837,  -1, r1= 1.30, r2= 1.80, r3= 3.41, r4= 3.91,
 igr2= 839, 840,
 &end
#
#   51 GLN  QG      55 ILE  QD1    4.170   (#SUP   2.31 )
 &rst
  ixpk= 2, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.62, r4= 6.12,
 igr1= 839, 840,
 igr2= 914, 915, 916,
 &end
#
#   52 GLU- HA      52 GLU- HB2    3.130   (#SUP   3.97 )
 &rst
  ixpk= 3, nxpk= 0, iat= 851, 853, r1= 1.30, r2= 1.80, r3= 3.13, r4= 3.63,  &end
#
#   52 GLU- HA      52 GLU- HB3    3.150   (#SUP   3.94 )
 &rst
  ixpk= 3, nxpk= 0, iat= 851, 854, r1= 1.30, r2= 1.80, r3= 3.15, r4= 3.65,  &end
#
#   52 GLU- HA      52 GLU- QG     3.490   (#SUP   3.76 )
 &rst
  ixpk= 3, nxpk= 0, iat= 851,  -1, r1= 1.30, r2= 1.80, r3= 3.92, r4= 4.42,
 igr2= 856, 857,
 &end
#
#   52 GLU- HA      55 ILE  HB     3.500   (#SUP   1.25 )
 &rst
  ixpk= 1, nxpk= 0, iat= 851, 905, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   52 GLU- HA      55 ILE  QD1    3.650   (#SUP   2.48 )
 &rst
  ixpk= 2, nxpk= 0, iat= 851,  -1, r1= 1.30, r2= 1.80, r3= 4.38, r4= 4.88,
 igr2= 914, 915, 916,
 &end
#
#   52 GLU- HB2     52 GLU- QG     2.860   (#SUP   3.72 )
 &rst
  ixpk= 3, nxpk= 0, iat= 853,  -1, r1= 1.30, r2= 1.80, r3= 3.21, r4= 3.71,
 igr2= 856, 857,
 &end
#
#   52 GLU- HB3     52 GLU- QG     2.980   (#SUP   3.70 )
 &rst
  ixpk= 3, nxpk= 0, iat= 854,  -1, r1= 1.30, r2= 1.80, r3= 3.34, r4= 3.84,
 igr2= 856, 857,
 &end
#
#   53 HIS  HA      53 HIS  QB     3.290   (#SUP   2.00 )
 &rst
  ixpk= 2, nxpk= 0, iat= 866,  -1, r1= 1.30, r2= 1.80, r3= 3.69, r4= 4.19,
 igr2= 868, 869,
 &end
#
#   53 HIS  HA      56 GLN  QB     3.160   (#SUP   0.75 )
 &rst
  ixpk= 0, nxpk= 0, iat= 866,  -1, r1= 1.30, r2= 1.80, r3= 3.55, r4= 4.05,
 igr2= 924, 925,
 &end
#
#   54 PHE  HA      54 PHE  HB2    3.660   (#SUP   3.00 )
 &rst
  ixpk= 3, nxpk= 0, iat= 883, 885, r1= 1.30, r2= 1.80, r3= 3.66, r4= 4.16,  &end
#
#   54 PHE  HA      54 PHE  HB3    3.440   (#SUP   3.00 )
 &rst
  ixpk= 3, nxpk= 0, iat= 883, 886, r1= 1.30, r2= 1.80, r3= 3.44, r4= 3.94,  &end
#
#   54 PHE  HA      57 MET  HB2    3.810   (#SUP   1.74 )
 &rst
  ixpk= 1, nxpk= 0, iat= 883, 941, r1= 1.30, r2= 1.80, r3= 3.81, r4= 4.31,  &end
#
#   54 PHE  HA      57 MET  HB3    4.630   (#SUP   1.74 )
 &rst
  ixpk= 1, nxpk= 0, iat= 883, 942, r1= 1.30, r2= 1.80, r3= 4.63, r4= 5.13,  &end
#
#   54 PHE  HA      58 LEU  HB2    4.510   (#SUP   1.98 )
 &rst
  ixpk= 1, nxpk= 0, iat= 883, 958, r1= 1.30, r2= 1.80, r3= 4.51, r4= 5.01,  &end
#
#   54 PHE  HB2     54 PHE  HB3    2.740   (#SUP   3.00 )
 &rst
  ixpk= 3, nxpk= 0, iat= 885, 886, r1= 1.30, r2= 1.80, r3= 2.74, r4= 3.24,  &end
#
#   55 ILE  HA      55 ILE  HB     3.570   (#SUP   6.27 )
 &rst
  ixpk= 6, nxpk= 0, iat= 903, 905, r1= 1.30, r2= 1.80, r3= 3.57, r4= 4.07,  &end
#
#   55 ILE  HA      55 ILE  HG12   3.540   (#SUP   6.00 )
 &rst
  ixpk= 6, nxpk= 0, iat= 903, 911, r1= 1.30, r2= 1.80, r3= 3.54, r4= 4.04,  &end
#
#   55 ILE  HA      55 ILE  HG13   3.440   (#SUP   5.31 )
 &rst
  ixpk= 5, nxpk= 0, iat= 903, 912, r1= 1.30, r2= 1.80, r3= 3.44, r4= 3.94,  &end
#
#   55 ILE  HA      55 ILE  QD1    3.590   (#SUP   4.91 )
 &rst
  ixpk= 4, nxpk= 0, iat= 903,  -1, r1= 1.30, r2= 1.80, r3= 4.31, r4= 4.81,
 igr2= 914, 915, 916,
 &end
#
#   55 ILE  HA      55 ILE  QG2    3.110   (#SUP   4.92 )
 &rst
  ixpk= 4, nxpk= 0, iat= 903,  -1, r1= 1.30, r2= 1.80, r3= 3.73, r4= 4.23,
 igr2= 907, 908, 909,
 &end
#
#   55 ILE  HA      58 LEU  HB2    3.750   (#SUP   2.97 )
 &rst
  ixpk= 2, nxpk= 0, iat= 903, 958, r1= 1.30, r2= 1.80, r3= 3.75, r4= 4.25,  &end
#
#   55 ILE  HA      58 LEU  HB3    4.550   (#SUP   2.25 )
 &rst
  ixpk= 2, nxpk= 0, iat= 903, 959, r1= 1.30, r2= 1.80, r3= 4.55, r4= 5.05,  &end
#
#   55 ILE  HA      58 LEU  QD1    3.500   (#SUP   4.64 )
 &rst
  ixpk= 4, nxpk= 0, iat= 903,  -1, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
 igr2= 963, 964, 965,
 &end
#
#   55 ILE  HB      55 ILE  HG12   3.090   (#SUP   6.27 )
 &rst
  ixpk= 6, nxpk= 0, iat= 905, 911, r1= 1.30, r2= 1.80, r3= 3.09, r4= 3.59,  &end
#
#   55 ILE  HB      55 ILE  HG13   3.440   (#SUP   5.59 )
 &rst
  ixpk= 5, nxpk= 0, iat= 905, 912, r1= 1.30, r2= 1.80, r3= 3.44, r4= 3.94,  &end
#
#   55 ILE  HB      55 ILE  QD1    3.430   (#SUP   5.39 )
 &rst
  ixpk= 5, nxpk= 0, iat= 905,  -1, r1= 1.30, r2= 1.80, r3= 4.12, r4= 4.62,
 igr2= 914, 915, 916,
 &end
#
#   55 ILE  HB      55 ILE  QG2    2.880   (#SUP   5.19 )
 &rst
  ixpk= 5, nxpk= 0, iat= 905,  -1, r1= 1.30, r2= 1.80, r3= 3.46, r4= 3.96,
 igr2= 907, 908, 909,
 &end
#
#   55 ILE  HB      58 LEU  QD1    4.330   (#SUP   1.49 )
 &rst
  ixpk= 1, nxpk= 0, iat= 905,  -1, r1= 1.30, r2= 1.80, r3= 5.20, r4= 5.70,
 igr2= 963, 964, 965,
 &end
#
#   55 ILE  HG12    55 ILE  HG13   2.620   (#SUP   5.31 )
 &rst
  ixpk= 5, nxpk= 0, iat= 911, 912, r1= 1.30, r2= 1.80, r3= 2.62, r4= 3.12,  &end
#
#   55 ILE  HG12    55 ILE  QD1    3.040   (#SUP   4.79 )
 &rst
  ixpk= 4, nxpk= 0, iat= 911,  -1, r1= 1.30, r2= 1.80, r3= 3.65, r4= 4.15,
 igr2= 914, 915, 916,
 &end
#
#   55 ILE  HG12    55 ILE  QG2    3.510   (#SUP   5.04 )
 &rst
  ixpk= 5, nxpk= 0, iat= 911,  -1, r1= 1.30, r2= 1.80, r3= 4.22, r4= 4.72,
 igr2= 907, 908, 909,
 &end
#
#   55 ILE  HG13    55 ILE  QD1    3.000   (#SUP   4.53 )
 &rst
  ixpk= 4, nxpk= 0, iat= 912,  -1, r1= 1.30, r2= 1.80, r3= 3.60, r4= 4.10,
 igr2= 914, 915, 916,
 &end
#
#   55 ILE  HG13    55 ILE  QG2    3.390   (#SUP   4.34 )
 &rst
  ixpk= 4, nxpk= 0, iat= 912,  -1, r1= 1.30, r2= 1.80, r3= 4.07, r4= 4.57,
 igr2= 907, 908, 909,
 &end
#
#   55 ILE  QD1     58 LEU  QD1    4.340   (#SUP   1.44 )
 &rst
  ixpk= 1, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.26, r4= 6.76,
 igr1= 914, 915, 916,
 igr2= 963, 964, 965,
 &end
#
#   55 ILE  QG2     56 GLN  HA     3.560   (#SUP   3.71 )
 &rst
  ixpk= 3, nxpk= 0, iat=  -1, 922, r1= 1.30, r2= 1.80, r3= 4.28, r4= 4.78,
 igr1= 907, 908, 909,
 &end
#
#   56 GLN  HA      56 GLN  HG2    3.720   (#SUP   3.34 )
 &rst
  ixpk= 3, nxpk= 0, iat= 922, 927, r1= 1.30, r2= 1.80, r3= 3.72, r4= 4.22,  &end
#
#   56 GLN  HA      56 GLN  HG3    3.900   (#SUP   3.34 )
 &rst
  ixpk= 3, nxpk= 0, iat= 922, 928, r1= 1.30, r2= 1.80, r3= 3.90, r4= 4.40,  &end
#
#   56 GLN  HA      56 GLN  QB     3.030   (#SUP   3.35 )
 &rst
  ixpk= 3, nxpk= 0, iat= 922,  -1, r1= 1.30, r2= 1.80, r3= 3.40, r4= 3.90,
 igr2= 924, 925,
 &end
#
#   56 GLN  HA      59 ASN  HB3    3.930   (#SUP   0.75 )
 &rst
  ixpk= 0, nxpk= 0, iat= 922, 978, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,  &end
#
#   57 MET  HA      57 MET  HB2    3.860   (#SUP   4.85 )
 &rst
  ixpk= 4, nxpk= 0, iat= 939, 941, r1= 1.30, r2= 1.80, r3= 3.86, r4= 4.36,  &end
#
#   57 MET  HA      57 MET  HB3    3.380   (#SUP   4.90 )
 &rst
  ixpk= 4, nxpk= 0, iat= 939, 942, r1= 1.30, r2= 1.80, r3= 3.38, r4= 3.88,  &end
#
#   57 MET  HA      57 MET  HG2    3.380   (#SUP   3.93 )
 &rst
  ixpk= 3, nxpk= 0, iat= 939, 944, r1= 1.30, r2= 1.80, r3= 3.38, r4= 3.88,  &end
#
#   57 MET  HA      57 MET  HG3    3.600   (#SUP   4.57 )
 &rst
  ixpk= 4, nxpk= 0, iat= 939, 945, r1= 1.30, r2= 1.80, r3= 3.60, r4= 4.10,  &end
#
#   57 MET  HA      60 GLU- HG2    4.200   (#SUP   1.50 )
 &rst
  ixpk= 1, nxpk= 0, iat= 939, 994, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,  &end
#
#   57 MET  HA      60 GLU- HG3    4.660   (#SUP   1.50 )
 &rst
  ixpk= 1, nxpk= 0, iat= 939, 995, r1= 1.30, r2= 1.80, r3= 4.66, r4= 5.16,  &end
#
#   57 MET  HB2     57 MET  HB3    2.730   (#SUP   2.96 )
 &rst
  ixpk= 2, nxpk= 0, iat= 941, 942, r1= 1.30, r2= 1.80, r3= 2.73, r4= 3.23,  &end
#
#   58 LEU  HA      58 LEU  HB2    3.710   (#SUP   6.31 )
 &rst
  ixpk= 6, nxpk= 0, iat= 956, 958, r1= 1.30, r2= 1.80, r3= 3.71, r4= 4.21,  &end
#
#   58 LEU  HA      58 LEU  HB3    3.540   (#SUP   5.98 )
 &rst
  ixpk= 5, nxpk= 0, iat= 956, 959, r1= 1.30, r2= 1.80, r3= 3.54, r4= 4.04,  &end
#
#   58 LEU  HA      58 LEU  HG     3.640   (#SUP   5.27 )
 &rst
  ixpk= 5, nxpk= 0, iat= 956, 961, r1= 1.30, r2= 1.80, r3= 3.64, r4= 4.14,  &end
#
#   58 LEU  HA      58 LEU  QD1    4.320   (#SUP   5.37 )
 &rst
  ixpk= 5, nxpk= 0, iat= 956,  -1, r1= 1.30, r2= 1.80, r3= 5.19, r4= 5.69,
 igr2= 963, 964, 965,
 &end
#
#   58 LEU  HA      58 LEU  QD2    3.200   (#SUP   5.41 )
 &rst
  ixpk= 5, nxpk= 0, iat= 956,  -1, r1= 1.30, r2= 1.80, r3= 3.84, r4= 4.34,
 igr2= 967, 968, 969,
 &end
#
#   58 LEU  HB2     58 LEU  HB3    2.730   (#SUP   6.28 )
 &rst
  ixpk= 6, nxpk= 0, iat= 958, 959, r1= 1.30, r2= 1.80, r3= 2.73, r4= 3.23,  &end
#
#   58 LEU  HB2     58 LEU  HG     3.370   (#SUP   5.57 )
 &rst
  ixpk= 5, nxpk= 0, iat= 958, 961, r1= 1.30, r2= 1.80, r3= 3.37, r4= 3.87,  &end
#
#   58 LEU  HB2     58 LEU  QD1    3.190   (#SUP   5.67 )
 &rst
  ixpk= 5, nxpk= 0, iat= 958,  -1, r1= 1.30, r2= 1.80, r3= 3.83, r4= 4.33,
 igr2= 963, 964, 965,
 &end
#
#   58 LEU  HB2     58 LEU  QD2    4.080   (#SUP   5.71 )
 &rst
  ixpk= 5, nxpk= 0, iat= 958,  -1, r1= 1.30, r2= 1.80, r3= 4.90, r4= 5.40,
 igr2= 967, 968, 969,
 &end
#
#   58 LEU  HB3     58 LEU  QD2    3.460   (#SUP   4.40 )
 &rst
  ixpk= 4, nxpk= 0, iat= 959,  -1, r1= 1.30, r2= 1.80, r3= 4.16, r4= 4.66,
 igr2= 967, 968, 969,
 &end
#
#   58 LEU  HG      58 LEU  QD1    2.620   (#SUP   4.90 )
 &rst
  ixpk= 4, nxpk= 0, iat= 961,  -1, r1= 1.30, r2= 1.80, r3= 3.15, r4= 3.65,
 igr2= 963, 964, 965,
 &end
#
#   58 LEU  HG      58 LEU  QD2    3.360   (#SUP   4.96 )
 &rst
  ixpk= 4, nxpk= 0, iat= 961,  -1, r1= 1.30, r2= 1.80, r3= 4.04, r4= 4.54,
 igr2= 967, 968, 969,
 &end
#
#   59 ASN  HA      59 ASN  HB2    3.290   (#SUP   3.62 )
 &rst
  ixpk= 3, nxpk= 0, iat= 975, 977, r1= 1.30, r2= 1.80, r3= 3.29, r4= 3.79,  &end
#
#   59 ASN  HA      59 ASN  HB3    3.410   (#SUP   3.31 )
 &rst
  ixpk= 3, nxpk= 0, iat= 975, 978, r1= 1.30, r2= 1.80, r3= 3.41, r4= 3.91,  &end
#
#   59 ASN  HB2     59 ASN  HB3    2.450   (#SUP   4.97 )
 &rst
  ixpk= 4, nxpk= 0, iat= 977, 978, r1= 1.30, r2= 1.80, r3= 2.45, r4= 2.95,  &end
#
#   60 GLU- HA      60 GLU- HG2    4.160   (#SUP   4.44 )
 &rst
  ixpk= 4, nxpk= 0, iat= 989, 994, r1= 1.30, r2= 1.80, r3= 4.16, r4= 4.66,  &end
#
#   60 GLU- HA      60 GLU- HG3    3.540   (#SUP   3.87 )
 &rst
  ixpk= 3, nxpk= 0, iat= 989, 995, r1= 1.30, r2= 1.80, r3= 3.54, r4= 4.04,  &end
#
#   60 GLU- HA      60 GLU- QB     3.320   (#SUP   4.75 )
 &rst
  ixpk= 4, nxpk= 0, iat= 989,  -1, r1= 1.30, r2= 1.80, r3= 3.73, r4= 4.23,
 igr2= 991, 992,
 &end
#
#   60 GLU- HA      61 PRO  HD2    3.120   (#SUP   4.39 )
 &rst
  ixpk= 4, nxpk= 0, iat= 989,1003, r1= 1.30, r2= 1.80, r3= 3.12, r4= 3.62,  &end
#
#   60 GLU- HA      61 PRO  HD3    3.230   (#SUP   5.49 )
 &rst
  ixpk= 5, nxpk= 0, iat= 989,1004, r1= 1.30, r2= 1.80, r3= 3.23, r4= 3.73,  &end
#
#   60 GLU- HG2     60 GLU- HG3    2.460   (#SUP   3.31 )
 &rst
  ixpk= 3, nxpk= 0, iat= 994, 995, r1= 1.30, r2= 1.80, r3= 2.46, r4= 2.96,  &end
#
#   60 GLU- HG2     60 GLU- QB     3.300   (#SUP   4.30 )
 &rst
  ixpk= 4, nxpk= 0, iat= 994,  -1, r1= 1.30, r2= 1.80, r3= 3.70, r4= 4.20,
 igr2= 991, 992,
 &end
#
#   60 GLU- HG2     61 PRO  HD3    5.350   (#SUP   5.05 )
 &rst
  ixpk= 5, nxpk= 0, iat= 994,1004, r1= 1.30, r2= 1.80, r3= 5.35, r4= 5.85,  &end
#
#   60 GLU- HG3     60 GLU- QB     3.160   (#SUP   3.61 )
 &rst
  ixpk= 3, nxpk= 0, iat= 995,  -1, r1= 1.30, r2= 1.80, r3= 3.55, r4= 4.05,
 igr2= 991, 992,
 &end
#
#   60 GLU- QB      61 PRO  HD3    3.550   (#SUP   4.91 )
 &rst
  ixpk= 4, nxpk= 0, iat=  -1,1004, r1= 1.30, r2= 1.80, r3= 3.98, r4= 4.48,
 igr1= 991, 992,
 &end
#
#   61 PRO  HA      61 PRO  HB2    3.340   (#SUP   5.25 )
 &rst
  ixpk= 5, nxpk= 0, iat=1012,1009, r1= 1.30, r2= 1.80, r3= 3.34, r4= 3.84,  &end
#
#   61 PRO  HA      61 PRO  HB3    3.610   (#SUP   5.25 )
 &rst
  ixpk= 5, nxpk= 0, iat=1012,1010, r1= 1.30, r2= 1.80, r3= 3.61, r4= 4.11,  &end
#
#   61 PRO  HA      61 PRO  QG     3.450   (#SUP   4.58 )
 &rst
  ixpk= 4, nxpk= 0, iat=1012,  -1, r1= 1.30, r2= 1.80, r3= 3.87, r4= 4.37,
 igr2=1006,1007,
 &end
#
#   61 PRO  HA      62 VAL  QG1    4.610   (#SUP   2.93 )
 &rst
  ixpk= 2, nxpk= 0, iat=1012,  -1, r1= 1.30, r2= 1.80, r3= 5.54, r4= 6.04,
 igr2=1022,1023,1024,
 &end
#
#   61 PRO  HB2     61 PRO  HB3    2.540   (#SUP   5.00 )
 &rst
  ixpk= 5, nxpk= 0, iat=1009,1010, r1= 1.30, r2= 1.80, r3= 2.54, r4= 3.04,  &end
#
#   61 PRO  HB2     61 PRO  HD2    4.040   (#SUP   5.07 )
 &rst
  ixpk= 5, nxpk= 0, iat=1009,1003, r1= 1.30, r2= 1.80, r3= 4.04, r4= 4.54,  &end
#
#   61 PRO  HB2     61 PRO  HD3    3.940   (#SUP   5.71 )
 &rst
  ixpk= 5, nxpk= 0, iat=1009,1004, r1= 1.30, r2= 1.80, r3= 3.94, r4= 4.44,  &end
#
#   61 PRO  HB2     61 PRO  QG     2.620   (#SUP   4.31 )
 &rst
  ixpk= 4, nxpk= 0, iat=1009,  -1, r1= 1.30, r2= 1.80, r3= 2.94, r4= 3.44,
 igr2=1006,1007,
 &end
#
#   61 PRO  HB3     61 PRO  HD2    4.490   (#SUP   5.07 )
 &rst
  ixpk= 5, nxpk= 0, iat=1010,1003, r1= 1.30, r2= 1.80, r3= 4.49, r4= 4.99,  &end
#
#   61 PRO  HB3     61 PRO  HD3    3.800   (#SUP   5.71 )
 &rst
  ixpk= 5, nxpk= 0, iat=1010,1004, r1= 1.30, r2= 1.80, r3= 3.80, r4= 4.30,  &end
#
#   61 PRO  HB3     61 PRO  QG     2.750   (#SUP   4.31 )
 &rst
  ixpk= 4, nxpk= 0, iat=1010,  -1, r1= 1.30, r2= 1.80, r3= 3.09, r4= 3.59,
 igr2=1006,1007,
 &end
#
#   61 PRO  HD2     61 PRO  HD3    2.640   (#SUP   5.62 )
 &rst
  ixpk= 5, nxpk= 0, iat=1003,1004, r1= 1.30, r2= 1.80, r3= 2.64, r4= 3.14,  &end
#
#   61 PRO  HD2     61 PRO  QG     3.020   (#SUP   4.76 )
 &rst
  ixpk= 4, nxpk= 0, iat=1003,  -1, r1= 1.30, r2= 1.80, r3= 3.39, r4= 3.89,
 igr2=1006,1007,
 &end
#
#   61 PRO  HD3     61 PRO  QG     2.950   (#SUP   5.39 )
 &rst
  ixpk= 5, nxpk= 0, iat=1004,  -1, r1= 1.30, r2= 1.80, r3= 3.31, r4= 3.81,
 igr2=1006,1007,
 &end
#
#   62 VAL  HA      62 VAL  HB     3.620   (#SUP   3.75 )
 &rst
  ixpk= 3, nxpk= 0, iat=1018,1020, r1= 1.30, r2= 1.80, r3= 3.62, r4= 4.12,  &end
#
#   62 VAL  HA      62 VAL  QG1    3.730   (#SUP   3.54 )
 &rst
  ixpk= 3, nxpk= 0, iat=1018,  -1, r1= 1.30, r2= 1.80, r3= 4.48, r4= 4.98,
 igr2=1022,1023,1024,
 &end
#
#   62 VAL  HA      62 VAL  QG2    3.480   (#SUP   3.47 )
 &rst
  ixpk= 3, nxpk= 0, iat=1018,  -1, r1= 1.30, r2= 1.80, r3= 4.18, r4= 4.68,
 igr2=1026,1027,1028,
 &end
#
#   62 VAL  HB      62 VAL  QG1    3.000   (#SUP   3.47 )
 &rst
  ixpk= 3, nxpk= 0, iat=1020,  -1, r1= 1.30, r2= 1.80, r3= 3.60, r4= 4.10,
 igr2=1022,1023,1024,
 &end
#
#   62 VAL  HB      62 VAL  QG2    3.220   (#SUP   3.22 )
 &rst
  ixpk= 3, nxpk= 0, iat=1020,  -1, r1= 1.30, r2= 1.80, r3= 3.87, r4= 4.37,
 igr2=1026,1027,1028,
 &end
#
#   62 VAL  QG2     63 GLN  HG3    5.390   (#SUP   2.84 )
 &rst
  ixpk= 2, nxpk= 0, iat=  -1,1040, r1= 1.30, r2= 1.80, r3= 6.47, r4= 6.97,
 igr1=1026,1027,1028,
 &end
#
#   63 GLN  HA      63 GLN  HB2    3.560   (#SUP   3.08 )
 &rst
  ixpk= 3, nxpk= 0, iat=1034,1036, r1= 1.30, r2= 1.80, r3= 3.56, r4= 4.06,  &end
#
#   63 GLN  HA      63 GLN  HB3    4.090   (#SUP   3.25 )
 &rst
  ixpk= 3, nxpk= 0, iat=1034,1037, r1= 1.30, r2= 1.80, r3= 4.09, r4= 4.59,  &end
#
#   63 GLN  HA      63 GLN  HG3    4.100   (#SUP   3.52 )
 &rst
  ixpk= 3, nxpk= 0, iat=1034,1040, r1= 1.30, r2= 1.80, r3= 4.10, r4= 4.60,  &end
#
#   63 GLN  HB2     63 GLN  HG3    2.800   (#SUP   2.98 )
 &rst
  ixpk= 2, nxpk= 0, iat=1036,1040, r1= 1.30, r2= 1.80, r3= 2.80, r4= 3.30,  &end
#
#   63 GLN  HB3     63 GLN  HG3    3.170   (#SUP   3.14 )
 &rst
  ixpk= 3, nxpk= 0, iat=1037,1040, r1= 1.30, r2= 1.80, r3= 3.17, r4= 3.67,  &end
#
#   64 GLU- HA      64 GLU- HB2    3.720   (#SUP   3.51 )
 &rst
  ixpk= 3, nxpk= 0, iat=1051,1053, r1= 1.30, r2= 1.80, r3= 3.72, r4= 4.22,  &end
#
#   64 GLU- HA      64 GLU- HB3    3.780   (#SUP   3.31 )
 &rst
  ixpk= 3, nxpk= 0, iat=1051,1054, r1= 1.30, r2= 1.80, r3= 3.78, r4= 4.28,  &end
#
#   64 GLU- HA      64 GLU- QG     4.400   (#SUP   2.61 )
 &rst
  ixpk= 2, nxpk= 0, iat=1051,  -1, r1= 1.30, r2= 1.80, r3= 4.94, r4= 5.44,
 igr2=1056,1057,
 &end
#
#   64 GLU- HB2     64 GLU- HB3    2.400   (#SUP   3.19 )
 &rst
  ixpk= 3, nxpk= 0, iat=1053,1054, r1= 1.30, r2= 1.80, r3= 2.40, r4= 2.90,  &end
#
#   64 GLU- HB2     64 GLU- QG     2.550   (#SUP   2.50 )
 &rst
  ixpk= 2, nxpk= 0, iat=1053,  -1, r1= 1.30, r2= 1.80, r3= 2.86, r4= 3.36,
 igr2=1056,1057,
 &end
#
#   64 GLU- HB3     64 GLU- QG     2.900   (#SUP   2.31 )
 &rst
  ixpk= 2, nxpk= 0, iat=1054,  -1, r1= 1.30, r2= 1.80, r3= 3.26, r4= 3.76,
 igr2=1056,1057,
 &end
#
#   65 ALA  HA      65 ALA  QB     3.690   (#SUP   1.00 )
 &rst
  ixpk= 1, nxpk= 0, iat=1066,  -1, r1= 1.30, r2= 1.80, r3= 4.43, r4= 4.93,
 igr2=1068,1069,1070,
 &end
#
#    5 PRO  HA       6 LEU  HN     4.180   (#SUP   4.38 )
 &rst
  ixpk= 4, nxpk= 0, iat=  66,  70, r1= 1.30, r2= 1.80, r3= 4.18, r4= 4.68,  &end
#
#    6 LEU  HA       6 LEU  HN     4.560   (#SUP   5.02 )
 &rst
  ixpk= 5, nxpk= 0, iat=  72,  70, r1= 1.30, r2= 1.80, r3= 4.56, r4= 5.06,  &end
#
#    6 LEU  HA       7 GLU- HN     5.500   (#SUP   3.66 )
 &rst
  ixpk= 3, nxpk= 0, iat=  72,  89, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#    6 LEU  HB2      6 LEU  HN     4.720   (#SUP   4.78 )
 &rst
  ixpk= 4, nxpk= 0, iat=  74,  70, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,  &end
#
#    6 LEU  HB3      6 LEU  HN     4.260   (#SUP   4.29 )
 &rst
  ixpk= 4, nxpk= 0, iat=  75,  70, r1= 1.30, r2= 1.80, r3= 4.26, r4= 4.76,  &end
#
#    6 LEU  HN       6 LEU  QD2    4.700   (#SUP   5.11 )
 &rst
  ixpk= 5, nxpk= 0, iat=  70,  -1, r1= 1.30, r2= 1.80, r3= 5.64, r4= 6.14,
 igr2=  83,  84,  85,
 &end
#
#    6 LEU  HN       7 GLU- HN     4.620   (#SUP   3.44 )
 &rst
  ixpk= 3, nxpk= 0, iat=  70,  89, r1= 1.30, r2= 1.80, r3= 4.62, r4= 5.12,  &end
#
#    6 LEU  QD1     50 HIS  HN     5.150   (#SUP   1.50 )
 &rst
  ixpk= 1, nxpk= 0, iat=  -1, 815, r1= 1.30, r2= 1.80, r3= 6.18, r4= 6.68,
 igr1=  79,  80,  81,
 &end
#
#    6 LEU  QD1     54 PHE  HN     4.830   (#SUP   3.00 )
 &rst
  ixpk= 3, nxpk= 0, iat=  -1, 881, r1= 1.30, r2= 1.80, r3= 5.80, r4= 6.30,
 igr1=  79,  80,  81,
 &end
#
#    6 LEU  QD2     46 GLN  HN     5.500   (#SUP   3.46 )
 &rst
  ixpk= 3, nxpk= 0, iat=  -1, 751, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr1=  83,  84,  85,
 &end
#
#    6 LEU  QD2     47 ILE  HN     5.030   (#SUP   4.34 )
 &rst
  ixpk= 4, nxpk= 0, iat=  -1, 768, r1= 1.30, r2= 1.80, r3= 6.04, r4= 6.54,
 igr1=  83,  84,  85,
 &end
#
#    7 GLU- HA       7 GLU- HN     4.370   (#SUP   4.75 )
 &rst
  ixpk= 4, nxpk= 0, iat=  91,  89, r1= 1.30, r2= 1.80, r3= 4.37, r4= 4.87,  &end
#
#    7 GLU- HA       8 PHE  HN     5.420   (#SUP   4.82 )
 &rst
  ixpk= 4, nxpk= 0, iat=  91, 104, r1= 1.30, r2= 1.80, r3= 5.42, r4= 5.92,  &end
#
#    7 GLU- HA       9 LEU  HN     4.930   (#SUP   4.25 )
 &rst
  ixpk= 4, nxpk= 0, iat=  91, 124, r1= 1.30, r2= 1.80, r3= 4.93, r4= 5.43,  &end
#
#    7 GLU- HA      10 ARG+ HN     5.040   (#SUP   1.50 )
 &rst
  ixpk= 1, nxpk= 0, iat=  91, 143, r1= 1.30, r2= 1.80, r3= 5.04, r4= 5.54,  &end
#
#    7 GLU- HB2      7 GLU- HN     4.150   (#SUP   3.94 )
 &rst
  ixpk= 3, nxpk= 0, iat=  93,  89, r1= 1.30, r2= 1.80, r3= 4.15, r4= 4.65,  &end
#
#    7 GLU- HB3      7 GLU- HN     4.220   (#SUP   4.68 )
 &rst
  ixpk= 4, nxpk= 0, iat=  94,  89, r1= 1.30, r2= 1.80, r3= 4.22, r4= 4.72,  &end
#
#    7 GLU- HB3      8 PHE  HN     4.930   (#SUP   3.39 )
 &rst
  ixpk= 3, nxpk= 0, iat=  94, 104, r1= 1.30, r2= 1.80, r3= 4.93, r4= 5.43,  &end
#
#    7 GLU- HN       7 GLU- QG     4.160   (#SUP   4.04 )
 &rst
  ixpk= 4, nxpk= 0, iat=  89,  -1, r1= 1.30, r2= 1.80, r3= 4.67, r4= 5.17,
 igr2=  96,  97,
 &end
#
#    7 GLU- HN       8 PHE  HN     4.130   (#SUP   3.58 )
 &rst
  ixpk= 3, nxpk= 0, iat=  89, 104, r1= 1.30, r2= 1.80, r3= 4.13, r4= 4.63,  &end
#
#    8 PHE  HA       8 PHE  HN     4.330   (#SUP   3.92 )
 &rst
  ixpk= 3, nxpk= 0, iat= 106, 104, r1= 1.30, r2= 1.80, r3= 4.33, r4= 4.83,  &end
#
#    8 PHE  HA       9 LEU  HN     5.230   (#SUP   5.09 )
 &rst
  ixpk= 5, nxpk= 0, iat= 106, 124, r1= 1.30, r2= 1.80, r3= 5.23, r4= 5.73,  &end
#
#    8 PHE  HB2      8 PHE  HN     4.280   (#SUP   3.92 )
 &rst
  ixpk= 3, nxpk= 0, iat= 108, 104, r1= 1.30, r2= 1.80, r3= 4.28, r4= 4.78,  &end
#
#    8 PHE  HB2      9 LEU  HN     5.360   (#SUP   5.09 )
 &rst
  ixpk= 5, nxpk= 0, iat= 108, 124, r1= 1.30, r2= 1.80, r3= 5.36, r4= 5.86,  &end
#
#    8 PHE  HB3      8 PHE  HN     4.140   (#SUP   3.92 )
 &rst
  ixpk= 3, nxpk= 0, iat= 109, 104, r1= 1.30, r2= 1.80, r3= 4.14, r4= 4.64,  &end
#
#    8 PHE  HB3      9 LEU  HN     4.990   (#SUP   5.09 )
 &rst
  ixpk= 5, nxpk= 0, iat= 109, 124, r1= 1.30, r2= 1.80, r3= 4.99, r4= 5.49,  &end
#
#    8 PHE  HN       9 LEU  HN     4.430   (#SUP   5.71 )
 &rst
  ixpk= 5, nxpk= 0, iat= 104, 124, r1= 1.30, r2= 1.80, r3= 4.43, r4= 4.93,  &end
#
#    9 LEU  HA       9 LEU  HN     4.060   (#SUP   7.93 )
 &rst
  ixpk= 7, nxpk= 0, iat= 126, 124, r1= 1.30, r2= 1.80, r3= 4.06, r4= 4.56,  &end
#
#    9 LEU  HA      10 ARG+ HN     4.640   (#SUP   5.16 )
 &rst
  ixpk= 5, nxpk= 0, iat= 126, 143, r1= 1.30, r2= 1.80, r3= 4.64, r4= 5.14,  &end
#
#    9 LEU  HA      12 GLN  HN     5.140   (#SUP   2.97 )
 &rst
  ixpk= 2, nxpk= 0, iat= 126, 181, r1= 1.30, r2= 1.80, r3= 5.14, r4= 5.64,  &end
#
#    9 LEU  HB2      9 LEU  HN     3.880   (#SUP   7.56 )
 &rst
  ixpk= 7, nxpk= 0, iat= 128, 124, r1= 1.30, r2= 1.80, r3= 3.88, r4= 4.38,  &end
#
#    9 LEU  HB2     10 ARG+ HN     4.890   (#SUP   4.18 )
 &rst
  ixpk= 4, nxpk= 0, iat= 128, 143, r1= 1.30, r2= 1.80, r3= 4.89, r4= 5.39,  &end
#
#    9 LEU  HB3      9 LEU  HN     4.410   (#SUP   7.32 )
 &rst
  ixpk= 7, nxpk= 0, iat= 129, 124, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,  &end
#
#    9 LEU  HB3     10 ARG+ HN     5.080   (#SUP   3.82 )
 &rst
  ixpk= 3, nxpk= 0, iat= 129, 143, r1= 1.30, r2= 1.80, r3= 5.08, r4= 5.58,  &end
#
#    9 LEU  HG       9 LEU  HN     3.940   (#SUP   6.51 )
 &rst
  ixpk= 6, nxpk= 0, iat= 131, 124, r1= 1.30, r2= 1.80, r3= 3.94, r4= 4.44,  &end
#
#    9 LEU  HN       9 LEU  QD1    4.700   (#SUP   6.85 )
 &rst
  ixpk= 6, nxpk= 0, iat= 124,  -1, r1= 1.30, r2= 1.80, r3= 5.64, r4= 6.14,
 igr2= 133, 134, 135,
 &end
#
#    9 LEU  HN       9 LEU  QD2    4.610   (#SUP   7.21 )
 &rst
  ixpk= 7, nxpk= 0, iat= 124,  -1, r1= 1.30, r2= 1.80, r3= 5.54, r4= 6.04,
 igr2= 137, 138, 139,
 &end
#
#    9 LEU  HN      10 ARG+ HN     3.970   (#SUP   6.16 )
 &rst
  ixpk= 6, nxpk= 0, iat= 124, 143, r1= 1.30, r2= 1.80, r3= 3.97, r4= 4.47,  &end
#
#    9 LEU  HN      10 ARG+ QB     4.580   (#SUP   5.73 )
 &rst
  ixpk= 5, nxpk= 0, iat= 124,  -1, r1= 1.30, r2= 1.80, r3= 5.14, r4= 5.64,
 igr2= 147, 148,
 &end
#
#    9 LEU  HN      10 ARG+ QG     5.500   (#SUP   5.23 )
 &rst
  ixpk= 5, nxpk= 0, iat= 124,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2= 150, 151,
 &end
#
#   10 ARG+ HA      10 ARG+ HN     4.120   (#SUP   4.34 )
 &rst
  ixpk= 4, nxpk= 0, iat= 145, 143, r1= 1.30, r2= 1.80, r3= 4.12, r4= 4.62,  &end
#
#   10 ARG+ HA      11 ASN  HN     4.600   (#SUP   4.63 )
 &rst
  ixpk= 4, nxpk= 0, iat= 145, 167, r1= 1.30, r2= 1.80, r3= 4.60, r4= 5.10,  &end
#
#   10 ARG+ HA      12 GLN  HN     5.500   (#SUP   1.60 )
 &rst
  ixpk= 1, nxpk= 0, iat= 145, 181, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   10 ARG+ HN      10 ARG+ QB     3.450   (#SUP   6.10 )
 &rst
  ixpk= 6, nxpk= 0, iat= 143,  -1, r1= 1.30, r2= 1.80, r3= 3.87, r4= 4.37,
 igr2= 147, 148,
 &end
#
#   10 ARG+ HN      10 ARG+ QG     3.970   (#SUP   5.84 )
 &rst
  ixpk= 5, nxpk= 0, iat= 143,  -1, r1= 1.30, r2= 1.80, r3= 4.46, r4= 4.96,
 igr2= 150, 151,
 &end
#
#   10 ARG+ HN      11 ASN  HN     4.170   (#SUP   3.62 )
 &rst
  ixpk= 3, nxpk= 0, iat= 143, 167, r1= 1.30, r2= 1.80, r3= 4.17, r4= 4.67,  &end
#
#   10 ARG+ QB      11 ASN  HN     4.190   (#SUP   4.52 )
 &rst
  ixpk= 4, nxpk= 0, iat=  -1, 167, r1= 1.30, r2= 1.80, r3= 4.70, r4= 5.20,
 igr1= 147, 148,
 &end
#
#   10 ARG+ QG      11 ASN  HN     5.110   (#SUP   4.52 )
 &rst
  ixpk= 4, nxpk= 0, iat=  -1, 167, r1= 1.30, r2= 1.80, r3= 5.74, r4= 6.24,
 igr1= 150, 151,
 &end
#
#   11 ASN  HB2     11 ASN  HD21   4.810   (#SUP   2.63 )
 &rst
  ixpk= 2, nxpk= 0, iat= 171, 176, r1= 1.30, r2= 1.80, r3= 4.81, r4= 5.31,  &end
#
#   11 ASN  HB2     11 ASN  HN     4.340   (#SUP   3.67 )
 &rst
  ixpk= 3, nxpk= 0, iat= 171, 167, r1= 1.30, r2= 1.80, r3= 4.34, r4= 4.84,  &end
#
#   11 ASN  HB2     12 GLN  HN     5.370   (#SUP   3.32 )
 &rst
  ixpk= 3, nxpk= 0, iat= 171, 181, r1= 1.30, r2= 1.80, r3= 5.37, r4= 5.87,  &end
#
#   11 ASN  HB3     11 ASN  HD21   4.560   (#SUP   2.31 )
 &rst
  ixpk= 2, nxpk= 0, iat= 172, 176, r1= 1.30, r2= 1.80, r3= 4.56, r4= 5.06,  &end
#
#   11 ASN  HB3     11 ASN  HD22   4.590   (#SUP   2.21 )
 &rst
  ixpk= 2, nxpk= 0, iat= 172, 177, r1= 1.30, r2= 1.80, r3= 4.59, r4= 5.09,  &end
#
#   11 ASN  HB3     11 ASN  HN     3.980   (#SUP   3.42 )
 &rst
  ixpk= 3, nxpk= 0, iat= 172, 167, r1= 1.30, r2= 1.80, r3= 3.98, r4= 4.48,  &end
#
#   11 ASN  HD21    11 ASN  HD22   3.070   (#SUP   1.93 )
 &rst
  ixpk= 1, nxpk= 0, iat= 176, 177, r1= 1.30, r2= 1.80, r3= 3.07, r4= 3.57,  &end
#
#   11 ASN  HN      12 GLN  HN     4.050   (#SUP   3.44 )
 &rst
  ixpk= 3, nxpk= 0, iat= 167, 181, r1= 1.30, r2= 1.80, r3= 4.05, r4= 4.55,  &end
#
#   12 GLN  HA      12 GLN  HN     3.720   (#SUP   4.32 )
 &rst
  ixpk= 4, nxpk= 0, iat= 183, 181, r1= 1.30, r2= 1.80, r3= 3.72, r4= 4.22,  &end
#
#   12 GLN  HG2     12 GLN  HN     4.510   (#SUP   4.21 )
 &rst
  ixpk= 4, nxpk= 0, iat= 188, 181, r1= 1.30, r2= 1.80, r3= 4.51, r4= 5.01,  &end
#
#   12 GLN  HG3     12 GLN  HN     3.790   (#SUP   3.99 )
 &rst
  ixpk= 3, nxpk= 0, iat= 189, 181, r1= 1.30, r2= 1.80, r3= 3.79, r4= 4.29,  &end
#
#   12 GLN  HN      12 GLN  QB     3.780   (#SUP   3.99 )
 &rst
  ixpk= 3, nxpk= 0, iat= 181,  -1, r1= 1.30, r2= 1.80, r3= 4.24, r4= 4.74,
 igr2= 185, 186,
 &end
#
#   12 GLN  HN      13 PRO  HD2    5.330   (#SUP   4.45 )
 &rst
  ixpk= 4, nxpk= 0, iat= 181, 199, r1= 1.30, r2= 1.80, r3= 5.33, r4= 5.83,  &end
#
#   12 GLN  HN      13 PRO  HD3    5.500   (#SUP   4.26 )
 &rst
  ixpk= 4, nxpk= 0, iat= 181, 200, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   14 GLN  HN      14 GLN  QB     4.760   (#SUP   2.95 )
 &rst
  ixpk= 2, nxpk= 0, iat= 212,  -1, r1= 1.30, r2= 1.80, r3= 5.34, r4= 5.84,
 igr2= 216, 217,
 &end
#
#   14 GLN  HN      14 GLN  QG     5.500   (#SUP   2.67 )
 &rst
  ixpk= 2, nxpk= 0, iat= 212,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2= 219, 220,
 &end
#
#   14 GLN  HN      15 PHE  HN     4.550   (#SUP   3.30 )
 &rst
  ixpk= 3, nxpk= 0, iat= 212, 229, r1= 1.30, r2= 1.80, r3= 4.55, r4= 5.05,  &end
#
#   14 GLN  QB      15 PHE  HN     4.060   (#SUP   4.19 )
 &rst
  ixpk= 4, nxpk= 0, iat=  -1, 229, r1= 1.30, r2= 1.80, r3= 4.56, r4= 5.06,
 igr1= 216, 217,
 &end
#
#   14 GLN  QG      15 PHE  HN     5.110   (#SUP   4.18 )
 &rst
  ixpk= 4, nxpk= 0, iat=  -1, 229, r1= 1.30, r2= 1.80, r3= 5.74, r4= 6.24,
 igr1= 219, 220,
 &end
#
#   15 PHE  HA      15 PHE  HN     3.820   (#SUP   4.28 )
 &rst
  ixpk= 4, nxpk= 0, iat= 231, 229, r1= 1.30, r2= 1.80, r3= 3.82, r4= 4.32,  &end
#
#   15 PHE  HA      16 GLN  HN     4.500   (#SUP   4.95 )
 &rst
  ixpk= 4, nxpk= 0, iat= 231, 249, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   15 PHE  HA      17 GLN  HN     4.350   (#SUP   3.26 )
 &rst
  ixpk= 3, nxpk= 0, iat= 231, 266, r1= 1.30, r2= 1.80, r3= 4.35, r4= 4.85,  &end
#
#   15 PHE  HA      18 MET  HN     4.190   (#SUP   1.70 )
 &rst
  ixpk= 1, nxpk= 0, iat= 231, 283, r1= 1.30, r2= 1.80, r3= 4.19, r4= 4.69,  &end
#
#   15 PHE  HB2     15 PHE  HN     3.750   (#SUP   4.28 )
 &rst
  ixpk= 4, nxpk= 0, iat= 233, 229, r1= 1.30, r2= 1.80, r3= 3.75, r4= 4.25,  &end
#
#   15 PHE  HB2     16 GLN  HN     4.360   (#SUP   3.92 )
 &rst
  ixpk= 3, nxpk= 0, iat= 233, 249, r1= 1.30, r2= 1.80, r3= 4.36, r4= 4.86,  &end
#
#   15 PHE  HB3     15 PHE  HN     3.620   (#SUP   4.28 )
 &rst
  ixpk= 4, nxpk= 0, iat= 234, 229, r1= 1.30, r2= 1.80, r3= 3.62, r4= 4.12,  &end
#
#   15 PHE  HB3     16 GLN  HN     4.880   (#SUP   3.92 )
 &rst
  ixpk= 3, nxpk= 0, iat= 234, 249, r1= 1.30, r2= 1.80, r3= 4.88, r4= 5.38,  &end
#
#   15 PHE  HN      16 GLN  HN     3.880   (#SUP   5.79 )
 &rst
  ixpk= 5, nxpk= 0, iat= 229, 249, r1= 1.30, r2= 1.80, r3= 3.88, r4= 4.38,  &end
#
#   15 PHE  HN      16 GLN  QB     4.220   (#SUP   3.46 )
 &rst
  ixpk= 3, nxpk= 0, iat= 229,  -1, r1= 1.30, r2= 1.80, r3= 4.74, r4= 5.24,
 igr2= 253, 254,
 &end
#
#   15 PHE  HN      17 GLN  HN     5.500   (#SUP   2.59 )
 &rst
  ixpk= 2, nxpk= 0, iat= 229, 266, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   16 GLN  HA      16 GLN  HN     4.230   (#SUP   4.62 )
 &rst
  ixpk= 4, nxpk= 0, iat= 251, 249, r1= 1.30, r2= 1.80, r3= 4.23, r4= 4.73,  &end
#
#   16 GLN  HA      17 GLN  HN     4.800   (#SUP   3.86 )
 &rst
  ixpk= 3, nxpk= 0, iat= 251, 266, r1= 1.30, r2= 1.80, r3= 4.80, r4= 5.30,  &end
#
#   16 GLN  HN      16 GLN  QB     3.260   (#SUP   4.62 )
 &rst
  ixpk= 4, nxpk= 0, iat= 249,  -1, r1= 1.30, r2= 1.80, r3= 3.66, r4= 4.16,
 igr2= 253, 254,
 &end
#
#   16 GLN  HN      16 GLN  QG     3.520   (#SUP   4.60 )
 &rst
  ixpk= 4, nxpk= 0, iat= 249,  -1, r1= 1.30, r2= 1.80, r3= 3.95, r4= 4.45,
 igr2= 256, 257,
 &end
#
#   16 GLN  HN      17 GLN  HG3    4.300   (#SUP   2.90 )
 &rst
  ixpk= 2, nxpk= 0, iat= 249, 274, r1= 1.30, r2= 1.80, r3= 4.30, r4= 4.80,  &end
#
#   16 GLN  HN      17 GLN  HN     3.860   (#SUP   5.55 )
 &rst
  ixpk= 5, nxpk= 0, iat= 249, 266, r1= 1.30, r2= 1.80, r3= 3.86, r4= 4.36,  &end
#
#   17 GLN  HA      17 GLN  HN     3.940   (#SUP   5.07 )
 &rst
  ixpk= 5, nxpk= 0, iat= 268, 266, r1= 1.30, r2= 1.80, r3= 3.94, r4= 4.44,  &end
#
#   17 GLN  HA      18 MET  HN     4.530   (#SUP   3.92 )
 &rst
  ixpk= 3, nxpk= 0, iat= 268, 283, r1= 1.30, r2= 1.80, r3= 4.53, r4= 5.03,  &end
#
#   17 GLN  HA      20 GLN  HN     4.200   (#SUP   1.50 )
 &rst
  ixpk= 1, nxpk= 0, iat= 268, 324, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,  &end
#
#   17 GLN  HA      21 ILE  HN     5.500   (#SUP   2.13 )
 &rst
  ixpk= 2, nxpk= 0, iat= 268, 341, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   17 GLN  HB2     17 GLN  HN     3.330   (#SUP   5.02 )
 &rst
  ixpk= 5, nxpk= 0, iat= 270, 266, r1= 1.30, r2= 1.80, r3= 3.33, r4= 3.83,  &end
#
#   17 GLN  HB2     18 MET  HN     3.920   (#SUP   3.52 )
 &rst
  ixpk= 3, nxpk= 0, iat= 270, 283, r1= 1.30, r2= 1.80, r3= 3.92, r4= 4.42,  &end
#
#   17 GLN  HB3     17 GLN  HN     3.800   (#SUP   4.68 )
 &rst
  ixpk= 4, nxpk= 0, iat= 271, 266, r1= 1.30, r2= 1.80, r3= 3.80, r4= 4.30,  &end
#
#   17 GLN  HE21    17 GLN  HE22   2.790   (#SUP   2.00 )
 &rst
  ixpk= 2, nxpk= 0, iat= 278, 279, r1= 1.30, r2= 1.80, r3= 2.79, r4= 3.29,  &end
#
#   17 GLN  HE21    17 GLN  HG2    4.640   (#SUP   3.39 )
 &rst
  ixpk= 3, nxpk= 0, iat= 278, 273, r1= 1.30, r2= 1.80, r3= 4.64, r4= 5.14,  &end
#
#   17 GLN  HE21    17 GLN  HG3    4.840   (#SUP   2.94 )
 &rst
  ixpk= 2, nxpk= 0, iat= 278, 274, r1= 1.30, r2= 1.80, r3= 4.84, r4= 5.34,  &end
#
#   17 GLN  HE22    17 GLN  HG2    4.870   (#SUP   3.39 )
 &rst
  ixpk= 3, nxpk= 0, iat= 279, 273, r1= 1.30, r2= 1.80, r3= 4.87, r4= 5.37,  &end
#
#   17 GLN  HE22    17 GLN  HG3    5.250   (#SUP   2.94 )
 &rst
  ixpk= 2, nxpk= 0, iat= 279, 274, r1= 1.30, r2= 1.80, r3= 5.25, r4= 5.75,  &end
#
#   17 GLN  HG2     17 GLN  HN     3.900   (#SUP   5.36 )
 &rst
  ixpk= 5, nxpk= 0, iat= 273, 266, r1= 1.30, r2= 1.80, r3= 3.90, r4= 4.40,  &end
#
#   17 GLN  HG3     17 GLN  HN     4.440   (#SUP   5.79 )
 &rst
  ixpk= 5, nxpk= 0, iat= 274, 266, r1= 1.30, r2= 1.80, r3= 4.44, r4= 4.94,  &end
#
#   18 MET  HA      18 MET  HN     3.810   (#SUP   5.62 )
 &rst
  ixpk= 5, nxpk= 0, iat= 285, 283, r1= 1.30, r2= 1.80, r3= 3.81, r4= 4.31,  &end
#
#   18 MET  HA      19 ARG+ HN     4.180   (#SUP   5.70 )
 &rst
  ixpk= 5, nxpk= 0, iat= 285, 300, r1= 1.30, r2= 1.80, r3= 4.18, r4= 4.68,  &end
#
#   18 MET  HA      21 ILE  HN     5.500   (#SUP   2.04 )
 &rst
  ixpk= 2, nxpk= 0, iat= 285, 341, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   18 MET  HB2     18 MET  HN     4.010   (#SUP   5.04 )
 &rst
  ixpk= 5, nxpk= 0, iat= 287, 283, r1= 1.30, r2= 1.80, r3= 4.01, r4= 4.51,  &end
#
#   18 MET  HB3     18 MET  HN     4.110   (#SUP   5.62 )
 &rst
  ixpk= 5, nxpk= 0, iat= 288, 283, r1= 1.30, r2= 1.80, r3= 4.11, r4= 4.61,  &end
#
#   18 MET  HB3     19 ARG+ HN     4.860   (#SUP   5.70 )
 &rst
  ixpk= 5, nxpk= 0, iat= 288, 300, r1= 1.30, r2= 1.80, r3= 4.86, r4= 5.36,  &end
#
#   18 MET  HG2     18 MET  HN     3.650   (#SUP   5.62 )
 &rst
  ixpk= 5, nxpk= 0, iat= 290, 283, r1= 1.30, r2= 1.80, r3= 3.65, r4= 4.15,  &end
#
#   18 MET  HG2     19 ARG+ HN     4.670   (#SUP   5.70 )
 &rst
  ixpk= 5, nxpk= 0, iat= 290, 300, r1= 1.30, r2= 1.80, r3= 4.67, r4= 5.17,  &end
#
#   18 MET  HG3     18 MET  HN     3.700   (#SUP   5.62 )
 &rst
  ixpk= 5, nxpk= 0, iat= 291, 283, r1= 1.30, r2= 1.80, r3= 3.70, r4= 4.20,  &end
#
#   18 MET  HG3     19 ARG+ HN     4.150   (#SUP   5.70 )
 &rst
  ixpk= 5, nxpk= 0, iat= 291, 300, r1= 1.30, r2= 1.80, r3= 4.15, r4= 4.65,  &end
#
#   18 MET  HN      19 ARG+ HN     3.810   (#SUP   5.53 )
 &rst
  ixpk= 5, nxpk= 0, iat= 283, 300, r1= 1.30, r2= 1.80, r3= 3.81, r4= 4.31,  &end
#
#   18 MET  HN      32 LEU  QD2    4.480   (#SUP   3.22 )
 &rst
  ixpk= 3, nxpk= 0, iat= 283,  -1, r1= 1.30, r2= 1.80, r3= 5.625, r4= 5.88,
 igr2= 527, 528, 529,
 &end
#
#   19 ARG+ HA      19 ARG+ HN     3.830   (#SUP   5.73 )
 &rst
  ixpk= 5, nxpk= 0, iat= 302, 300, r1= 1.30, r2= 1.80, r3= 3.83, r4= 4.33,  &end
#
#   19 ARG+ HA      20 GLN  HN     4.490   (#SUP   6.26 )
 &rst
  ixpk= 6, nxpk= 0, iat= 302, 324, r1= 1.30, r2= 1.80, r3= 4.49, r4= 4.99,  &end
#
#   19 ARG+ HA      21 ILE  HN     5.500   (#SUP   4.78 )
 &rst
  ixpk= 4, nxpk= 0, iat= 302, 341, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   19 ARG+ HA      22 ILE  HN     4.730   (#SUP   3.69 )
 &rst
  ixpk= 3, nxpk= 0, iat= 302, 360, r1= 1.30, r2= 1.80, r3= 4.73, r4= 5.23,  &end
#
#   19 ARG+ HD2     19 ARG+ HE     5.500   (#SUP   3.19 )
 &rst
  ixpk= 3, nxpk= 0, iat= 310, 313, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   19 ARG+ HD3     19 ARG+ HE     5.500   (#SUP   3.19 )
 &rst
  ixpk= 3, nxpk= 0, iat= 311, 313, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   19 ARG+ HG2     19 ARG+ HN     4.230   (#SUP   6.34 )
 &rst
  ixpk= 6, nxpk= 0, iat= 307, 300, r1= 1.30, r2= 1.80, r3= 4.23, r4= 4.73,  &end
#
#   19 ARG+ HG2     20 GLN  HN     4.730   (#SUP   5.84 )
 &rst
  ixpk= 5, nxpk= 0, iat= 307, 324, r1= 1.30, r2= 1.80, r3= 4.73, r4= 5.23,  &end
#
#   19 ARG+ HG3     19 ARG+ HN     4.160   (#SUP   6.34 )
 &rst
  ixpk= 6, nxpk= 0, iat= 308, 300, r1= 1.30, r2= 1.80, r3= 4.16, r4= 4.66,  &end
#
#   19 ARG+ HG3     20 GLN  HN     4.800   (#SUP   5.84 )
 &rst
  ixpk= 5, nxpk= 0, iat= 308, 324, r1= 1.30, r2= 1.80, r3= 4.80, r4= 5.30,  &end
#
#   19 ARG+ HN      19 ARG+ QB     3.500   (#SUP   6.68 )
 &rst
  ixpk= 6, nxpk= 0, iat= 300,  -1, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr2= 304, 305,
 &end
#
#   19 ARG+ HN      20 GLN  HN     3.750   (#SUP   5.23 )
 &rst
  ixpk= 5, nxpk= 0, iat= 300, 324, r1= 1.30, r2= 1.80, r3= 3.75, r4= 4.25,  &end
#
#   19 ARG+ HN      58 LEU  QD2    4.280   (#SUP   2.74 )
 &rst
  ixpk= 2, nxpk= 0, iat= 300,  -1, r1= 1.30, r2= 1.80, r3= 5.14, r4= 5.64,
 igr2= 967, 968, 969,
 &end
#
#   19 ARG+ QB      20 GLN  HN     3.510   (#SUP   6.16 )
 &rst
  ixpk= 6, nxpk= 0, iat=  -1, 324, r1= 1.30, r2= 1.80, r3= 3.94, r4= 4.44,
 igr1= 304, 305,
 &end
#
#   20 GLN  HA      20 GLN  HN     3.740   (#SUP   5.94 )
 &rst
  ixpk= 5, nxpk= 0, iat= 326, 324, r1= 1.30, r2= 1.80, r3= 3.74, r4= 4.24,  &end
#
#   20 GLN  HA      21 ILE  HN     4.700   (#SUP   5.82 )
 &rst
  ixpk= 5, nxpk= 0, iat= 326, 341, r1= 1.30, r2= 1.80, r3= 4.70, r4= 5.20,  &end
#
#   20 GLN  HE21    20 GLN  HE22   2.850   (#SUP   2.00 )
 &rst
  ixpk= 2, nxpk= 0, iat= 336, 337, r1= 1.30, r2= 1.80, r3= 2.85, r4= 3.35,  &end
#
#   20 GLN  HE21    20 GLN  HG2    5.180   (#SUP   3.39 )
 &rst
  ixpk= 3, nxpk= 0, iat= 336, 331, r1= 1.30, r2= 1.80, r3= 5.18, r4= 5.68,  &end
#
#   20 GLN  HE21    20 GLN  HG3    5.370   (#SUP   3.08 )
 &rst
  ixpk= 3, nxpk= 0, iat= 336, 332, r1= 1.30, r2= 1.80, r3= 5.37, r4= 5.87,  &end
#
#   20 GLN  HE22    20 GLN  HG2    4.800   (#SUP   3.39 )
 &rst
  ixpk= 3, nxpk= 0, iat= 337, 331, r1= 1.30, r2= 1.80, r3= 4.80, r4= 5.30,  &end
#
#   20 GLN  HE22    20 GLN  HG3    4.550   (#SUP   3.08 )
 &rst
  ixpk= 3, nxpk= 0, iat= 337, 332, r1= 1.30, r2= 1.80, r3= 4.55, r4= 5.05,  &end
#
#   20 GLN  HG2     20 GLN  HN     3.770   (#SUP   6.55 )
 &rst
  ixpk= 6, nxpk= 0, iat= 331, 324, r1= 1.30, r2= 1.80, r3= 3.77, r4= 4.27,  &end
#
#   20 GLN  HG2     21 ILE  HN     5.500   (#SUP   6.43 )
 &rst
  ixpk= 6, nxpk= 0, iat= 331, 341, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   20 GLN  HG3     20 GLN  HN     4.330   (#SUP   6.43 )
 &rst
  ixpk= 6, nxpk= 0, iat= 332, 324, r1= 1.30, r2= 1.80, r3= 4.33, r4= 4.83,  &end
#
#   20 GLN  HG3     21 ILE  HN     5.500   (#SUP   6.31 )
 &rst
  ixpk= 6, nxpk= 0, iat= 332, 341, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   20 GLN  HN      20 GLN  QB     3.110   (#SUP   6.07 )
 &rst
  ixpk= 6, nxpk= 0, iat= 324,  -1, r1= 1.30, r2= 1.80, r3= 3.49, r4= 3.99,
 igr2= 328, 329,
 &end
#
#   20 GLN  HN      21 ILE  HG12   4.990   (#SUP   4.22 )
 &rst
  ixpk= 4, nxpk= 0, iat= 324, 351, r1= 1.30, r2= 1.80, r3= 4.99, r4= 5.49,  &end
#
#   20 GLN  HN      21 ILE  HN     3.750   (#SUP   7.17 )
 &rst
  ixpk= 7, nxpk= 0, iat= 324, 341, r1= 1.30, r2= 1.80, r3= 3.75, r4= 4.25,  &end
#
#   20 GLN  HN      62 VAL  QG1    4.720   (#SUP   1.38 )
 &rst
  ixpk= 1, nxpk= 0, iat= 324,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr2=1022,1023,1024,
 &end
#
#   20 GLN  QB      21 ILE  HN     4.000   (#SUP   7.20 )
 &rst
  ixpk= 7, nxpk= 0, iat=  -1, 341, r1= 1.30, r2= 1.80, r3= 4.49, r4= 4.99,
 igr1= 328, 329,
 &end
#
#   21 ILE  HA      21 ILE  HN     4.000   (#SUP   7.30 )
 &rst
  ixpk= 7, nxpk= 0, iat= 343, 341, r1= 1.30, r2= 1.80, r3= 4.00, r4= 4.50,  &end
#
#   21 ILE  HB      21 ILE  HN     3.400   (#SUP   6.99 )
 &rst
  ixpk= 6, nxpk= 0, iat= 345, 341, r1= 1.30, r2= 1.80, r3= 3.40, r4= 3.90,  &end
#
#   21 ILE  HB      22 ILE  HN     3.770   (#SUP   5.88 )
 &rst
  ixpk= 5, nxpk= 0, iat= 345, 360, r1= 1.30, r2= 1.80, r3= 3.77, r4= 4.27,  &end
#
#   21 ILE  HG12    21 ILE  HN     3.720   (#SUP   7.70 )
 &rst
  ixpk= 7, nxpk= 0, iat= 351, 341, r1= 1.30, r2= 1.80, r3= 3.72, r4= 4.22,  &end
#
#   21 ILE  HG12    22 ILE  HN     4.360   (#SUP   6.04 )
 &rst
  ixpk= 6, nxpk= 0, iat= 351, 360, r1= 1.30, r2= 1.80, r3= 4.597, r4= 4.86,  &end
#
#   21 ILE  HG13    21 ILE  HN     3.520   (#SUP   6.55 )
 &rst
  ixpk= 6, nxpk= 0, iat= 352, 341, r1= 1.30, r2= 1.80, r3= 3.52, r4= 4.02,  &end
#
#   21 ILE  HN      21 ILE  QG2    3.720   (#SUP   6.06 )
 &rst
  ixpk= 6, nxpk= 0, iat= 341,  -1, r1= 1.30, r2= 1.80, r3= 4.47, r4= 4.97,
 igr2= 347, 348, 349,
 &end
#
#   21 ILE  HN      22 ILE  HN     3.750   (#SUP   5.97 )
 &rst
  ixpk= 5, nxpk= 0, iat= 341, 360, r1= 1.30, r2= 1.80, r3= 3.75, r4= 4.25,  &end
#
#   22 ILE  HA      22 ILE  HN     3.780   (#SUP   6.34 )
 &rst
  ixpk= 6, nxpk= 0, iat= 362, 360, r1= 1.30, r2= 1.80, r3= 3.78, r4= 4.28,  &end
#
#   22 ILE  HA      23 GLN  HN     4.600   (#SUP   6.23 )
 &rst
  ixpk= 6, nxpk= 0, iat= 362, 379, r1= 1.30, r2= 1.80, r3= 4.60, r4= 5.10,  &end
#
#   22 ILE  HA      25 ASN  HN     4.140   (#SUP   1.27 )
 &rst
  ixpk= 1, nxpk= 0, iat= 362, 413, r1= 1.30, r2= 1.80, r3= 4.14, r4= 4.64,  &end
#
#   22 ILE  HB      22 ILE  HN     3.760   (#SUP   6.34 )
 &rst
  ixpk= 6, nxpk= 0, iat= 364, 360, r1= 1.30, r2= 1.80, r3= 3.76, r4= 4.26,  &end
#
#   22 ILE  HB      23 GLN  HN     3.830   (#SUP   6.23 )
 &rst
  ixpk= 6, nxpk= 0, iat= 364, 379, r1= 1.30, r2= 1.80, r3= 3.83, r4= 4.33,  &end
#
#   22 ILE  HN      22 ILE  QD1    4.330   (#SUP   6.34 )
 &rst
  ixpk= 6, nxpk= 0, iat= 360,  -1, r1= 1.30, r2= 1.80, r3= 5.20, r4= 5.70,
 igr2= 373, 374, 375,
 &end
#
#   22 ILE  HN      22 ILE  QG1    3.600   (#SUP   6.34 )
 &rst
  ixpk= 6, nxpk= 0, iat= 360,  -1, r1= 1.30, r2= 1.80, r3= 4.04, r4= 4.54,
 igr2= 370, 371,
 &end
#
#   22 ILE  HN      22 ILE  QG2    4.050   (#SUP   6.81 )
 &rst
  ixpk= 6, nxpk= 0, iat= 360,  -1, r1= 1.30, r2= 1.80, r3= 4.86, r4= 5.36,
 igr2= 366, 367, 368,
 &end
#
#   22 ILE  HN      23 GLN  HN     4.130   (#SUP   6.93 )
 &rst
  ixpk= 6, nxpk= 0, iat= 360, 379, r1= 1.30, r2= 1.80, r3= 4.13, r4= 4.63,  &end
#
#   22 ILE  HN      23 GLN  QB     4.270   (#SUP   4.72 )
 &rst
  ixpk= 4, nxpk= 0, iat= 360,  -1, r1= 1.30, r2= 1.80, r3= 4.79, r4= 5.29,
 igr2= 383, 384,
 &end
#
#   22 ILE  HN      58 LEU  QD2    5.500   (#SUP   2.80 )
 &rst
  ixpk= 2, nxpk= 0, iat= 360,  -1, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr2= 967, 968, 969,
 &end
#
#   22 ILE  QD1     23 GLN  HN     5.500   (#SUP   6.23 )
 &rst
  ixpk= 6, nxpk= 0, iat=  -1, 379, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr1= 373, 374, 375,
 &end
#
#   22 ILE  QD1     28 LEU  HN     5.190   (#SUP   3.10 )
 &rst
  ixpk= 3, nxpk= 0, iat=  -1, 452, r1= 1.30, r2= 1.80, r3= 6.23, r4= 6.73,
 igr1= 373, 374, 375,
 &end
#
#   22 ILE  QD1     29 LEU  HN     4.650   (#SUP   5.35 )
 &rst
  ixpk= 5, nxpk= 0, iat=  -1, 471, r1= 1.30, r2= 1.80, r3= 5.58, r4= 6.08,
 igr1= 373, 374, 375,
 &end
#
#   22 ILE  QD1     31 ALA  HN     5.500   (#SUP   1.16 )
 &rst
  ixpk= 1, nxpk= 0, iat=  -1, 504, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr1= 373, 374, 375,
 &end
#
#   22 ILE  QD1     32 LEU  HN     4.220   (#SUP   2.05 )
 &rst
  ixpk= 2, nxpk= 0, iat=  -1, 514, r1= 1.30, r2= 1.80, r3= 5.07, r4= 5.57,
 igr1= 373, 374, 375,
 &end
#
#   22 ILE  QG1     23 GLN  HN     4.630   (#SUP   6.23 )
 &rst
  ixpk= 6, nxpk= 0, iat=  -1, 379, r1= 1.30, r2= 1.80, r3= 5.20, r4= 5.70,
 igr1= 370, 371,
 &end
#
#   22 ILE  QG2     23 GLN  HN     4.190   (#SUP   7.82 )
 &rst
  ixpk= 7, nxpk= 0, iat=  -1, 379, r1= 1.30, r2= 1.80, r3= 5.03, r4= 5.53,
 igr1= 366, 367, 368,
 &end
#
#   22 ILE  QG2     24 GLN  HN     4.610   (#SUP   3.63 )
 &rst
  ixpk= 3, nxpk= 0, iat=  -1, 396, r1= 1.30, r2= 1.80, r3= 5.54, r4= 6.04,
 igr1= 366, 367, 368,
 &end
#
#   22 ILE  QG2     29 LEU  HN     4.700   (#SUP   3.86 )
 &rst
  ixpk= 3, nxpk= 0, iat=  -1, 471, r1= 1.30, r2= 1.80, r3= 5.64, r4= 6.14,
 igr1= 366, 367, 368,
 &end
#
#   23 GLN  HA      23 GLN  HN     4.390   (#SUP   6.53 )
 &rst
  ixpk= 6, nxpk= 0, iat= 381, 379, r1= 1.30, r2= 1.80, r3= 4.39, r4= 4.89,  &end
#
#   23 GLN  HA      24 GLN  HN     4.310   (#SUP   5.15 )
 &rst
  ixpk= 5, nxpk= 0, iat= 381, 396, r1= 1.30, r2= 1.80, r3= 4.31, r4= 4.81,  &end
#
#   23 GLN  HE21    23 GLN  HE22   3.020   (#SUP   2.93 )
 &rst
  ixpk= 2, nxpk= 0, iat= 391, 392, r1= 1.30, r2= 1.80, r3= 3.02, r4= 3.52,  &end
#
#   23 GLN  HE21    23 GLN  HG2    4.190   (#SUP   3.83 )
 &rst
  ixpk= 3, nxpk= 0, iat= 391, 386, r1= 1.30, r2= 1.80, r3= 4.19, r4= 4.69,  &end
#
#   23 GLN  HE21    23 GLN  HG3    4.580   (#SUP   3.69 )
 &rst
  ixpk= 3, nxpk= 0, iat= 391, 387, r1= 1.30, r2= 1.80, r3= 4.58, r4= 5.08,  &end
#
#   23 GLN  HE21    23 GLN  QB     5.500   (#SUP   4.44 )
 &rst
  ixpk= 4, nxpk= 0, iat= 391,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2= 383, 384,
 &end
#
#   23 GLN  HE21    62 VAL  HN     5.500   (#SUP   0.75 )
 &rst
  ixpk= 0, nxpk= 0, iat= 391,1016, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   23 GLN  HE22    23 GLN  HG2    4.750   (#SUP   3.83 )
 &rst
  ixpk= 3, nxpk= 0, iat= 392, 386, r1= 1.30, r2= 1.80, r3= 4.75, r4= 5.25,  &end
#
#   23 GLN  HE22    23 GLN  HG3    5.100   (#SUP   3.69 )
 &rst
  ixpk= 3, nxpk= 0, iat= 392, 387, r1= 1.30, r2= 1.80, r3= 5.10, r4= 5.60,  &end
#
#   23 GLN  HE22    23 GLN  QB     5.230   (#SUP   4.44 )
 &rst
  ixpk= 4, nxpk= 0, iat= 392,  -1, r1= 1.30, r2= 1.80, r3= 5.87, r4= 6.37,
 igr2= 383, 384,
 &end
#
#   23 GLN  HE22    61 PRO  HA     5.080   (#SUP   1.48 )
 &rst
  ixpk= 1, nxpk= 0, iat= 392,1012, r1= 1.30, r2= 1.80, r3= 5.08, r4= 5.58,  &end
#
#   23 GLN  HE22    62 VAL  HN     5.500   (#SUP   2.89 )
 &rst
  ixpk= 2, nxpk= 0, iat= 392,1016, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   23 GLN  HE22    62 VAL  QG1    5.500   (#SUP   1.46 )
 &rst
  ixpk= 1, nxpk= 0, iat= 392,  -1, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr2=1022,1023,1024,
 &end
#
#   23 GLN  HG2     23 GLN  HN     3.840   (#SUP   5.79 )
 &rst
  ixpk= 5, nxpk= 0, iat= 386, 379, r1= 1.30, r2= 1.80, r3= 3.84, r4= 4.34,  &end
#
#   23 GLN  HG3     23 GLN  HN     3.970   (#SUP   5.79 )
 &rst
  ixpk= 5, nxpk= 0, iat= 387, 379, r1= 1.30, r2= 1.80, r3= 3.97, r4= 4.47,  &end
#
#   23 GLN  HN      23 GLN  QB     3.260   (#SUP   7.17 )
 &rst
  ixpk= 7, nxpk= 0, iat= 379,  -1, r1= 1.30, r2= 1.80, r3= 3.66, r4= 4.16,
 igr2= 383, 384,
 &end
#
#   23 GLN  HN      24 GLN  HN     3.620   (#SUP   4.71 )
 &rst
  ixpk= 4, nxpk= 0, iat= 379, 396, r1= 1.30, r2= 1.80, r3= 3.62, r4= 4.12,  &end
#
#   23 GLN  QB      24 GLN  HN     3.480   (#SUP   5.15 )
 &rst
  ixpk= 5, nxpk= 0, iat=  -1, 396, r1= 1.30, r2= 1.80, r3= 3.91, r4= 4.41,
 igr1= 383, 384,
 &end
#
#   24 GLN  HA      24 GLN  HN     3.660   (#SUP   5.95 )
 &rst
  ixpk= 5, nxpk= 0, iat= 398, 396, r1= 1.30, r2= 1.80, r3= 3.66, r4= 4.16,  &end
#
#   24 GLN  HA      25 ASN  HN     4.160   (#SUP   5.39 )
 &rst
  ixpk= 5, nxpk= 0, iat= 398, 413, r1= 1.30, r2= 1.80, r3= 4.16, r4= 4.66,  &end
#
#   24 GLN  HB2     24 GLN  HN     3.460   (#SUP   4.93 )
 &rst
  ixpk= 4, nxpk= 0, iat= 400, 396, r1= 1.30, r2= 1.80, r3= 3.46, r4= 3.96,  &end
#
#   24 GLN  HB2     25 ASN  HN     3.910   (#SUP   5.02 )
 &rst
  ixpk= 5, nxpk= 0, iat= 400, 413, r1= 1.30, r2= 1.80, r3= 3.91, r4= 4.41,  &end
#
#   24 GLN  HB3     25 ASN  HN     3.940   (#SUP   5.09 )
 &rst
  ixpk= 5, nxpk= 0, iat= 401, 413, r1= 1.30, r2= 1.80, r3= 3.94, r4= 4.44,  &end
#
#   24 GLN  HG2     24 GLN  HN     4.020   (#SUP   5.33 )
 &rst
  ixpk= 5, nxpk= 0, iat= 403, 396, r1= 1.30, r2= 1.80, r3= 4.02, r4= 4.52,  &end
#
#   24 GLN  HG3     24 GLN  HN     4.150   (#SUP   5.93 )
 &rst
  ixpk= 5, nxpk= 0, iat= 404, 396, r1= 1.30, r2= 1.80, r3= 4.15, r4= 4.65,  &end
#
#   24 GLN  HG3     25 ASN  HN     3.870   (#SUP   4.73 )
 &rst
  ixpk= 4, nxpk= 0, iat= 404, 413, r1= 1.30, r2= 1.80, r3= 3.87, r4= 4.37,  &end
#
#   24 GLN  HN      25 ASN  HN     3.240   (#SUP   5.02 )
 &rst
  ixpk= 5, nxpk= 0, iat= 396, 413, r1= 1.30, r2= 1.80, r3= 3.24, r4= 3.74,  &end
#
#   25 ASN  HA      25 ASN  HN     3.780   (#SUP   5.04 )
 &rst
  ixpk= 5, nxpk= 0, iat= 415, 413, r1= 1.30, r2= 1.80, r3= 3.78, r4= 4.28,  &end
#
#   25 ASN  HB2     25 ASN  HD21   4.580   (#SUP   3.07 )
 &rst
  ixpk= 3, nxpk= 0, iat= 417, 422, r1= 1.30, r2= 1.80, r3= 4.58, r4= 5.08,  &end
#
#   25 ASN  HB2     25 ASN  HD22   4.990   (#SUP   2.74 )
 &rst
  ixpk= 2, nxpk= 0, iat= 417, 423, r1= 1.30, r2= 1.80, r3= 4.99, r4= 5.49,  &end
#
#   25 ASN  HB2     25 ASN  HN     3.890   (#SUP   4.53 )
 &rst
  ixpk= 4, nxpk= 0, iat= 417, 413, r1= 1.30, r2= 1.80, r3= 3.89, r4= 4.39,  &end
#
#   25 ASN  HB2     28 LEU  HN     5.120   (#SUP   3.30 )
 &rst
  ixpk= 3, nxpk= 0, iat= 417, 452, r1= 1.30, r2= 1.80, r3= 5.12, r4= 5.62,  &end
#
#   25 ASN  HB3     25 ASN  HD21   4.410   (#SUP   3.07 )
 &rst
  ixpk= 3, nxpk= 0, iat= 418, 422, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,  &end
#
#   25 ASN  HB3     25 ASN  HD22   4.780   (#SUP   2.74 )
 &rst
  ixpk= 2, nxpk= 0, iat= 418, 423, r1= 1.30, r2= 1.80, r3= 4.78, r4= 5.28,  &end
#
#   25 ASN  HB3     25 ASN  HN     3.930   (#SUP   4.53 )
 &rst
  ixpk= 4, nxpk= 0, iat= 418, 413, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,  &end
#
#   25 ASN  HB3     28 LEU  HN     5.130   (#SUP   3.30 )
 &rst
  ixpk= 3, nxpk= 0, iat= 418, 452, r1= 1.30, r2= 1.80, r3= 5.13, r4= 5.63,  &end
#
#   25 ASN  HD21    25 ASN  HD22   3.120   (#SUP   2.31 )
 &rst
  ixpk= 2, nxpk= 0, iat= 422, 423, r1= 1.30, r2= 1.80, r3= 3.12, r4= 3.62,  &end
#
#   25 ASN  HD21    26 PRO  HG2    5.260   (#SUP   2.77 )
 &rst
  ixpk= 2, nxpk= 0, iat= 422, 431, r1= 1.30, r2= 1.80, r3= 5.26, r4= 5.76,  &end
#
#   25 ASN  HD21    28 LEU  HG     5.360   (#SUP   4.97 )
 &rst
  ixpk= 4, nxpk= 0, iat= 422, 459, r1= 1.30, r2= 1.80, r3= 5.36, r4= 5.86,  &end
#
#   25 ASN  HD21    28 LEU  QD1    5.500   (#SUP   4.96 )
 &rst
  ixpk= 4, nxpk= 0, iat= 422,  -1, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr2= 461, 462, 463,
 &end
#
#   25 ASN  HD21    28 LEU  QD2    4.860   (#SUP   2.96 )
 &rst
  ixpk= 2, nxpk= 0, iat= 422,  -1, r1= 1.30, r2= 1.80, r3= 5.84, r4= 6.34,
 igr2= 465, 466, 467,
 &end
#
#   25 ASN  HD22    28 LEU  HG     5.500   (#SUP   4.97 )
 &rst
  ixpk= 4, nxpk= 0, iat= 423, 459, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   25 ASN  HD22    28 LEU  QD1    5.000   (#SUP   4.97 )
 &rst
  ixpk= 4, nxpk= 0, iat= 423,  -1, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,
 igr2= 461, 462, 463,
 &end
#
#   25 ASN  HD22    28 LEU  QD2    5.500   (#SUP   2.95 )
 &rst
  ixpk= 2, nxpk= 0, iat= 423,  -1, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr2= 465, 466, 467,
 &end
#
#   25 ASN  HN      26 PRO  HD3    4.220   (#SUP   3.54 )
 &rst
  ixpk= 3, nxpk= 0, iat= 413, 429, r1= 1.30, r2= 1.80, r3= 4.22, r4= 4.72,  &end
#
#   26 PRO  HB2     27 SER  HN     5.040   (#SUP   5.94 )
 &rst
  ixpk= 5, nxpk= 0, iat= 434, 441, r1= 1.30, r2= 1.80, r3= 5.04, r4= 5.54,  &end
#
#   26 PRO  HB3     27 SER  HN     5.000   (#SUP   5.91 )
 &rst
  ixpk= 5, nxpk= 0, iat= 435, 441, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50,  &end
#
#   26 PRO  HD2     27 SER  HN     4.390   (#SUP   5.04 )
 &rst
  ixpk= 5, nxpk= 0, iat= 428, 441, r1= 1.30, r2= 1.80, r3= 4.39, r4= 4.89,  &end
#
#   26 PRO  HD3     27 SER  HN     4.800   (#SUP   4.95 )
 &rst
  ixpk= 4, nxpk= 0, iat= 429, 441, r1= 1.30, r2= 1.80, r3= 4.80, r4= 5.30,  &end
#
#   26 PRO  HG3     27 SER  HN     4.640   (#SUP   4.90 )
 &rst
  ixpk= 4, nxpk= 0, iat= 432, 441, r1= 1.30, r2= 1.80, r3= 4.64, r4= 5.14,  &end
#
#   27 SER  HA      27 SER  HN     3.870   (#SUP   3.49 )
 &rst
  ixpk= 3, nxpk= 0, iat= 443, 441, r1= 1.30, r2= 1.80, r3= 3.87, r4= 4.37,  &end
#
#   27 SER  HA      28 LEU  HN     4.570   (#SUP   5.18 )
 &rst
  ixpk= 5, nxpk= 0, iat= 443, 452, r1= 1.30, r2= 1.80, r3= 4.57, r4= 5.07,  &end
#
#   27 SER  HA      29 LEU  HN     5.330   (#SUP   2.76 )
 &rst
  ixpk= 2, nxpk= 0, iat= 443, 471, r1= 1.30, r2= 1.80, r3= 5.33, r4= 5.83,  &end
#
#   27 SER  HN      27 SER  QB     3.630   (#SUP   3.49 )
 &rst
  ixpk= 3, nxpk= 0, iat= 441,  -1, r1= 1.30, r2= 1.80, r3= 4.07, r4= 4.57,
 igr2= 445, 446,
 &end
#
#   27 SER  HN      28 LEU  HN     3.840   (#SUP   4.66 )
 &rst
  ixpk= 4, nxpk= 0, iat= 441, 452, r1= 1.30, r2= 1.80, r3= 3.84, r4= 4.34,  &end
#
#   27 SER  QB      28 LEU  HN     4.480   (#SUP   5.18 )
 &rst
  ixpk= 5, nxpk= 0, iat=  -1, 452, r1= 1.30, r2= 1.80, r3= 5.03, r4= 5.53,
 igr1= 445, 446,
 &end
#
#   27 SER  QB      29 LEU  HN     5.500   (#SUP   2.76 )
 &rst
  ixpk= 2, nxpk= 0, iat=  -1, 471, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 445, 446,
 &end
#
#   28 LEU  HA      28 LEU  HN     3.820   (#SUP   7.05 )
 &rst
  ixpk= 7, nxpk= 0, iat= 454, 452, r1= 1.30, r2= 1.80, r3= 3.82, r4= 4.32,  &end
#
#   28 LEU  HA      29 LEU  HN     4.430   (#SUP   5.93 )
 &rst
  ixpk= 5, nxpk= 0, iat= 454, 471, r1= 1.30, r2= 1.80, r3= 4.43, r4= 4.93,  &end
#
#   28 LEU  HA      31 ALA  HN     4.650   (#SUP   2.00 )
 &rst
  ixpk= 2, nxpk= 0, iat= 454, 504, r1= 1.30, r2= 1.80, r3= 4.65, r4= 5.15,  &end
#
#   28 LEU  HB2     28 LEU  HN     3.570   (#SUP   7.06 )
 &rst
  ixpk= 7, nxpk= 0, iat= 456, 452, r1= 1.30, r2= 1.80, r3= 3.57, r4= 4.07,  &end
#
#   28 LEU  HB2     29 LEU  HN     4.560   (#SUP   6.02 )
 &rst
  ixpk= 6, nxpk= 0, iat= 456, 471, r1= 1.30, r2= 1.80, r3= 4.56, r4= 5.06,  &end
#
#   28 LEU  HB3     28 LEU  HN     3.860   (#SUP   6.40 )
 &rst
  ixpk= 6, nxpk= 0, iat= 457, 452, r1= 1.30, r2= 1.80, r3= 3.86, r4= 4.36,  &end
#
#   28 LEU  HG      28 LEU  HN     3.600   (#SUP   6.40 )
 &rst
  ixpk= 6, nxpk= 0, iat= 459, 452, r1= 1.30, r2= 1.80, r3= 3.60, r4= 4.10,  &end
#
#   28 LEU  HN      28 LEU  QD1    4.110   (#SUP   6.47 )
 &rst
  ixpk= 6, nxpk= 0, iat= 452,  -1, r1= 1.30, r2= 1.80, r3= 4.94, r4= 5.44,
 igr2= 461, 462, 463,
 &end
#
#   28 LEU  HN      28 LEU  QD2    4.210   (#SUP   7.06 )
 &rst
  ixpk= 7, nxpk= 0, iat= 452,  -1, r1= 1.30, r2= 1.80, r3= 5.06, r4= 5.56,
 igr2= 465, 466, 467,
 &end
#
#   28 LEU  HN      29 LEU  HN     3.810   (#SUP   7.96 )
 &rst
  ixpk= 7, nxpk= 0, iat= 452, 471, r1= 1.30, r2= 1.80, r3= 3.81, r4= 4.31,  &end
#
#   28 LEU  HN      30 PRO  HD2    4.990   (#SUP   1.43 )
 &rst
  ixpk= 1, nxpk= 0, iat= 452, 491, r1= 1.30, r2= 1.80, r3= 4.99, r4= 5.49,  &end
#
#   28 LEU  QD2     29 LEU  HN     5.440   (#SUP   6.17 )
 &rst
  ixpk= 6, nxpk= 0, iat=  -1, 471, r1= 1.30, r2= 1.80, r3= 6.53, r4= 7.03,
 igr1= 465, 466, 467,
 &end
#
#   28 LEU  QD2     31 ALA  HN     4.800   (#SUP   2.00 )
 &rst
  ixpk= 2, nxpk= 0, iat=  -1, 504, r1= 1.30, r2= 1.80, r3= 5.76, r4= 6.26,
 igr1= 465, 466, 467,
 &end
#
#   29 LEU  HA      29 LEU  HN     3.560   (#SUP   6.49 )
 &rst
  ixpk= 6, nxpk= 0, iat= 473, 471, r1= 1.30, r2= 1.80, r3= 3.56, r4= 4.06,  &end
#
#   29 LEU  HB2     29 LEU  HN     3.660   (#SUP   6.96 )
 &rst
  ixpk= 6, nxpk= 0, iat= 475, 471, r1= 1.30, r2= 1.80, r3= 3.66, r4= 4.16,  &end
#
#   29 LEU  HB3     29 LEU  HN     3.420   (#SUP   6.14 )
 &rst
  ixpk= 6, nxpk= 0, iat= 476, 471, r1= 1.30, r2= 1.80, r3= 3.42, r4= 3.92,  &end
#
#   29 LEU  HN      29 LEU  QD2    4.390   (#SUP   5.18 )
 &rst
  ixpk= 5, nxpk= 0, iat= 471,  -1, r1= 1.30, r2= 1.80, r3= 5.27, r4= 5.77,
 igr2= 484, 485, 486,
 &end
#
#   29 LEU  HN      30 PRO  HD2    3.930   (#SUP   6.36 )
 &rst
  ixpk= 6, nxpk= 0, iat= 471, 491, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,  &end
#
#   29 LEU  HN      30 PRO  HD3    3.720   (#SUP   6.65 )
 &rst
  ixpk= 6, nxpk= 0, iat= 471, 492, r1= 1.30, r2= 1.80, r3= 3.72, r4= 4.22,  &end
#
#   29 LEU  QD1     32 LEU  HN     4.980   (#SUP   2.05 )
 &rst
  ixpk= 2, nxpk= 0, iat=  -1, 514, r1= 1.30, r2= 1.80, r3= 5.98, r4= 6.48,
 igr1= 480, 481, 482,
 &end
#
#   29 LEU  QD1     33 LEU  HN     5.500   (#SUP   3.58 )
 &rst
  ixpk= 3, nxpk= 0, iat=  -1, 533, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr1= 480, 481, 482,
 &end
#
#   30 PRO  HA      32 LEU  HN     3.930   (#SUP   4.53 )
 &rst
  ixpk= 4, nxpk= 0, iat= 500, 514, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,  &end
#
#   30 PRO  HA      33 LEU  HN     3.960   (#SUP   7.28 )
 &rst
  ixpk= 7, nxpk= 0, iat= 500, 533, r1= 1.30, r2= 1.80, r3= 3.96, r4= 4.46,  &end
#
#   30 PRO  HA      34 GLN  HN     4.180   (#SUP   6.00 )
 &rst
  ixpk= 6, nxpk= 0, iat= 500, 552, r1= 1.30, r2= 1.80, r3= 4.18, r4= 4.68,  &end
#
#   30 PRO  HB2     31 ALA  HN     4.290   (#SUP   5.91 )
 &rst
  ixpk= 5, nxpk= 0, iat= 497, 504, r1= 1.30, r2= 1.80, r3= 4.29, r4= 4.79,  &end
#
#   30 PRO  HB3     31 ALA  HN     3.570   (#SUP   6.00 )
 &rst
  ixpk= 6, nxpk= 0, iat= 498, 504, r1= 1.30, r2= 1.80, r3= 3.708, r4= 4.07,  &end
#
#   30 PRO  HD2     31 ALA  HN     4.070   (#SUP   5.03 )
 &rst
  ixpk= 5, nxpk= 0, iat= 491, 504, r1= 1.30, r2= 1.80, r3= 4.07, r4= 4.57,  &end
#
#   30 PRO  HD3     31 ALA  HN     4.590   (#SUP   5.04 )
 &rst
  ixpk= 5, nxpk= 0, iat= 492, 504, r1= 1.30, r2= 1.80, r3= 4.59, r4= 5.09,  &end
#
#   30 PRO  HG2     31 ALA  HN     4.390   (#SUP   6.72 )
 &rst
  ixpk= 6, nxpk= 0, iat= 494, 504, r1= 1.30, r2= 1.80, r3= 4.39, r4= 4.89,  &end
#
#   31 ALA  HA      31 ALA  HN     3.540   (#SUP   3.31 )
 &rst
  ixpk= 3, nxpk= 0, iat= 506, 504, r1= 1.30, r2= 1.80, r3= 3.54, r4= 4.04,  &end
#
#   31 ALA  HN      31 ALA  QB     3.200   (#SUP   4.61 )
 &rst
  ixpk= 4, nxpk= 0, iat= 504,  -1, r1= 1.30, r2= 1.80, r3= 3.84, r4= 4.34,
 igr2= 508, 509, 510,
 &end
#
#   31 ALA  HN      32 LEU  HN     3.580   (#SUP   5.09 )
 &rst
  ixpk= 5, nxpk= 0, iat= 504, 514, r1= 1.30, r2= 1.80, r3= 3.58, r4= 4.08,  &end
#
#   31 ALA  HN      33 LEU  HN     5.460   (#SUP   4.51 )
 &rst
  ixpk= 4, nxpk= 0, iat= 504, 533, r1= 1.30, r2= 1.80, r3= 5.46, r4= 5.96,  &end
#
#   31 ALA  HN      34 GLN  HN     5.310   (#SUP   4.23 )
 &rst
  ixpk= 4, nxpk= 0, iat= 504, 552, r1= 1.30, r2= 1.80, r3= 5.31, r4= 5.81,  &end
#
#   31 ALA  QB      32 LEU  HN     3.650   (#SUP   4.61 )
 &rst
  ixpk= 4, nxpk= 0, iat=  -1, 514, r1= 1.30, r2= 1.80, r3= 4.38, r4= 4.88,
 igr1= 508, 509, 510,
 &end
#
#   31 ALA  QB      33 LEU  HN     5.500   (#SUP   3.89 )
 &rst
  ixpk= 3, nxpk= 0, iat=  -1, 533, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr1= 508, 509, 510,
 &end
#
#   31 ALA  QB      34 GLN  HN     4.800   (#SUP   5.15 )
 &rst
  ixpk= 5, nxpk= 0, iat=  -1, 552, r1= 1.30, r2= 1.80, r3= 5.76, r4= 6.26,
 igr1= 508, 509, 510,
 &end
#
#   31 ALA  QB      35 GLN  HN     5.110   (#SUP   2.08 )
 &rst
  ixpk= 2, nxpk= 0, iat=  -1, 569, r1= 1.30, r2= 1.80, r3= 6.14, r4= 6.64,
 igr1= 508, 509, 510,
 &end
#
#   32 LEU  HA      32 LEU  HN     3.870   (#SUP   6.03 )
 &rst
  ixpk= 6, nxpk= 0, iat= 516, 514, r1= 1.30, r2= 1.80, r3= 3.87, r4= 4.37,  &end
#
#   32 LEU  HA      35 GLN  HN     4.040   (#SUP   5.60 )
 &rst
  ixpk= 5, nxpk= 0, iat= 516, 569, r1= 1.30, r2= 1.80, r3= 4.04, r4= 4.54,  &end
#
#   32 LEU  HB2     32 LEU  HN     3.480   (#SUP   5.46 )
 &rst
  ixpk= 5, nxpk= 0, iat= 518, 514, r1= 1.30, r2= 1.80, r3= 3.48, r4= 3.98,  &end
#
#   32 LEU  HB3     32 LEU  HN     3.300   (#SUP   5.47 )
 &rst
  ixpk= 5, nxpk= 0, iat= 519, 514, r1= 1.30, r2= 1.80, r3= 3.30, r4= 3.80,  &end
#
#   32 LEU  HB3     33 LEU  HN     3.910   (#SUP   6.26 )
 &rst
  ixpk= 6, nxpk= 0, iat= 519, 533, r1= 1.30, r2= 1.80, r3= 3.91, r4= 4.41,  &end
#
#   32 LEU  HB3     35 GLN  HN     4.810   (#SUP   3.61 )
 &rst
  ixpk= 3, nxpk= 0, iat= 519, 569, r1= 1.30, r2= 1.80, r3= 5.012, r4= 5.31,  &end
#
#   32 LEU  HG      36 ILE  HN     5.500   (#SUP   2.08 )
 &rst
  ixpk= 2, nxpk= 0, iat= 521, 586, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   32 LEU  HN      32 LEU  QD2    4.000   (#SUP   4.81 )
 &rst
  ixpk= 4, nxpk= 0, iat= 514,  -1, r1= 1.30, r2= 1.80, r3= 5.015, r4= 5.30,
 igr2= 527, 528, 529,
 &end
#
#   32 LEU  HN      33 LEU  HN     3.760   (#SUP   8.71 )
 &rst
  ixpk= 8, nxpk= 0, iat= 514, 533, r1= 1.30, r2= 1.80, r3= 3.76, r4= 4.26,  &end
#
#   32 LEU  HN      33 LEU  QD1    4.060   (#SUP   5.00 )
 &rst
  ixpk= 5, nxpk= 0, iat= 514,  -1, r1= 1.30, r2= 1.80, r3= 4.88, r4= 5.38,
 igr2= 542, 543, 544,
 &end
#
#   32 LEU  HN      34 GLN  HN     4.330   (#SUP   5.76 )
 &rst
  ixpk= 5, nxpk= 0, iat= 514, 552, r1= 1.30, r2= 1.80, r3= 4.33, r4= 4.83,  &end
#
#   32 LEU  QD1     33 LEU  HN     5.500   (#SUP   6.41 )
 &rst
  ixpk= 6, nxpk= 0, iat=  -1, 533, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr1= 523, 524, 525,
 &end
#
#   32 LEU  QD1     35 GLN  HN     4.990   (#SUP   5.66 )
 &rst
  ixpk= 5, nxpk= 0, iat=  -1, 569, r1= 1.30, r2= 1.80, r3= 5.99, r4= 6.49,
 igr1= 523, 524, 525,
 &end
#
#   33 LEU  HA      33 LEU  HN     4.140   (#SUP   7.01 )
 &rst
  ixpk= 7, nxpk= 0, iat= 535, 533, r1= 1.30, r2= 1.80, r3= 4.14, r4= 4.64,  &end
#
#   33 LEU  HA      34 GLN  HN     4.730   (#SUP   7.22 )
 &rst
  ixpk= 7, nxpk= 0, iat= 535, 552, r1= 1.30, r2= 1.80, r3= 4.73, r4= 5.23,  &end
#
#   33 LEU  HA      35 GLN  HN     5.470   (#SUP   5.00 )
 &rst
  ixpk= 5, nxpk= 0, iat= 535, 569, r1= 1.30, r2= 1.80, r3= 5.47, r4= 5.97,  &end
#
#   33 LEU  HA      36 ILE  HN     4.690   (#SUP   4.00 )
 &rst
  ixpk= 4, nxpk= 0, iat= 535, 586, r1= 1.30, r2= 1.80, r3= 4.69, r4= 5.19,  &end
#
#   33 LEU  HA      37 GLY  HN     5.500   (#SUP   1.71 )
 &rst
  ixpk= 1, nxpk= 0, iat= 535, 605, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   33 LEU  HB2     33 LEU  HN     3.500   (#SUP   7.04 )
 &rst
  ixpk= 7, nxpk= 0, iat= 537, 533, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   33 LEU  HB2     34 GLN  HN     3.820   (#SUP   6.31 )
 &rst
  ixpk= 6, nxpk= 0, iat= 537, 552, r1= 1.30, r2= 1.80, r3= 3.82, r4= 4.32,  &end
#
#   33 LEU  HB3     33 LEU  HN     4.020   (#SUP   7.36 )
 &rst
  ixpk= 7, nxpk= 0, iat= 538, 533, r1= 1.30, r2= 1.80, r3= 4.02, r4= 4.52,  &end
#
#   33 LEU  HB3     34 GLN  HN     4.230   (#SUP   6.31 )
 &rst
  ixpk= 6, nxpk= 0, iat= 538, 552, r1= 1.30, r2= 1.80, r3= 4.23, r4= 4.73,  &end
#
#   33 LEU  HG      33 LEU  HN     3.670   (#SUP   6.98 )
 &rst
  ixpk= 6, nxpk= 0, iat= 540, 533, r1= 1.30, r2= 1.80, r3= 3.67, r4= 4.17,  &end
#
#   33 LEU  HG      34 GLN  HN     4.840   (#SUP   6.22 )
 &rst
  ixpk= 6, nxpk= 0, iat= 540, 552, r1= 1.30, r2= 1.80, r3= 4.84, r4= 5.34,  &end
#
#   33 LEU  HN      33 LEU  QD1    4.580   (#SUP   7.54 )
 &rst
  ixpk= 7, nxpk= 0, iat= 533,  -1, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,
 igr2= 542, 543, 544,
 &end
#
#   33 LEU  HN      33 LEU  QD2    4.240   (#SUP   7.04 )
 &rst
  ixpk= 7, nxpk= 0, iat= 533,  -1, r1= 1.30, r2= 1.80, r3= 5.09, r4= 5.59,
 igr2= 546, 547, 548,
 &end
#
#   33 LEU  HN      34 GLN  HN     3.750   (#SUP   6.84 )
 &rst
  ixpk= 6, nxpk= 0, iat= 533, 552, r1= 1.30, r2= 1.80, r3= 3.75, r4= 4.25,  &end
#
#   33 LEU  QD1     34 GLN  HN     4.530   (#SUP   7.96 )
 &rst
  ixpk= 7, nxpk= 0, iat=  -1, 552, r1= 1.30, r2= 1.80, r3= 5.44, r4= 5.94,
 igr1= 542, 543, 544,
 &end
#
#   33 LEU  QD2     34 GLN  HN     5.500   (#SUP   6.31 )
 &rst
  ixpk= 6, nxpk= 0, iat=  -1, 552, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr1= 546, 547, 548,
 &end
#
#   34 GLN  HN      35 GLN  HN     3.780   (#SUP   2.12 )
 &rst
  ixpk= 2, nxpk= 0, iat= 552, 569, r1= 1.30, r2= 1.80, r3= 3.78, r4= 4.28,  &end
#
#   35 GLN  HA      35 GLN  HN     3.590   (#SUP   3.95 )
 &rst
  ixpk= 3, nxpk= 0, iat= 571, 569, r1= 1.30, r2= 1.80, r3= 3.59, r4= 4.09,  &end
#
#   35 GLN  HA      36 ILE  HN     4.370   (#SUP   5.88 )
 &rst
  ixpk= 5, nxpk= 0, iat= 571, 586, r1= 1.30, r2= 1.80, r3= 4.37, r4= 4.87,  &end
#
#   35 GLN  HA      37 GLY  HN     4.220   (#SUP   5.23 )
 &rst
  ixpk= 5, nxpk= 0, iat= 571, 605, r1= 1.30, r2= 1.80, r3= 4.22, r4= 4.72,  &end
#
#   35 GLN  HA      38 ARG+ HN     4.160   (#SUP   5.66 )
 &rst
  ixpk= 5, nxpk= 0, iat= 571, 612, r1= 1.30, r2= 1.80, r3= 4.16, r4= 4.66,  &end
#
#   35 GLN  HA      39 GLU- HN     5.270   (#SUP   2.40 )
 &rst
  ixpk= 2, nxpk= 0, iat= 571, 636, r1= 1.30, r2= 1.80, r3= 5.27, r4= 5.77,  &end
#
#   35 GLN  HE21    35 GLN  HE22   2.950   (#SUP   2.00 )
 &rst
  ixpk= 2, nxpk= 0, iat= 581, 582, r1= 1.30, r2= 1.80, r3= 2.95, r4= 3.45,  &end
#
#   35 GLN  HE21    35 GLN  QB     5.450   (#SUP   3.03 )
 &rst
  ixpk= 3, nxpk= 0, iat= 581,  -1, r1= 1.30, r2= 1.80, r3= 6.12, r4= 6.62,
 igr2= 573, 574,
 &end
#
#   35 GLN  HE21    35 GLN  QG     3.880   (#SUP   3.01 )
 &rst
  ixpk= 3, nxpk= 0, iat= 581,  -1, r1= 1.30, r2= 1.80, r3= 4.36, r4= 4.86,
 igr2= 576, 577,
 &end
#
#   35 GLN  HE22    35 GLN  QB     5.190   (#SUP   3.03 )
 &rst
  ixpk= 3, nxpk= 0, iat= 582,  -1, r1= 1.30, r2= 1.80, r3= 5.83, r4= 6.33,
 igr2= 573, 574,
 &end
#
#   35 GLN  HE22    35 GLN  QG     4.080   (#SUP   3.01 )
 &rst
  ixpk= 3, nxpk= 0, iat= 582,  -1, r1= 1.30, r2= 1.80, r3= 4.58, r4= 5.08,
 igr2= 576, 577,
 &end
#
#   35 GLN  HN      35 GLN  QB     3.170   (#SUP   4.61 )
 &rst
  ixpk= 4, nxpk= 0, iat= 569,  -1, r1= 1.30, r2= 1.80, r3= 3.56, r4= 4.06,
 igr2= 573, 574,
 &end
#
#   35 GLN  HN      35 GLN  QG     3.830   (#SUP   4.61 )
 &rst
  ixpk= 4, nxpk= 0, iat= 569,  -1, r1= 1.30, r2= 1.80, r3= 4.30, r4= 4.80,
 igr2= 576, 577,
 &end
#
#   35 GLN  HN      36 ILE  HA     5.500   (#SUP   5.58 )
 &rst
  ixpk= 5, nxpk= 0, iat= 569, 588, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   35 GLN  HN      36 ILE  HB     4.400   (#SUP   4.98 )
 &rst
  ixpk= 4, nxpk= 0, iat= 569, 590, r1= 1.30, r2= 1.80, r3= 4.40, r4= 4.90,  &end
#
#   35 GLN  HN      36 ILE  HN     3.790   (#SUP   6.96 )
 &rst
  ixpk= 6, nxpk= 0, iat= 569, 586, r1= 1.30, r2= 1.80, r3= 3.79, r4= 4.29,  &end
#
#   35 GLN  HN      37 GLY  HN     5.230   (#SUP   4.94 )
 &rst
  ixpk= 4, nxpk= 0, iat= 569, 605, r1= 1.30, r2= 1.80, r3= 5.23, r4= 5.73,  &end
#
#   35 GLN  QB      36 ILE  HN     3.870   (#SUP   6.53 )
 &rst
  ixpk= 6, nxpk= 0, iat=  -1, 586, r1= 1.30, r2= 1.80, r3= 4.34, r4= 4.84,
 igr1= 573, 574,
 &end
#
#   35 GLN  QB      37 GLY  HN     5.480   (#SUP   3.34 )
 &rst
  ixpk= 3, nxpk= 0, iat=  -1, 605, r1= 1.30, r2= 1.80, r3= 6.15, r4= 6.65,
 igr1= 573, 574,
 &end
#
#   35 GLN  QG      36 ILE  HN     4.900   (#SUP   5.49 )
 &rst
  ixpk= 5, nxpk= 0, iat=  -1, 586, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,
 igr1= 576, 577,
 &end
#
#   36 ILE  HA      36 ILE  HN     4.070   (#SUP   7.89 )
 &rst
  ixpk= 7, nxpk= 0, iat= 588, 586, r1= 1.30, r2= 1.80, r3= 4.07, r4= 4.57,  &end
#
#   36 ILE  HA      39 GLU- HN     4.490   (#SUP   2.31 )
 &rst
  ixpk= 2, nxpk= 0, iat= 588, 636, r1= 1.30, r2= 1.80, r3= 4.49, r4= 4.99,  &end
#
#   36 ILE  HA      40 ASN  HN     4.360   (#SUP   2.00 )
 &rst
  ixpk= 2, nxpk= 0, iat= 588, 651, r1= 1.30, r2= 1.80, r3= 4.36, r4= 4.86,  &end
#
#   36 ILE  HB      36 ILE  HN     3.580   (#SUP   7.86 )
 &rst
  ixpk= 7, nxpk= 0, iat= 590, 586, r1= 1.30, r2= 1.80, r3= 3.58, r4= 4.08,  &end
#
#   36 ILE  HB      37 GLY  HN     3.570   (#SUP   5.59 )
 &rst
  ixpk= 5, nxpk= 0, iat= 590, 605, r1= 1.30, r2= 1.80, r3= 3.57, r4= 4.07,  &end
#
#   36 ILE  HG12    36 ILE  HN     3.670   (#SUP   6.68 )
 &rst
  ixpk= 6, nxpk= 0, iat= 596, 586, r1= 1.30, r2= 1.80, r3= 3.67, r4= 4.17,  &end
#
#   36 ILE  HG13    36 ILE  HN     4.850   (#SUP   6.78 )
 &rst
  ixpk= 6, nxpk= 0, iat= 597, 586, r1= 1.30, r2= 1.80, r3= 4.85, r4= 5.35,  &end
#
#   36 ILE  HN      36 ILE  QD1    3.920   (#SUP   6.06 )
 &rst
  ixpk= 6, nxpk= 0, iat= 586,  -1, r1= 1.30, r2= 1.80, r3= 4.71, r4= 5.21,
 igr2= 599, 600, 601,
 &end
#
#   36 ILE  HN      36 ILE  QG2    4.460   (#SUP   6.65 )
 &rst
  ixpk= 6, nxpk= 0, iat= 586,  -1, r1= 1.30, r2= 1.80, r3= 5.36, r4= 5.86,
 igr2= 592, 593, 594,
 &end
#
#   36 ILE  HN      37 GLY  HN     3.900   (#SUP   8.53 )
 &rst
  ixpk= 8, nxpk= 0, iat= 586, 605, r1= 1.30, r2= 1.80, r3= 3.90, r4= 4.40,  &end
#
#   36 ILE  HN      38 ARG+ HN     5.500   (#SUP   2.99 )
 &rst
  ixpk= 2, nxpk= 0, iat= 586, 612, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   36 ILE  QG2     37 GLY  HN     4.070   (#SUP   5.21 )
 &rst
  ixpk= 5, nxpk= 0, iat=  -1, 605, r1= 1.30, r2= 1.80, r3= 4.89, r4= 5.39,
 igr1= 592, 593, 594,
 &end
#
#   36 ILE  QG2     40 ASN  HN     4.690   (#SUP   2.96 )
 &rst
  ixpk= 2, nxpk= 0, iat=  -1, 651, r1= 1.30, r2= 1.80, r3= 5.63, r4= 6.13,
 igr1= 592, 593, 594,
 &end
#
#   36 ILE  QG2     43 LEU  HN     4.870   (#SUP   2.61 )
 &rst
  ixpk= 2, nxpk= 0, iat=  -1, 696, r1= 1.30, r2= 1.80, r3= 5.85, r4= 6.35,
 igr1= 592, 593, 594,
 &end
#
#   37 GLY  HA2     37 GLY  HN     3.400   (#SUP   3.02 )
 &rst
  ixpk= 3, nxpk= 0, iat= 607, 605, r1= 1.30, r2= 1.80, r3= 3.40, r4= 3.90,  &end
#
#   37 GLY  HA2     38 ARG+ HN     4.100   (#SUP   3.45 )
 &rst
  ixpk= 3, nxpk= 0, iat= 607, 612, r1= 1.30, r2= 1.80, r3= 4.10, r4= 4.60,  &end
#
#   37 GLY  HA3     37 GLY  HN     3.490   (#SUP   3.02 )
 &rst
  ixpk= 3, nxpk= 0, iat= 608, 605, r1= 1.30, r2= 1.80, r3= 3.49, r4= 3.99,  &end
#
#   37 GLY  HA3     38 ARG+ HN     4.080   (#SUP   3.45 )
 &rst
  ixpk= 3, nxpk= 0, iat= 608, 612, r1= 1.30, r2= 1.80, r3= 4.08, r4= 4.58,  &end
#
#   37 GLY  HN      38 ARG+ HN     3.790   (#SUP   5.18 )
 &rst
  ixpk= 5, nxpk= 0, iat= 605, 612, r1= 1.30, r2= 1.80, r3= 3.79, r4= 4.29,  &end
#
#   37 GLY  HN      39 GLU- HN     4.800   (#SUP   2.49 )
 &rst
  ixpk= 2, nxpk= 0, iat= 605, 636, r1= 1.30, r2= 1.80, r3= 4.80, r4= 5.30,  &end
#
#   37 GLY  HN      44 LEU  HB3    4.710   (#SUP   3.69 )
 &rst
  ixpk= 3, nxpk= 0, iat= 605, 720, r1= 1.30, r2= 1.80, r3= 4.71, r4= 5.21,  &end
#
#   37 GLY  HN      44 LEU  QD1    3.790   (#SUP   2.96 )
 &rst
  ixpk= 2, nxpk= 0, iat= 605,  -1, r1= 1.30, r2= 1.80, r3= 4.55, r4= 5.05,
 igr2= 724, 725, 726,
 &end
#
#   38 ARG+ HA      38 ARG+ HN     3.710   (#SUP   5.05 )
 &rst
  ixpk= 5, nxpk= 0, iat= 614, 612, r1= 1.30, r2= 1.80, r3= 3.71, r4= 4.21,  &end
#
#   38 ARG+ HA      39 GLU- HN     4.370   (#SUP   4.75 )
 &rst
  ixpk= 4, nxpk= 0, iat= 614, 636, r1= 1.30, r2= 1.80, r3= 4.37, r4= 4.87,  &end
#
#   38 ARG+ HG2     38 ARG+ HN     3.640   (#SUP   5.84 )
 &rst
  ixpk= 5, nxpk= 0, iat= 619, 612, r1= 1.30, r2= 1.80, r3= 3.64, r4= 4.14,  &end
#
#   38 ARG+ HG2     39 GLU- HN     5.140   (#SUP   5.54 )
 &rst
  ixpk= 5, nxpk= 0, iat= 619, 636, r1= 1.30, r2= 1.80, r3= 5.14, r4= 5.64,  &end
#
#   38 ARG+ HG3     38 ARG+ HN     3.940   (#SUP   5.14 )
 &rst
  ixpk= 5, nxpk= 0, iat= 620, 612, r1= 1.30, r2= 1.80, r3= 3.94, r4= 4.44,  &end
#
#   38 ARG+ HN      38 ARG+ QB     3.050   (#SUP   5.14 )
 &rst
  ixpk= 5, nxpk= 0, iat= 612,  -1, r1= 1.30, r2= 1.80, r3= 3.42, r4= 3.92,
 igr2= 616, 617,
 &end
#
#   38 ARG+ HN      39 GLU- HN     3.550   (#SUP   6.13 )
 &rst
  ixpk= 6, nxpk= 0, iat= 612, 636, r1= 1.30, r2= 1.80, r3= 3.55, r4= 4.05,  &end
#
#   38 ARG+ HN      40 ASN  HN     4.770   (#SUP   1.89 )
 &rst
  ixpk= 1, nxpk= 0, iat= 612, 651, r1= 1.30, r2= 1.80, r3= 4.77, r4= 5.27,  &end
#
#   39 GLU- HA      39 GLU- HN     3.860   (#SUP   6.06 )
 &rst
  ixpk= 6, nxpk= 0, iat= 638, 636, r1= 1.30, r2= 1.80, r3= 3.86, r4= 4.36,  &end
#
#   39 GLU- HA      40 ASN  HN     4.600   (#SUP   5.28 )
 &rst
  ixpk= 5, nxpk= 0, iat= 638, 651, r1= 1.30, r2= 1.80, r3= 4.60, r4= 5.10,  &end
#
#   39 GLU- HB2     39 GLU- HN     3.970   (#SUP   6.06 )
 &rst
  ixpk= 6, nxpk= 0, iat= 640, 636, r1= 1.30, r2= 1.80, r3= 3.97, r4= 4.47,  &end
#
#   39 GLU- HB2     40 ASN  HN     4.560   (#SUP   5.28 )
 &rst
  ixpk= 5, nxpk= 0, iat= 640, 651, r1= 1.30, r2= 1.80, r3= 4.56, r4= 5.06,  &end
#
#   39 GLU- HB3     39 GLU- HN     3.290   (#SUP   6.06 )
 &rst
  ixpk= 6, nxpk= 0, iat= 641, 636, r1= 1.30, r2= 1.80, r3= 3.29, r4= 3.79,  &end
#
#   39 GLU- HB3     40 ASN  HN     4.050   (#SUP   5.28 )
 &rst
  ixpk= 5, nxpk= 0, iat= 641, 651, r1= 1.30, r2= 1.80, r3= 4.05, r4= 4.55,  &end
#
#   39 GLU- HG2     39 GLU- HN     3.880   (#SUP   5.47 )
 &rst
  ixpk= 5, nxpk= 0, iat= 643, 636, r1= 1.30, r2= 1.80, r3= 3.88, r4= 4.38,  &end
#
#   39 GLU- HG3     39 GLU- HN     4.190   (#SUP   5.47 )
 &rst
  ixpk= 5, nxpk= 0, iat= 644, 636, r1= 1.30, r2= 1.80, r3= 4.19, r4= 4.69,  &end
#
#   39 GLU- HN      40 ASN  HN     3.470   (#SUP   6.57 )
 &rst
  ixpk= 6, nxpk= 0, iat= 636, 651, r1= 1.30, r2= 1.80, r3= 3.47, r4= 3.97,  &end
#
#   39 GLU- HN      41 PRO  HD2    5.500   (#SUP   1.43 )
 &rst
  ixpk= 1, nxpk= 0, iat= 636, 666, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   40 ASN  HA      40 ASN  HD21   5.500   (#SUP   3.64 )
 &rst
  ixpk= 3, nxpk= 0, iat= 653, 660, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   40 ASN  HA      40 ASN  HN     4.130   (#SUP   5.15 )
 &rst
  ixpk= 5, nxpk= 0, iat= 653, 651, r1= 1.30, r2= 1.80, r3= 4.13, r4= 4.63,  &end
#
#   40 ASN  HB2     40 ASN  HD21   4.330   (#SUP   3.31 )
 &rst
  ixpk= 3, nxpk= 0, iat= 655, 660, r1= 1.30, r2= 1.80, r3= 4.33, r4= 4.83,  &end
#
#   40 ASN  HB2     40 ASN  HD22   4.460   (#SUP   2.61 )
 &rst
  ixpk= 2, nxpk= 0, iat= 655, 661, r1= 1.30, r2= 1.80, r3= 4.46, r4= 4.96,  &end
#
#   40 ASN  HB2     40 ASN  HN     4.320   (#SUP   4.31 )
 &rst
  ixpk= 4, nxpk= 0, iat= 655, 651, r1= 1.30, r2= 1.80, r3= 4.32, r4= 4.82,  &end
#
#   40 ASN  HB2     43 LEU  HN     4.430   (#SUP   4.88 )
 &rst
  ixpk= 4, nxpk= 0, iat= 655, 696, r1= 1.30, r2= 1.80, r3= 4.43, r4= 4.93,  &end
#
#   40 ASN  HB3     40 ASN  HD21   4.130   (#SUP   3.31 )
 &rst
  ixpk= 3, nxpk= 0, iat= 656, 660, r1= 1.30, r2= 1.80, r3= 4.13, r4= 4.63,  &end
#
#   40 ASN  HB3     40 ASN  HD22   4.140   (#SUP   2.61 )
 &rst
  ixpk= 2, nxpk= 0, iat= 656, 661, r1= 1.30, r2= 1.80, r3= 4.14, r4= 4.64,  &end
#
#   40 ASN  HB3     40 ASN  HN     4.220   (#SUP   4.31 )
 &rst
  ixpk= 4, nxpk= 0, iat= 656, 651, r1= 1.30, r2= 1.80, r3= 4.22, r4= 4.72,  &end
#
#   40 ASN  HB3     43 LEU  HN     5.160   (#SUP   2.96 )
 &rst
  ixpk= 2, nxpk= 0, iat= 656, 696, r1= 1.30, r2= 1.80, r3= 5.16, r4= 5.66,  &end
#
#   40 ASN  HD21    40 ASN  HD22   2.760   (#SUP   2.31 )
 &rst
  ixpk= 2, nxpk= 0, iat= 660, 661, r1= 1.30, r2= 1.80, r3= 2.76, r4= 3.26,  &end
#
#   40 ASN  HD21    43 LEU  HB3    4.820   (#SUP   2.85 )
 &rst
  ixpk= 2, nxpk= 0, iat= 660, 701, r1= 1.30, r2= 1.80, r3= 4.82, r4= 5.32,  &end
#
#   40 ASN  HD21    43 LEU  QD2    5.070   (#SUP   2.86 )
 &rst
  ixpk= 2, nxpk= 0, iat= 660,  -1, r1= 1.30, r2= 1.80, r3= 6.09, r4= 6.59,
 igr2= 709, 710, 711,
 &end
#
#   40 ASN  HD22    43 LEU  HB3    4.680   (#SUP   3.90 )
 &rst
  ixpk= 3, nxpk= 0, iat= 661, 701, r1= 1.30, r2= 1.80, r3= 4.68, r4= 5.18,  &end
#
#   40 ASN  HD22    43 LEU  HN     5.500   (#SUP   3.94 )
 &rst
  ixpk= 3, nxpk= 0, iat= 661, 696, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   40 ASN  HD22    43 LEU  QD2    5.500   (#SUP   3.94 )
 &rst
  ixpk= 3, nxpk= 0, iat= 661,  -1, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr2= 709, 710, 711,
 &end
#
#   40 ASN  HN      41 PRO  HD2    4.510   (#SUP   4.12 )
 &rst
  ixpk= 4, nxpk= 0, iat= 651, 666, r1= 1.30, r2= 1.80, r3= 4.51, r4= 5.01,  &end
#
#   41 PRO  HA      42 GLN  HN     4.810   (#SUP   5.85 )
 &rst
  ixpk= 5, nxpk= 0, iat= 675, 679, r1= 1.30, r2= 1.80, r3= 4.81, r4= 5.31,  &end
#
#   41 PRO  HB3     42 GLN  HN     4.900   (#SUP   6.19 )
 &rst
  ixpk= 6, nxpk= 0, iat= 673, 679, r1= 1.30, r2= 1.80, r3= 4.90, r4= 5.40,  &end
#
#   41 PRO  HD2     42 GLN  HN     4.680   (#SUP   5.25 )
 &rst
  ixpk= 5, nxpk= 0, iat= 666, 679, r1= 1.30, r2= 1.80, r3= 4.68, r4= 5.18,  &end
#
#   41 PRO  HD3     42 GLN  HN     5.230   (#SUP   6.58 )
 &rst
  ixpk= 6, nxpk= 0, iat= 667, 679, r1= 1.30, r2= 1.80, r3= 5.23, r4= 5.73,  &end
#
#   42 GLN  HA      42 GLN  HN     4.050   (#SUP   5.41 )
 &rst
  ixpk= 5, nxpk= 0, iat= 681, 679, r1= 1.30, r2= 1.80, r3= 4.05, r4= 4.55,  &end
#
#   42 GLN  HA      43 LEU  HN     4.510   (#SUP   5.52 )
 &rst
  ixpk= 5, nxpk= 0, iat= 681, 696, r1= 1.30, r2= 1.80, r3= 4.51, r4= 5.01,  &end
#
#   42 GLN  HA      45 GLN  HN     4.200   (#SUP   0.87 )
 &rst
  ixpk= 0, nxpk= 0, iat= 681, 734, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,  &end
#
#   42 GLN  HB2     42 GLN  HN     3.790   (#SUP   4.98 )
 &rst
  ixpk= 4, nxpk= 0, iat= 683, 679, r1= 1.30, r2= 1.80, r3= 3.79, r4= 4.29,  &end
#
#   42 GLN  HB2     43 LEU  HN     4.100   (#SUP   6.45 )
 &rst
  ixpk= 6, nxpk= 0, iat= 683, 696, r1= 1.30, r2= 1.80, r3= 4.10, r4= 4.60,  &end
#
#   42 GLN  HB2     44 LEU  HN     4.150   (#SUP   2.57 )
 &rst
  ixpk= 2, nxpk= 0, iat= 683, 715, r1= 1.30, r2= 1.80, r3= 4.684, r4= 5.18,  &end
#
#   42 GLN  HB2     46 GLN  HE21   5.500   (#SUP   0.75 )
 &rst
  ixpk= 0, nxpk= 0, iat= 683, 763, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   42 GLN  HB2     46 GLN  HE22   5.500   (#SUP   0.75 )
 &rst
  ixpk= 0, nxpk= 0, iat= 683, 764, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   42 GLN  HB3     42 GLN  HN     3.840   (#SUP   5.31 )
 &rst
  ixpk= 5, nxpk= 0, iat= 684, 679, r1= 1.30, r2= 1.80, r3= 3.84, r4= 4.34,  &end
#
#   42 GLN  HB3     43 LEU  HN     4.180   (#SUP   5.42 )
 &rst
  ixpk= 5, nxpk= 0, iat= 684, 696, r1= 1.30, r2= 1.80, r3= 4.18, r4= 4.68,  &end
#
#   42 GLN  HN      42 GLN  QG     4.120   (#SUP   5.31 )
 &rst
  ixpk= 5, nxpk= 0, iat= 679,  -1, r1= 1.30, r2= 1.80, r3= 4.62, r4= 5.12,
 igr2= 686, 687,
 &end
#
#   42 GLN  HN      43 LEU  HN     3.930   (#SUP   5.52 )
 &rst
  ixpk= 5, nxpk= 0, iat= 679, 696, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,  &end
#
#   42 GLN  QG      43 LEU  HN     4.320   (#SUP   6.44 )
 &rst
  ixpk= 6, nxpk= 0, iat=  -1, 696, r1= 1.30, r2= 1.80, r3= 4.85, r4= 5.35,
 igr1= 686, 687,
 &end
#
#   42 GLN  QG      44 LEU  HN     5.060   (#SUP   2.64 )
 &rst
  ixpk= 2, nxpk= 0, iat=  -1, 715, r1= 1.30, r2= 1.80, r3= 5.68, r4= 6.18,
 igr1= 686, 687,
 &end
#
#   43 LEU  HA      43 LEU  HN     3.810   (#SUP   6.65 )
 &rst
  ixpk= 6, nxpk= 0, iat= 698, 696, r1= 1.30, r2= 1.80, r3= 3.81, r4= 4.31,  &end
#
#   43 LEU  HA      44 LEU  HN     4.010   (#SUP   7.07 )
 &rst
  ixpk= 7, nxpk= 0, iat= 698, 715, r1= 1.30, r2= 1.80, r3= 4.01, r4= 4.51,  &end
#
#   43 LEU  HA      45 GLN  HN     4.970   (#SUP   5.18 )
 &rst
  ixpk= 5, nxpk= 0, iat= 698, 734, r1= 1.30, r2= 1.80, r3= 4.97, r4= 5.47,  &end
#
#   43 LEU  HA      46 GLN  HN     4.270   (#SUP   6.23 )
 &rst
  ixpk= 6, nxpk= 0, iat= 698, 751, r1= 1.30, r2= 1.80, r3= 4.27, r4= 4.77,  &end
#
#   43 LEU  HA      47 ILE  HN     5.500   (#SUP   4.54 )
 &rst
  ixpk= 4, nxpk= 0, iat= 698, 768, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   43 LEU  HB2     43 LEU  HN     3.500   (#SUP   6.99 )
 &rst
  ixpk= 6, nxpk= 0, iat= 700, 696, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   43 LEU  HB2     44 LEU  HN     3.850   (#SUP   6.09 )
 &rst
  ixpk= 6, nxpk= 0, iat= 700, 715, r1= 1.30, r2= 1.80, r3= 3.85, r4= 4.35,  &end
#
#   43 LEU  HB3     43 LEU  HN     3.390   (#SUP   6.65 )
 &rst
  ixpk= 6, nxpk= 0, iat= 701, 696, r1= 1.30, r2= 1.80, r3= 3.39, r4= 3.89,  &end
#
#   43 LEU  HB3     44 LEU  HN     4.290   (#SUP   5.30 )
 &rst
  ixpk= 5, nxpk= 0, iat= 701, 715, r1= 1.30, r2= 1.80, r3= 4.29, r4= 4.79,  &end
#
#   43 LEU  HN      43 LEU  QD1    4.480   (#SUP   6.50 )
 &rst
  ixpk= 6, nxpk= 0, iat= 696,  -1, r1= 1.30, r2= 1.80, r3= 5.38, r4= 5.88,
 igr2= 705, 706, 707,
 &end
#
#   43 LEU  HN      43 LEU  QD2    4.380   (#SUP   6.41 )
 &rst
  ixpk= 6, nxpk= 0, iat= 696,  -1, r1= 1.30, r2= 1.80, r3= 5.26, r4= 5.76,
 igr2= 709, 710, 711,
 &end
#
#   43 LEU  HN      44 LEU  HN     3.760   (#SUP   7.22 )
 &rst
  ixpk= 7, nxpk= 0, iat= 696, 715, r1= 1.30, r2= 1.80, r3= 3.76, r4= 4.26,  &end
#
#   43 LEU  HN      45 GLN  HN     5.030   (#SUP   3.81 )
 &rst
  ixpk= 3, nxpk= 0, iat= 696, 734, r1= 1.30, r2= 1.80, r3= 5.03, r4= 5.53,  &end
#
#   43 LEU  QD1     46 GLN  HN     4.290   (#SUP   5.78 )
 &rst
  ixpk= 5, nxpk= 0, iat=  -1, 751, r1= 1.30, r2= 1.80, r3= 5.15, r4= 5.65,
 igr1= 705, 706, 707,
 &end
#
#   43 LEU  QD1     47 ILE  HN     5.080   (#SUP   6.38 )
 &rst
  ixpk= 6, nxpk= 0, iat=  -1, 768, r1= 1.30, r2= 1.80, r3= 6.10, r4= 6.60,
 igr1= 705, 706, 707,
 &end
#
#   44 LEU  HA      44 LEU  HN     3.960   (#SUP   6.27 )
 &rst
  ixpk= 6, nxpk= 0, iat= 717, 715, r1= 1.30, r2= 1.80, r3= 3.96, r4= 4.46,  &end
#
#   44 LEU  HA      47 ILE  HN     4.130   (#SUP   4.58 )
 &rst
  ixpk= 4, nxpk= 0, iat= 717, 768, r1= 1.30, r2= 1.80, r3= 4.13, r4= 4.63,  &end
#
#   44 LEU  HB2     45 GLN  HN     3.320   (#SUP   8.11 )
 &rst
  ixpk= 8, nxpk= 0, iat= 719, 734, r1= 1.30, r2= 1.80, r3= 3.32, r4= 3.82,  &end
#
#   44 LEU  HB2     46 GLN  HN     4.580   (#SUP   3.04 )
 &rst
  ixpk= 3, nxpk= 0, iat= 719, 751, r1= 1.30, r2= 1.80, r3= 5.450, r4= 5.95,  &end
#
#   44 LEU  HB3     44 LEU  HN     3.760   (#SUP   6.48 )
 &rst
  ixpk= 6, nxpk= 0, iat= 720, 715, r1= 1.30, r2= 1.80, r3= 3.76, r4= 4.26,  &end
#
#   44 LEU  HB3     45 GLN  HN     4.190   (#SUP   7.34 )
 &rst
  ixpk= 7, nxpk= 0, iat= 720, 734, r1= 1.30, r2= 1.80, r3= 4.19, r4= 4.69,  &end
#
#   44 LEU  HG      45 GLN  HN     4.320   (#SUP   6.68 )
 &rst
  ixpk= 6, nxpk= 0, iat= 722, 734, r1= 1.30, r2= 1.80, r3= 4.533, r4= 4.82,  &end
#
#   44 LEU  HN      44 LEU  QD2    4.200   (#SUP   6.19 )
 &rst
  ixpk= 6, nxpk= 0, iat= 715,  -1, r1= 1.30, r2= 1.80, r3= 5.04, r4= 5.54,
 igr2= 728, 729, 730,
 &end
#
#   44 LEU  HN      45 GLN  HN     3.750   (#SUP   8.52 )
 &rst
  ixpk= 8, nxpk= 0, iat= 715, 734, r1= 1.30, r2= 1.80, r3= 3.75, r4= 4.25,  &end
#
#   44 LEU  HN      46 GLN  HN     4.780   (#SUP   4.07 )
 &rst
  ixpk= 4, nxpk= 0, iat= 715, 751, r1= 1.30, r2= 1.80, r3= 4.78, r4= 5.28,  &end
#
#   44 LEU  QD1     45 GLN  HN     4.310   (#SUP   6.49 )
 &rst
  ixpk= 6, nxpk= 0, iat=  -1, 734, r1= 1.30, r2= 1.80, r3= 5.18, r4= 5.68,
 igr1= 724, 725, 726,
 &end
#
#   44 LEU  QD2     47 ILE  HN     5.020   (#SUP   4.87 )
 &rst
  ixpk= 4, nxpk= 0, iat=  -1, 768, r1= 1.30, r2= 1.80, r3= 6.03, r4= 6.53,
 igr1= 728, 729, 730,
 &end
#
#   44 LEU  QD2     48 SER  HN     4.540   (#SUP   3.61 )
 &rst
  ixpk= 3, nxpk= 0, iat=  -1, 787, r1= 1.30, r2= 1.80, r3= 5.45, r4= 5.95,
 igr1= 728, 729, 730,
 &end
#
#   45 GLN  HA      45 GLN  HN     3.640   (#SUP   6.25 )
 &rst
  ixpk= 6, nxpk= 0, iat= 736, 734, r1= 1.30, r2= 1.80, r3= 3.64, r4= 4.14,  &end
#
#   45 GLN  HA      46 GLN  HN     4.200   (#SUP   4.74 )
 &rst
  ixpk= 4, nxpk= 0, iat= 736, 751, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,  &end
#
#   45 GLN  HG2     45 GLN  HN     3.910   (#SUP   5.13 )
 &rst
  ixpk= 5, nxpk= 0, iat= 741, 734, r1= 1.30, r2= 1.80, r3= 3.91, r4= 4.41,  &end
#
#   45 GLN  HG3     45 GLN  HN     4.140   (#SUP   4.97 )
 &rst
  ixpk= 4, nxpk= 0, iat= 742, 734, r1= 1.30, r2= 1.80, r3= 4.14, r4= 4.64,  &end
#
#   45 GLN  HN      45 GLN  QB     3.080   (#SUP   6.17 )
 &rst
  ixpk= 6, nxpk= 0, iat= 734,  -1, r1= 1.30, r2= 1.80, r3= 3.46, r4= 3.96,
 igr2= 738, 739,
 &end
#
#   45 GLN  HN      46 GLN  HN     3.650   (#SUP   5.97 )
 &rst
  ixpk= 5, nxpk= 0, iat= 734, 751, r1= 1.30, r2= 1.80, r3= 3.65, r4= 4.15,  &end
#
#   45 GLN  HN      48 SER  HN     5.500   (#SUP   1.38 )
 &rst
  ixpk= 1, nxpk= 0, iat= 734, 787, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   45 GLN  QB      46 GLN  HN     3.670   (#SUP   4.71 )
 &rst
  ixpk= 4, nxpk= 0, iat=  -1, 751, r1= 1.30, r2= 1.80, r3= 4.12, r4= 4.62,
 igr1= 738, 739,
 &end
#
#   46 GLN  HA      46 GLN  HE21   5.500   (#SUP   3.93 )
 &rst
  ixpk= 3, nxpk= 0, iat= 753, 763, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   46 GLN  HA      46 GLN  HN     3.720   (#SUP   6.83 )
 &rst
  ixpk= 6, nxpk= 0, iat= 753, 751, r1= 1.30, r2= 1.80, r3= 3.72, r4= 4.22,  &end
#
#   46 GLN  HA      47 ILE  HN     4.740   (#SUP   5.47 )
 &rst
  ixpk= 5, nxpk= 0, iat= 753, 768, r1= 1.30, r2= 1.80, r3= 4.74, r4= 5.24,  &end
#
#   46 GLN  HA      49 GLN  HN     5.500   (#SUP   1.50 )
 &rst
  ixpk= 1, nxpk= 0, iat= 753, 798, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   46 GLN  HB2     46 GLN  HN     3.540   (#SUP   6.09 )
 &rst
  ixpk= 6, nxpk= 0, iat= 755, 751, r1= 1.30, r2= 1.80, r3= 3.54, r4= 4.04,  &end
#
#   46 GLN  HB2     47 ILE  HN     4.270   (#SUP   4.34 )
 &rst
  ixpk= 4, nxpk= 0, iat= 755, 768, r1= 1.30, r2= 1.80, r3= 4.27, r4= 4.77,  &end
#
#   46 GLN  HB3     46 GLN  HN     3.830   (#SUP   6.28 )
 &rst
  ixpk= 6, nxpk= 0, iat= 756, 751, r1= 1.30, r2= 1.80, r3= 3.83, r4= 4.33,  &end
#
#   46 GLN  HB3     47 ILE  HN     4.570   (#SUP   5.01 )
 &rst
  ixpk= 5, nxpk= 0, iat= 756, 768, r1= 1.30, r2= 1.80, r3= 4.57, r4= 5.07,  &end
#
#   46 GLN  HB3     48 SER  HN     5.230   (#SUP   2.59 )
 &rst
  ixpk= 2, nxpk= 0, iat= 756, 787, r1= 1.30, r2= 1.80, r3= 5.35, r4= 5.73,  &end
#
#   46 GLN  HE21    46 GLN  HE22   2.880   (#SUP   2.31 )
 &rst
  ixpk= 2, nxpk= 0, iat= 763, 764, r1= 1.30, r2= 1.80, r3= 2.88, r4= 3.38,  &end
#
#   46 GLN  HE21    46 GLN  HG2    5.320   (#SUP   3.63 )
 &rst
  ixpk= 3, nxpk= 0, iat= 763, 758, r1= 1.30, r2= 1.80, r3= 5.32, r4= 5.82,  &end
#
#   46 GLN  HE21    46 GLN  HG3    4.640   (#SUP   3.26 )
 &rst
  ixpk= 3, nxpk= 0, iat= 763, 759, r1= 1.30, r2= 1.80, r3= 4.64, r4= 5.14,  &end
#
#   46 GLN  HE22    46 GLN  HG2    5.360   (#SUP   2.95 )
 &rst
  ixpk= 2, nxpk= 0, iat= 764, 758, r1= 1.30, r2= 1.80, r3= 5.36, r4= 5.86,  &end
#
#   46 GLN  HE22    46 GLN  HG3    5.500   (#SUP   2.59 )
 &rst
  ixpk= 2, nxpk= 0, iat= 764, 759, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   46 GLN  HG2     46 GLN  HN     3.820   (#SUP   6.40 )
 &rst
  ixpk= 6, nxpk= 0, iat= 758, 751, r1= 1.30, r2= 1.80, r3= 3.82, r4= 4.32,  &end
#
#   46 GLN  HG3     46 GLN  HN     3.810   (#SUP   6.31 )
 &rst
  ixpk= 6, nxpk= 0, iat= 759, 751, r1= 1.30, r2= 1.80, r3= 3.81, r4= 4.31,  &end
#
#   46 GLN  HN      47 ILE  HB     4.630   (#SUP   5.38 )
 &rst
  ixpk= 5, nxpk= 0, iat= 751, 772, r1= 1.30, r2= 1.80, r3= 4.63, r4= 5.13,  &end
#
#   46 GLN  HN      47 ILE  HN     3.850   (#SUP   6.52 )
 &rst
  ixpk= 6, nxpk= 0, iat= 751, 768, r1= 1.30, r2= 1.80, r3= 3.85, r4= 4.35,  &end
#
#   46 GLN  HN      47 ILE  QD1    5.500   (#SUP   5.42 )
 &rst
  ixpk= 5, nxpk= 0, iat= 751,  -1, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr2= 781, 782, 783,
 &end
#
#   46 GLN  HN      48 SER  HN     5.500   (#SUP   4.48 )
 &rst
  ixpk= 4, nxpk= 0, iat= 751, 787, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   47 ILE  HA      47 ILE  HN     4.060   (#SUP   5.86 )
 &rst
  ixpk= 5, nxpk= 0, iat= 770, 768, r1= 1.30, r2= 1.80, r3= 4.06, r4= 4.56,  &end
#
#   47 ILE  HA      48 SER  HN     4.720   (#SUP   5.48 )
 &rst
  ixpk= 5, nxpk= 0, iat= 770, 787, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,  &end
#
#   47 ILE  HB      47 ILE  HN     3.490   (#SUP   6.21 )
 &rst
  ixpk= 6, nxpk= 0, iat= 772, 768, r1= 1.30, r2= 1.80, r3= 3.49, r4= 3.99,  &end
#
#   47 ILE  HB      48 SER  HN     3.740   (#SUP   5.31 )
 &rst
  ixpk= 5, nxpk= 0, iat= 772, 787, r1= 1.30, r2= 1.80, r3= 3.74, r4= 4.24,  &end
#
#   47 ILE  HG12    47 ILE  HN     3.740   (#SUP   5.57 )
 &rst
  ixpk= 5, nxpk= 0, iat= 778, 768, r1= 1.30, r2= 1.80, r3= 3.74, r4= 4.24,  &end
#
#   47 ILE  HN      47 ILE  QD1    3.780   (#SUP   6.22 )
 &rst
  ixpk= 6, nxpk= 0, iat= 768,  -1, r1= 1.30, r2= 1.80, r3= 4.54, r4= 5.04,
 igr2= 781, 782, 783,
 &end
#
#   47 ILE  HN      47 ILE  QG2    4.010   (#SUP   6.74 )
 &rst
  ixpk= 6, nxpk= 0, iat= 768,  -1, r1= 1.30, r2= 1.80, r3= 4.82, r4= 5.32,
 igr2= 774, 775, 776,
 &end
#
#   47 ILE  QD1     48 SER  HN     5.000   (#SUP   5.69 )
 &rst
  ixpk= 5, nxpk= 0, iat=  -1, 787, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,
 igr1= 781, 782, 783,
 &end
#
#   47 ILE  QG2     48 SER  HN     4.230   (#SUP   6.71 )
 &rst
  ixpk= 6, nxpk= 0, iat=  -1, 787, r1= 1.30, r2= 1.80, r3= 5.08, r4= 5.58,
 igr1= 774, 775, 776,
 &end
#
#   47 ILE  QG2     54 PHE  HN     5.500   (#SUP   1.50 )
 &rst
  ixpk= 1, nxpk= 0, iat=  -1, 881, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr1= 774, 775, 776,
 &end
#
#   48 SER  HA      48 SER  HN     3.820   (#SUP   4.67 )
 &rst
  ixpk= 4, nxpk= 0, iat= 789, 787, r1= 1.30, r2= 1.80, r3= 3.82, r4= 4.32,  &end
#
#   48 SER  HB2     48 SER  HN     4.040   (#SUP   4.49 )
 &rst
  ixpk= 4, nxpk= 0, iat= 791, 787, r1= 1.30, r2= 1.80, r3= 4.04, r4= 4.54,  &end
#
#   48 SER  HB2     49 GLN  HN     4.230   (#SUP   4.51 )
 &rst
  ixpk= 4, nxpk= 0, iat= 791, 798, r1= 1.30, r2= 1.80, r3= 4.23, r4= 4.73,  &end
#
#   48 SER  HB3     48 SER  HN     3.690   (#SUP   3.85 )
 &rst
  ixpk= 3, nxpk= 0, iat= 792, 787, r1= 1.30, r2= 1.80, r3= 3.69, r4= 4.19,  &end
#
#   48 SER  HB3     49 GLN  HN     4.290   (#SUP   3.30 )
 &rst
  ixpk= 3, nxpk= 0, iat= 792, 798, r1= 1.30, r2= 1.80, r3= 4.29, r4= 4.79,  &end
#
#   48 SER  HN      49 GLN  HN     3.880   (#SUP   4.57 )
 &rst
  ixpk= 4, nxpk= 0, iat= 787, 798, r1= 1.30, r2= 1.80, r3= 3.88, r4= 4.38,  &end
#
#   49 GLN  HA      49 GLN  HN     3.610   (#SUP   5.38 )
 &rst
  ixpk= 5, nxpk= 0, iat= 800, 798, r1= 1.30, r2= 1.80, r3= 3.61, r4= 4.11,  &end
#
#   49 GLN  HA      50 HIS  HN     4.300   (#SUP   4.71 )
 &rst
  ixpk= 4, nxpk= 0, iat= 800, 815, r1= 1.30, r2= 1.80, r3= 4.30, r4= 4.80,  &end
#
#   49 GLN  HB2     49 GLN  HN     3.540   (#SUP   5.36 )
 &rst
  ixpk= 5, nxpk= 0, iat= 802, 798, r1= 1.30, r2= 1.80, r3= 3.54, r4= 4.04,  &end
#
#   49 GLN  HB2     50 HIS  HN     4.840   (#SUP   4.37 )
 &rst
  ixpk= 4, nxpk= 0, iat= 802, 815, r1= 1.30, r2= 1.80, r3= 4.84, r4= 5.34,  &end
#
#   49 GLN  HB3     49 GLN  HN     3.540   (#SUP   5.38 )
 &rst
  ixpk= 5, nxpk= 0, iat= 803, 798, r1= 1.30, r2= 1.80, r3= 3.54, r4= 4.04,  &end
#
#   49 GLN  HB3     50 HIS  HN     4.640   (#SUP   4.71 )
 &rst
  ixpk= 4, nxpk= 0, iat= 803, 815, r1= 1.30, r2= 1.80, r3= 4.64, r4= 5.14,  &end
#
#   49 GLN  HE21    49 GLN  HE22   2.810   (#SUP   1.50 )
 &rst
  ixpk= 1, nxpk= 0, iat= 810, 811, r1= 1.30, r2= 1.80, r3= 2.81, r4= 3.31,  &end
#
#   49 GLN  HE21    49 GLN  HG2    4.980   (#SUP   3.52 )
 &rst
  ixpk= 3, nxpk= 0, iat= 810, 805, r1= 1.30, r2= 1.80, r3= 4.98, r4= 5.48,  &end
#
#   49 GLN  HE21    49 GLN  HG3    5.050   (#SUP   3.77 )
 &rst
  ixpk= 3, nxpk= 0, iat= 810, 806, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,  &end
#
#   49 GLN  HG2     49 GLN  HN     4.050   (#SUP   5.30 )
 &rst
  ixpk= 5, nxpk= 0, iat= 805, 798, r1= 1.30, r2= 1.80, r3= 4.05, r4= 4.55,  &end
#
#   49 GLN  HG3     49 GLN  HN     3.890   (#SUP   5.60 )
 &rst
  ixpk= 5, nxpk= 0, iat= 806, 798, r1= 1.30, r2= 1.80, r3= 3.89, r4= 4.39,  &end
#
#   49 GLN  HG3     50 HIS  HN     5.240   (#SUP   4.57 )
 &rst
  ixpk= 4, nxpk= 0, iat= 806, 815, r1= 1.30, r2= 1.80, r3= 5.24, r4= 5.74,  &end
#
#   50 HIS  HA      50 HIS  HN     3.730   (#SUP   4.62 )
 &rst
  ixpk= 4, nxpk= 0, iat= 817, 815, r1= 1.30, r2= 1.80, r3= 3.73, r4= 4.23,  &end
#
#   50 HIS  HA      51 GLN  HN     3.750   (#SUP   5.26 )
 &rst
  ixpk= 5, nxpk= 0, iat= 817, 832, r1= 1.30, r2= 1.80, r3= 3.75, r4= 4.25,  &end
#
#   50 HIS  HA      52 GLU- HN     5.480   (#SUP   1.60 )
 &rst
  ixpk= 1, nxpk= 0, iat= 817, 849, r1= 1.30, r2= 1.80, r3= 5.48, r4= 5.98,  &end
#
#   50 HIS  HB2     50 HIS  HN     3.990   (#SUP   4.62 )
 &rst
  ixpk= 4, nxpk= 0, iat= 819, 815, r1= 1.30, r2= 1.80, r3= 3.99, r4= 4.49,  &end
#
#   50 HIS  HB2     51 GLN  HN     4.910   (#SUP   4.22 )
 &rst
  ixpk= 4, nxpk= 0, iat= 819, 832, r1= 1.30, r2= 1.80, r3= 4.91, r4= 5.41,  &end
#
#   50 HIS  HB2     53 HIS  HN     4.980   (#SUP   1.10 )
 &rst
  ixpk= 1, nxpk= 0, iat= 819, 864, r1= 1.30, r2= 1.80, r3= 4.98, r4= 5.48,  &end
#
#   50 HIS  HB2     54 PHE  HN     4.700   (#SUP   1.25 )
 &rst
  ixpk= 1, nxpk= 0, iat= 819, 881, r1= 1.30, r2= 1.80, r3= 4.70, r4= 5.20,  &end
#
#   50 HIS  HB3     50 HIS  HN     3.900   (#SUP   4.62 )
 &rst
  ixpk= 4, nxpk= 0, iat= 820, 815, r1= 1.30, r2= 1.80, r3= 3.90, r4= 4.40,  &end
#
#   50 HIS  HB3     51 GLN  HN     4.720   (#SUP   4.22 )
 &rst
  ixpk= 4, nxpk= 0, iat= 820, 832, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,  &end
#
#   50 HIS  HN      51 GLN  HB2    4.810   (#SUP   4.26 )
 &rst
  ixpk= 4, nxpk= 0, iat= 815, 836, r1= 1.30, r2= 1.80, r3= 4.81, r4= 5.31,  &end
#
#   50 HIS  HN      51 GLN  HN     3.580   (#SUP   5.22 )
 &rst
  ixpk= 5, nxpk= 0, iat= 815, 832, r1= 1.30, r2= 1.80, r3= 3.58, r4= 4.08,  &end
#
#   51 GLN  HA      51 GLN  HE21   5.230   (#SUP   3.76 )
 &rst
  ixpk= 3, nxpk= 0, iat= 834, 844, r1= 1.30, r2= 1.80, r3= 5.23, r4= 5.73,  &end
#
#   51 GLN  HA      51 GLN  HN     3.590   (#SUP   5.48 )
 &rst
  ixpk= 5, nxpk= 0, iat= 834, 832, r1= 1.30, r2= 1.80, r3= 3.59, r4= 4.09,  &end
#
#   51 GLN  HA      54 PHE  HN     4.220   (#SUP   4.68 )
 &rst
  ixpk= 4, nxpk= 0, iat= 834, 881, r1= 1.30, r2= 1.80, r3= 4.22, r4= 4.72,  &end
#
#   51 GLN  HA      55 ILE  HN     4.150   (#SUP   2.10 )
 &rst
  ixpk= 2, nxpk= 0, iat= 834, 901, r1= 1.30, r2= 1.80, r3= 4.15, r4= 4.65,  &end
#
#   51 GLN  HB2     51 GLN  HE21   5.500   (#SUP   4.44 )
 &rst
  ixpk= 4, nxpk= 0, iat= 836, 844, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   51 GLN  HB2     51 GLN  HE22   5.500   (#SUP   3.41 )
 &rst
  ixpk= 3, nxpk= 0, iat= 836, 845, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   51 GLN  HB2     51 GLN  HN     3.550   (#SUP   6.00 )
 &rst
  ixpk= 6, nxpk= 0, iat= 836, 832, r1= 1.30, r2= 1.80, r3= 3.55, r4= 4.05,  &end
#
#   51 GLN  HB3     51 GLN  HE21   5.500   (#SUP   4.11 )
 &rst
  ixpk= 4, nxpk= 0, iat= 837, 844, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   51 GLN  HB3     51 GLN  HN     3.670   (#SUP   6.10 )
 &rst
  ixpk= 6, nxpk= 0, iat= 837, 832, r1= 1.30, r2= 1.80, r3= 3.67, r4= 4.17,  &end
#
#   51 GLN  HB3     52 GLU- HN     4.290   (#SUP   5.29 )
 &rst
  ixpk= 5, nxpk= 0, iat= 837, 849, r1= 1.30, r2= 1.80, r3= 4.29, r4= 4.79,  &end
#
#   51 GLN  HE21    51 GLN  HE22   2.880   (#SUP   2.44 )
 &rst
  ixpk= 2, nxpk= 0, iat= 844, 845, r1= 1.30, r2= 1.80, r3= 2.88, r4= 3.38,  &end
#
#   51 GLN  HE21    51 GLN  QG     4.290   (#SUP   4.43 )
 &rst
  ixpk= 4, nxpk= 0, iat= 844,  -1, r1= 1.30, r2= 1.80, r3= 4.82, r4= 5.32,
 igr2= 839, 840,
 &end
#
#   51 GLN  HE21    55 ILE  QD1    5.470   (#SUP   2.07 )
 &rst
  ixpk= 2, nxpk= 0, iat= 844,  -1, r1= 1.30, r2= 1.80, r3= 6.57, r4= 7.07,
 igr2= 914, 915, 916,
 &end
#
#   51 GLN  HE22    51 GLN  QG     5.500   (#SUP   3.29 )
 &rst
  ixpk= 3, nxpk= 0, iat= 845,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2= 839, 840,
 &end
#
#   51 GLN  HE22    55 ILE  QD1    5.350   (#SUP   1.94 )
 &rst
  ixpk= 1, nxpk= 0, iat= 845,  -1, r1= 1.30, r2= 1.80, r3= 6.43, r4= 6.93,
 igr2= 914, 915, 916,
 &end
#
#   51 GLN  HN      51 GLN  QG     3.750   (#SUP   6.02 )
 &rst
  ixpk= 6, nxpk= 0, iat= 832,  -1, r1= 1.30, r2= 1.80, r3= 4.21, r4= 4.71,
 igr2= 839, 840,
 &end
#
#   51 GLN  HN      52 GLU- HN     4.130   (#SUP   5.51 )
 &rst
  ixpk= 5, nxpk= 0, iat= 832, 849, r1= 1.30, r2= 1.80, r3= 4.13, r4= 4.63,  &end
#
#   51 GLN  QG      52 GLU- HN     4.420   (#SUP   5.60 )
 &rst
  ixpk= 5, nxpk= 0, iat=  -1, 849, r1= 1.30, r2= 1.80, r3= 4.96, r4= 5.46,
 igr1= 839, 840,
 &end
#
#   52 GLU- HA      52 GLU- HN     3.780   (#SUP   5.05 )
 &rst
  ixpk= 5, nxpk= 0, iat= 851, 849, r1= 1.30, r2= 1.80, r3= 3.78, r4= 4.28,  &end
#
#   52 GLU- HA      53 HIS  HN     4.590   (#SUP   4.62 )
 &rst
  ixpk= 4, nxpk= 0, iat= 851, 864, r1= 1.30, r2= 1.80, r3= 4.59, r4= 5.09,  &end
#
#   52 GLU- HB2     52 GLU- HN     3.910   (#SUP   4.97 )
 &rst
  ixpk= 4, nxpk= 0, iat= 853, 849, r1= 1.30, r2= 1.80, r3= 3.91, r4= 4.41,  &end
#
#   52 GLU- HB2     53 HIS  HN     4.670   (#SUP   4.70 )
 &rst
  ixpk= 4, nxpk= 0, iat= 853, 864, r1= 1.30, r2= 1.80, r3= 4.67, r4= 5.17,  &end
#
#   52 GLU- HB3     52 GLU- HN     4.050   (#SUP   4.97 )
 &rst
  ixpk= 4, nxpk= 0, iat= 854, 849, r1= 1.30, r2= 1.80, r3= 4.05, r4= 4.55,  &end
#
#   52 GLU- HB3     53 HIS  HN     4.570   (#SUP   4.73 )
 &rst
  ixpk= 4, nxpk= 0, iat= 854, 864, r1= 1.30, r2= 1.80, r3= 4.57, r4= 5.07,  &end
#
#   52 GLU- HN      52 GLU- QG     3.810   (#SUP   5.05 )
 &rst
  ixpk= 5, nxpk= 0, iat= 849,  -1, r1= 1.30, r2= 1.80, r3= 4.28, r4= 4.78,
 igr2= 856, 857,
 &end
#
#   52 GLU- HN      53 HIS  HN     4.060   (#SUP   5.96 )
 &rst
  ixpk= 5, nxpk= 0, iat= 849, 864, r1= 1.30, r2= 1.80, r3= 4.06, r4= 4.56,  &end
#
#   52 GLU- HN      54 PHE  HN     5.360   (#SUP   2.44 )
 &rst
  ixpk= 2, nxpk= 0, iat= 849, 881, r1= 1.30, r2= 1.80, r3= 5.36, r4= 5.86,  &end
#
#   52 GLU- QG      53 HIS  HN     4.590   (#SUP   4.80 )
 &rst
  ixpk= 4, nxpk= 0, iat=  -1, 864, r1= 1.30, r2= 1.80, r3= 5.15, r4= 5.65,
 igr1= 856, 857,
 &end
#
#   53 HIS  HA      53 HIS  HN     4.170   (#SUP   3.58 )
 &rst
  ixpk= 3, nxpk= 0, iat= 866, 864, r1= 1.30, r2= 1.80, r3= 4.17, r4= 4.67,  &end
#
#   53 HIS  HA      54 PHE  HN     4.850   (#SUP   3.18 )
 &rst
  ixpk= 3, nxpk= 0, iat= 866, 881, r1= 1.30, r2= 1.80, r3= 4.85, r4= 5.35,  &end
#
#   53 HIS  HA      56 GLN  HN     4.360   (#SUP   0.75 )
 &rst
  ixpk= 0, nxpk= 0, iat= 866, 920, r1= 1.30, r2= 1.80, r3= 4.36, r4= 4.86,  &end
#
#   53 HIS  HN      53 HIS  QB     3.540   (#SUP   3.58 )
 &rst
  ixpk= 3, nxpk= 0, iat= 864,  -1, r1= 1.30, r2= 1.80, r3= 3.97, r4= 4.47,
 igr2= 868, 869,
 &end
#
#   53 HIS  HN      54 PHE  HN     3.880   (#SUP   3.82 )
 &rst
  ixpk= 3, nxpk= 0, iat= 864, 881, r1= 1.30, r2= 1.80, r3= 3.88, r4= 4.38,  &end
#
#   53 HIS  QB      54 PHE  HN     4.000   (#SUP   3.18 )
 &rst
  ixpk= 3, nxpk= 0, iat=  -1, 881, r1= 1.30, r2= 1.80, r3= 4.49, r4= 4.99,
 igr1= 868, 869,
 &end
#
#   54 PHE  HA      54 PHE  HN     4.080   (#SUP   3.91 )
 &rst
  ixpk= 3, nxpk= 0, iat= 883, 881, r1= 1.30, r2= 1.80, r3= 4.08, r4= 4.58,  &end
#
#   54 PHE  HA      55 ILE  HN     4.510   (#SUP   3.81 )
 &rst
  ixpk= 3, nxpk= 0, iat= 883, 901, r1= 1.30, r2= 1.80, r3= 4.51, r4= 5.01,  &end
#
#   54 PHE  HA      57 MET  HN     4.810   (#SUP   2.24 )
 &rst
  ixpk= 2, nxpk= 0, iat= 883, 937, r1= 1.30, r2= 1.80, r3= 4.81, r4= 5.31,  &end
#
#   54 PHE  HB2     54 PHE  HN     3.640   (#SUP   3.91 )
 &rst
  ixpk= 3, nxpk= 0, iat= 885, 881, r1= 1.30, r2= 1.80, r3= 3.64, r4= 4.14,  &end
#
#   54 PHE  HB2     55 ILE  HN     4.070   (#SUP   3.81 )
 &rst
  ixpk= 3, nxpk= 0, iat= 885, 901, r1= 1.30, r2= 1.80, r3= 4.07, r4= 4.57,  &end
#
#   54 PHE  HB3     54 PHE  HN     3.650   (#SUP   3.91 )
 &rst
  ixpk= 3, nxpk= 0, iat= 886, 881, r1= 1.30, r2= 1.80, r3= 3.65, r4= 4.15,  &end
#
#   54 PHE  HB3     55 ILE  HN     4.260   (#SUP   3.81 )
 &rst
  ixpk= 3, nxpk= 0, iat= 886, 901, r1= 1.30, r2= 1.80, r3= 4.26, r4= 4.76,  &end
#
#   54 PHE  HN      55 ILE  HB     4.820   (#SUP   3.65 )
 &rst
  ixpk= 3, nxpk= 0, iat= 881, 905, r1= 1.30, r2= 1.80, r3= 4.82, r4= 5.32,  &end
#
#   54 PHE  HN      55 ILE  QD1    5.500   (#SUP   3.25 )
 &rst
  ixpk= 3, nxpk= 0, iat= 881,  -1, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr2= 914, 915, 916,
 &end
#
#   55 ILE  HA      55 ILE  HN     4.040   (#SUP   6.25 )
 &rst
  ixpk= 6, nxpk= 0, iat= 903, 901, r1= 1.30, r2= 1.80, r3= 4.04, r4= 4.54,  &end
#
#   55 ILE  HA      56 GLN  HN     4.680   (#SUP   6.02 )
 &rst
  ixpk= 6, nxpk= 0, iat= 903, 920, r1= 1.30, r2= 1.80, r3= 4.68, r4= 5.18,  &end
#
#   55 ILE  HA      58 LEU  HN     4.560   (#SUP   3.82 )
 &rst
  ixpk= 3, nxpk= 0, iat= 903, 954, r1= 1.30, r2= 1.80, r3= 4.56, r4= 5.06,  &end
#
#   55 ILE  HB      55 ILE  HN     3.520   (#SUP   6.50 )
 &rst
  ixpk= 6, nxpk= 0, iat= 905, 901, r1= 1.30, r2= 1.80, r3= 3.52, r4= 4.02,  &end
#
#   55 ILE  HB      56 GLN  HN     3.710   (#SUP   5.88 )
 &rst
  ixpk= 5, nxpk= 0, iat= 905, 920, r1= 1.30, r2= 1.80, r3= 3.71, r4= 4.21,  &end
#
#   55 ILE  HG12    55 ILE  HN     3.810   (#SUP   6.26 )
 &rst
  ixpk= 6, nxpk= 0, iat= 911, 901, r1= 1.30, r2= 1.80, r3= 3.81, r4= 4.31,  &end
#
#   55 ILE  HG12    56 GLN  HN     5.330   (#SUP   6.11 )
 &rst
  ixpk= 6, nxpk= 0, iat= 911, 920, r1= 1.30, r2= 1.80, r3= 5.33, r4= 5.83,  &end
#
#   55 ILE  HG13    55 ILE  HN     4.000   (#SUP   5.74 )
 &rst
  ixpk= 5, nxpk= 0, iat= 912, 901, r1= 1.30, r2= 1.80, r3= 4.00, r4= 4.50,  &end
#
#   55 ILE  HN      55 ILE  QD1    3.890   (#SUP   5.66 )
 &rst
  ixpk= 5, nxpk= 0, iat= 901,  -1, r1= 1.30, r2= 1.80, r3= 4.67, r4= 5.17,
 igr2= 914, 915, 916,
 &end
#
#   55 ILE  HN      56 GLN  HN     3.800   (#SUP   5.13 )
 &rst
  ixpk= 5, nxpk= 0, iat= 901, 920, r1= 1.30, r2= 1.80, r3= 3.80, r4= 4.30,  &end
#
#   55 ILE  QG2     56 GLN  HN     4.080   (#SUP   5.74 )
 &rst
  ixpk= 5, nxpk= 0, iat=  -1, 920, r1= 1.30, r2= 1.80, r3= 4.90, r4= 5.40,
 igr1= 907, 908, 909,
 &end
#
#   55 ILE  QG2     58 LEU  HN     5.040   (#SUP   2.60 )
 &rst
  ixpk= 2, nxpk= 0, iat=  -1, 954, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55,
 igr1= 907, 908, 909,
 &end
#
#   55 ILE  QG2     59 ASN  HD21   4.270   (#SUP   1.20 )
 &rst
  ixpk= 1, nxpk= 0, iat=  -1, 982, r1= 1.30, r2= 1.80, r3= 5.13, r4= 5.63,
 igr1= 907, 908, 909,
 &end
#
#   55 ILE  QG2     59 ASN  HD22   4.230   (#SUP   1.20 )
 &rst
  ixpk= 1, nxpk= 0, iat=  -1, 983, r1= 1.30, r2= 1.80, r3= 5.08, r4= 5.58,
 igr1= 907, 908, 909,
 &end
#
#   55 ILE  QG2     59 ASN  HN     4.700   (#SUP   2.60 )
 &rst
  ixpk= 2, nxpk= 0, iat=  -1, 973, r1= 1.30, r2= 1.80, r3= 5.64, r4= 6.14,
 igr1= 907, 908, 909,
 &end
#
#   56 GLN  HA      56 GLN  HN     3.700   (#SUP   6.33 )
 &rst
  ixpk= 6, nxpk= 0, iat= 922, 920, r1= 1.30, r2= 1.80, r3= 3.70, r4= 4.20,  &end
#
#   56 GLN  HA      57 MET  HN     4.540   (#SUP   3.75 )
 &rst
  ixpk= 3, nxpk= 0, iat= 922, 937, r1= 1.30, r2= 1.80, r3= 4.54, r4= 5.04,  &end
#
#   56 GLN  HA      59 ASN  HN     4.310   (#SUP   2.93 )
 &rst
  ixpk= 2, nxpk= 0, iat= 922, 973, r1= 1.30, r2= 1.80, r3= 4.31, r4= 4.81,  &end
#
#   56 GLN  HG2     56 GLN  HN     4.120   (#SUP   4.62 )
 &rst
  ixpk= 4, nxpk= 0, iat= 927, 920, r1= 1.30, r2= 1.80, r3= 4.12, r4= 4.62,  &end
#
#   56 GLN  HG3     56 GLN  HN     4.290   (#SUP   4.62 )
 &rst
  ixpk= 4, nxpk= 0, iat= 928, 920, r1= 1.30, r2= 1.80, r3= 4.29, r4= 4.79,  &end
#
#   56 GLN  HN      56 GLN  QB     3.240   (#SUP   4.61 )
 &rst
  ixpk= 4, nxpk= 0, iat= 920,  -1, r1= 1.30, r2= 1.80, r3= 3.64, r4= 4.14,
 igr2= 924, 925,
 &end
#
#   56 GLN  HN      57 MET  HN     3.840   (#SUP   3.47 )
 &rst
  ixpk= 3, nxpk= 0, iat= 920, 937, r1= 1.30, r2= 1.80, r3= 3.84, r4= 4.34,  &end
#
#   57 MET  HA      57 MET  HN     3.920   (#SUP   5.94 )
 &rst
  ixpk= 5, nxpk= 0, iat= 939, 937, r1= 1.30, r2= 1.80, r3= 3.92, r4= 4.42,  &end
#
#   57 MET  HA      58 LEU  HN     4.600   (#SUP   5.93 )
 &rst
  ixpk= 5, nxpk= 0, iat= 939, 954, r1= 1.30, r2= 1.80, r3= 4.60, r4= 5.10,  &end
#
#   57 MET  HA      60 GLU- HN     4.880   (#SUP   2.13 )
 &rst
  ixpk= 2, nxpk= 0, iat= 939, 987, r1= 1.30, r2= 1.80, r3= 4.88, r4= 5.38,  &end
#
#   57 MET  HB2     57 MET  HN     3.370   (#SUP   5.76 )
 &rst
  ixpk= 5, nxpk= 0, iat= 941, 937, r1= 1.30, r2= 1.80, r3= 3.37, r4= 3.87,  &end
#
#   57 MET  HB2     58 LEU  HN     4.110   (#SUP   5.49 )
 &rst
  ixpk= 5, nxpk= 0, iat= 941, 954, r1= 1.30, r2= 1.80, r3= 4.11, r4= 4.61,  &end
#
#   57 MET  HB3     57 MET  HN     3.980   (#SUP   5.76 )
 &rst
  ixpk= 5, nxpk= 0, iat= 942, 937, r1= 1.30, r2= 1.80, r3= 3.98, r4= 4.48,  &end
#
#   57 MET  HB3     58 LEU  HN     4.300   (#SUP   5.49 )
 &rst
  ixpk= 5, nxpk= 0, iat= 942, 954, r1= 1.30, r2= 1.80, r3= 4.30, r4= 4.80,  &end
#
#   57 MET  HG2     57 MET  HN     3.800   (#SUP   4.84 )
 &rst
  ixpk= 4, nxpk= 0, iat= 944, 937, r1= 1.30, r2= 1.80, r3= 3.80, r4= 4.30,  &end
#
#   57 MET  HG3     57 MET  HN     4.100   (#SUP   5.69 )
 &rst
  ixpk= 5, nxpk= 0, iat= 945, 937, r1= 1.30, r2= 1.80, r3= 4.10, r4= 4.60,  &end
#
#   57 MET  HG3     58 LEU  HN     5.360   (#SUP   5.33 )
 &rst
  ixpk= 5, nxpk= 0, iat= 945, 954, r1= 1.30, r2= 1.80, r3= 5.36, r4= 5.86,  &end
#
#   57 MET  HN      58 LEU  HB2    4.630   (#SUP   5.48 )
 &rst
  ixpk= 5, nxpk= 0, iat= 937, 958, r1= 1.30, r2= 1.80, r3= 4.63, r4= 5.13,  &end
#
#   57 MET  HN      58 LEU  HN     3.990   (#SUP   7.50 )
 &rst
  ixpk= 7, nxpk= 0, iat= 937, 954, r1= 1.30, r2= 1.80, r3= 3.99, r4= 4.49,  &end
#
#   57 MET  HN      59 ASN  HN     5.390   (#SUP   3.94 )
 &rst
  ixpk= 3, nxpk= 0, iat= 937, 973, r1= 1.30, r2= 1.80, r3= 5.39, r4= 5.89,  &end
#
#   58 LEU  HA      58 LEU  HN     3.780   (#SUP   7.30 )
 &rst
  ixpk= 7, nxpk= 0, iat= 956, 954, r1= 1.30, r2= 1.80, r3= 3.78, r4= 4.28,  &end
#
#   58 LEU  HA      59 ASN  HN     4.590   (#SUP   7.27 )
 &rst
  ixpk= 7, nxpk= 0, iat= 956, 973, r1= 1.30, r2= 1.80, r3= 4.59, r4= 5.09,  &end
#
#   58 LEU  HA      60 GLU- HN     5.500   (#SUP   2.17 )
 &rst
  ixpk= 2, nxpk= 0, iat= 956, 987, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   58 LEU  HB2     58 LEU  HN     3.640   (#SUP   7.86 )
 &rst
  ixpk= 7, nxpk= 0, iat= 958, 954, r1= 1.30, r2= 1.80, r3= 3.64, r4= 4.14,  &end
#
#   58 LEU  HB2     59 ASN  HN     4.140   (#SUP   6.88 )
 &rst
  ixpk= 6, nxpk= 0, iat= 958, 973, r1= 1.30, r2= 1.80, r3= 4.14, r4= 4.64,  &end
#
#   58 LEU  HB3     58 LEU  HN     3.760   (#SUP   7.14 )
 &rst
  ixpk= 7, nxpk= 0, iat= 959, 954, r1= 1.30, r2= 1.80, r3= 3.76, r4= 4.26,  &end
#
#   58 LEU  HB3     59 ASN  HN     4.880   (#SUP   5.81 )
 &rst
  ixpk= 5, nxpk= 0, iat= 959, 973, r1= 1.30, r2= 1.80, r3= 4.88, r4= 5.38,  &end
#
#   58 LEU  HG      58 LEU  HN     4.030   (#SUP   6.66 )
 &rst
  ixpk= 6, nxpk= 0, iat= 961, 954, r1= 1.30, r2= 1.80, r3= 4.03, r4= 4.53,  &end
#
#   58 LEU  HN      58 LEU  QD2    4.400   (#SUP   6.60 )
 &rst
  ixpk= 6, nxpk= 0, iat= 954,  -1, r1= 1.30, r2= 1.80, r3= 5.28, r4= 5.78,
 igr2= 967, 968, 969,
 &end
#
#   58 LEU  HN      59 ASN  HN     3.720   (#SUP   6.21 )
 &rst
  ixpk= 6, nxpk= 0, iat= 954, 973, r1= 1.30, r2= 1.80, r3= 3.72, r4= 4.22,  &end
#
#   58 LEU  QD2     59 ASN  HN     4.520   (#SUP   6.30 )
 &rst
  ixpk= 6, nxpk= 0, iat=  -1, 973, r1= 1.30, r2= 1.80, r3= 5.43, r4= 5.93,
 igr1= 967, 968, 969,
 &end
#
#   59 ASN  HA      59 ASN  HN     3.890   (#SUP   5.03 )
 &rst
  ixpk= 5, nxpk= 0, iat= 975, 973, r1= 1.30, r2= 1.80, r3= 3.89, r4= 4.39,  &end
#
#   59 ASN  HA      60 GLU- HN     4.260   (#SUP   4.51 )
 &rst
  ixpk= 4, nxpk= 0, iat= 975, 987, r1= 1.30, r2= 1.80, r3= 4.26, r4= 4.76,  &end
#
#   59 ASN  HB2     59 ASN  HD21   4.550   (#SUP   2.76 )
 &rst
  ixpk= 2, nxpk= 0, iat= 977, 982, r1= 1.30, r2= 1.80, r3= 4.55, r4= 5.05,  &end
#
#   59 ASN  HB2     59 ASN  HD22   4.810   (#SUP   2.91 )
 &rst
  ixpk= 2, nxpk= 0, iat= 977, 983, r1= 1.30, r2= 1.80, r3= 4.81, r4= 5.31,  &end
#
#   59 ASN  HB2     59 ASN  HN     3.800   (#SUP   5.73 )
 &rst
  ixpk= 5, nxpk= 0, iat= 977, 973, r1= 1.30, r2= 1.80, r3= 3.80, r4= 4.30,  &end
#
#   59 ASN  HB2     60 GLU- HN     4.880   (#SUP   5.19 )
 &rst
  ixpk= 5, nxpk= 0, iat= 977, 987, r1= 1.30, r2= 1.80, r3= 4.88, r4= 5.38,  &end
#
#   59 ASN  HB3     59 ASN  HD22   4.350   (#SUP   2.95 )
 &rst
  ixpk= 2, nxpk= 0, iat= 978, 983, r1= 1.30, r2= 1.80, r3= 4.35, r4= 4.85,  &end
#
#   59 ASN  HB3     59 ASN  HN     3.520   (#SUP   5.38 )
 &rst
  ixpk= 5, nxpk= 0, iat= 978, 973, r1= 1.30, r2= 1.80, r3= 3.52, r4= 4.02,  &end
#
#   59 ASN  HB3     60 GLU- HN     4.960   (#SUP   4.86 )
 &rst
  ixpk= 4, nxpk= 0, iat= 978, 987, r1= 1.30, r2= 1.80, r3= 4.96, r4= 5.46,  &end
#
#   59 ASN  HD21    59 ASN  HD22   2.900   (#SUP   1.93 )
 &rst
  ixpk= 1, nxpk= 0, iat= 982, 983, r1= 1.30, r2= 1.80, r3= 2.90, r4= 3.40,  &end
#
#   59 ASN  HN      60 GLU- HN     3.740   (#SUP   5.82 )
 &rst
  ixpk= 5, nxpk= 0, iat= 973, 987, r1= 1.30, r2= 1.80, r3= 3.74, r4= 4.24,  &end
#
#   59 ASN  HN      60 GLU- QB     4.460   (#SUP   3.15 )
 &rst
  ixpk= 3, nxpk= 0, iat= 973,  -1, r1= 1.30, r2= 1.80, r3= 5.01, r4= 5.51,
 igr2= 991, 992,
 &end
#
#   60 GLU- HA      60 GLU- HN     3.710   (#SUP   6.35 )
 &rst
  ixpk= 6, nxpk= 0, iat= 989, 987, r1= 1.30, r2= 1.80, r3= 3.71, r4= 4.21,  &end
#
#   60 GLU- HG2     60 GLU- HN     4.140   (#SUP   5.64 )
 &rst
  ixpk= 5, nxpk= 0, iat= 994, 987, r1= 1.30, r2= 1.80, r3= 4.14, r4= 4.64,  &end
#
#   60 GLU- HG3     60 GLU- HN     4.430   (#SUP   4.92 )
 &rst
  ixpk= 4, nxpk= 0, iat= 995, 987, r1= 1.30, r2= 1.80, r3= 4.43, r4= 4.93,  &end
#
#   60 GLU- HN      60 GLU- QB     3.310   (#SUP   6.23 )
 &rst
  ixpk= 6, nxpk= 0, iat= 987,  -1, r1= 1.30, r2= 1.80, r3= 3.72, r4= 4.22,
 igr2= 991, 992,
 &end
#
#   60 GLU- HN      61 PRO  HD2    5.500   (#SUP   4.26 )
 &rst
  ixpk= 4, nxpk= 0, iat= 987,1003, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   60 GLU- HN      61 PRO  HD3    5.430   (#SUP   5.49 )
 &rst
  ixpk= 5, nxpk= 0, iat= 987,1004, r1= 1.30, r2= 1.80, r3= 5.43, r4= 5.93,  &end
#
#   61 PRO  HA      62 VAL  HN     3.130   (#SUP   3.89 )
 &rst
  ixpk= 3, nxpk= 0, iat=1012,1016, r1= 1.30, r2= 1.80, r3= 3.13, r4= 3.63,  &end
#
#   61 PRO  HB2     62 VAL  HN     4.220   (#SUP   4.14 )
 &rst
  ixpk= 4, nxpk= 0, iat=1009,1016, r1= 1.30, r2= 1.80, r3= 4.22, r4= 4.72,  &end
#
#   61 PRO  HB3     62 VAL  HN     4.370   (#SUP   4.27 )
 &rst
  ixpk= 4, nxpk= 0, iat=1010,1016, r1= 1.30, r2= 1.80, r3= 4.37, r4= 4.87,  &end
#
#   62 VAL  HA      62 VAL  HN     3.990   (#SUP   3.65 )
 &rst
  ixpk= 3, nxpk= 0, iat=1018,1016, r1= 1.30, r2= 1.80, r3= 3.99, r4= 4.49,  &end
#
#   62 VAL  HA      63 GLN  HN     3.570   (#SUP   3.65 )
 &rst
  ixpk= 3, nxpk= 0, iat=1018,1032, r1= 1.30, r2= 1.80, r3= 3.57, r4= 4.07,  &end
#
#   62 VAL  HB      62 VAL  HN     3.440   (#SUP   3.56 )
 &rst
  ixpk= 3, nxpk= 0, iat=1020,1016, r1= 1.30, r2= 1.80, r3= 3.44, r4= 3.94,  &end
#
#   62 VAL  HB      63 GLN  HN     4.230   (#SUP   3.65 )
 &rst
  ixpk= 3, nxpk= 0, iat=1020,1032, r1= 1.30, r2= 1.80, r3= 4.23, r4= 4.73,  &end
#
#   62 VAL  HN      62 VAL  QG1    3.590   (#SUP   3.62 )
 &rst
  ixpk= 3, nxpk= 0, iat=1016,  -1, r1= 1.30, r2= 1.80, r3= 4.31, r4= 4.81,
 igr2=1022,1023,1024,
 &end
#
#   62 VAL  QG2     63 GLN  HN     4.430   (#SUP   3.16 )
 &rst
  ixpk= 3, nxpk= 0, iat=  -1,1032, r1= 1.30, r2= 1.80, r3= 5.32, r4= 5.82,
 igr1=1026,1027,1028,
 &end
#
#   63 GLN  HA      63 GLN  HN     4.340   (#SUP   4.38 )
 &rst
  ixpk= 4, nxpk= 0, iat=1034,1032, r1= 1.30, r2= 1.80, r3= 4.34, r4= 4.84,  &end
#
#   63 GLN  HA      64 GLU- HN     3.980   (#SUP   2.33 )
 &rst
  ixpk= 2, nxpk= 0, iat=1034,1049, r1= 1.30, r2= 1.80, r3= 3.98, r4= 4.48,  &end
#
#   63 GLN  HB3     63 GLN  HN     4.400   (#SUP   3.02 )
 &rst
  ixpk= 3, nxpk= 0, iat=1037,1032, r1= 1.30, r2= 1.80, r3= 4.40, r4= 4.90,  &end
#
#   63 GLN  HG3     63 GLN  HN     4.690   (#SUP   4.39 )
 &rst
  ixpk= 4, nxpk= 0, iat=1040,1032, r1= 1.30, r2= 1.80, r3= 4.69, r4= 5.19,  &end
#
#   64 GLU- HA      64 GLU- HN     4.810   (#SUP   2.94 )
 &rst
  ixpk= 2, nxpk= 0, iat=1051,1049, r1= 1.30, r2= 1.80, r3= 4.81, r4= 5.31,  &end
#
#   64 GLU- HA      65 ALA  HN     4.400   (#SUP   1.50 )
 &rst
  ixpk= 1, nxpk= 0, iat=1051,1064, r1= 1.30, r2= 1.80, r3= 4.40, r4= 4.90,  &end
#
#   64 GLU- HB2     64 GLU- HN     4.720   (#SUP   2.95 )
 &rst
  ixpk= 2, nxpk= 0, iat=1053,1049, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,  &end
#
#   64 GLU- HB3     64 GLU- HN     4.520   (#SUP   2.76 )
 &rst
  ixpk= 2, nxpk= 0, iat=1054,1049, r1= 1.30, r2= 1.80, r3= 4.52, r4= 5.02,  &end
#
#   65 ALA  HN      65 ALA  QB     4.900   (#SUP   1.27 )
 &rst
  ixpk= 1, nxpk= 0, iat=1064,  -1, r1= 1.30, r2= 1.80, r3= 5.88, r4= 6.38,
 igr2=1068,1069,1070,
 &end

  Entry H atom name         Submitted Coord H atom name
  Start of MODEL    1
    1   1H    GLY   1           H1       GLY   1  11.653 -13.159   4.843
    2   2H    GLY   1           H2       GLY   1  11.540 -11.647   5.454
    3   3H    GLY   1           H3       GLY   1  10.937 -12.917   6.304
    4   1HA   GLY   1          HA2       GLY   1  13.120 -13.825   6.658
    5   2HA   GLY   1          HA3       GLY   1  13.790 -12.519   5.662
    6    H    SER   2           H        SER   2  14.596 -13.050   8.340
    7    HA   SER   2           HA       SER   2  13.303 -11.605  10.374
    8   1HB   SER   2          HB2       SER   2  15.477 -11.777  11.556
    9   2HB   SER   2          HB3       SER   2  14.957 -13.300  10.822
   10    HG   SER   2           HG       SER   2  17.165 -12.838  10.396
   11    H    HIS   3           H        HIS   3  15.248 -10.287   7.836
   12    HA   HIS   3           HA       HIS   3  15.191  -7.572   9.096
   13   1HB   HIS   3          HB2       HIS   3  17.266  -7.115   7.890
   14   2HB   HIS   3          HB3       HIS   3  17.450  -8.504   8.949
   15    HD1  HIS   3           HD1      HIS   3  17.210  -7.680   5.194
   16    HD2  HIS   3           HD2      HIS   3  17.977 -10.878   7.809
   17    HE1  HIS   3           HE1      HIS   3  18.059  -9.597   3.746
   18    H    MET   4           H        MET   4  13.429  -9.217   7.003
   19    HA   MET   4           HA       MET   4  12.626  -6.913   5.428
   20   1HB   MET   4          HB2       MET   4  14.532  -7.760   4.081
   21   2HB   MET   4          HB3       MET   4  13.724  -9.321   3.925
   22   1HG   MET   4          HG2       MET   4  11.776  -8.144   2.854
   23   2HG   MET   4          HG3       MET   4  12.670  -6.626   2.958
   24   1HE   MET   4          HE1       MET   4  15.639  -7.306   2.061
   25   2HE   MET   4          HE2       MET   4  15.488  -7.039   0.313
   26   3HE   MET   4          HE3       MET   4  14.663  -5.950   1.448
   27    HA   PRO   5           HA       PRO   5   9.034  -9.761   6.143
   28   1HB   PRO   5          HB2       PRO   5   7.260  -7.857   6.937
   29   2HB   PRO   5          HB3       PRO   5   8.408  -8.631   8.072
   30   1HG   PRO   5          HG2       PRO   5   8.690  -5.976   6.653
   31   2HG   PRO   5          HG3       PRO   5   8.950  -6.334   8.395
   32   1HD   PRO   5          HD2       PRO   5  10.995  -6.197   6.585
   33   2HD   PRO   5          HD3       PRO   5  11.035  -7.328   7.971
   34    H    LEU   6           H        LEU   6   7.055  -9.672   4.833
   35    HA   LEU   6           HA       LEU   6   6.044  -9.565   2.800
   36   1HB   LEU   6          HB2       LEU   6   6.707  -6.609   2.961
   37   2HB   LEU   6          HB3       LEU   6   5.416  -7.348   2.015
   38    HG   LEU   6           HG       LEU   6   5.511  -7.385   5.065
   39   1HD1  LEU   6          HD11      LEU   6   3.767  -5.635   4.887
   40   2HD1  LEU   6          HD12      LEU   6   5.337  -5.107   4.259
   41   3HD1  LEU   6          HD13      LEU   6   4.041  -5.565   3.129
   42   1HD2  LEU   6          HD21      LEU   6   3.112  -7.948   4.838
   43   2HD2  LEU   6          HD22      LEU   6   3.290  -8.034   3.073
   44   3HD2  LEU   6          HD23      LEU   6   4.138  -9.198   4.126
   45    H    GLU   7           H        GLU   7   8.873 -10.207   2.653
   46    HA   GLU   7           HA       GLU   7  10.381  -8.804   0.815
   47   1HB   GLU   7          HB2       GLU   7  11.754 -10.785   0.581
   48   2HB   GLU   7          HB3       GLU   7  11.260 -10.558   2.255
   49   1HG   GLU   7          HG2       GLU   7   9.489 -12.305   1.948
   50   2HG   GLU   7          HG3       GLU   7  10.035 -12.548   0.292
   51    H    PHE   8           H        PHE   8   7.765 -10.956  -0.047
   52    HA   PHE   8           HA       PHE   8   8.352 -11.385  -2.804
   53   1HB   PHE   8          HB2       PHE   8   5.760 -11.616  -2.880
   54   2HB   PHE   8          HB3       PHE   8   6.737 -12.762  -1.977
   55    HD1  PHE   8           HD1      PHE   8   4.814  -9.547  -1.413
   56    HD2  PHE   8           HD2      PHE   8   6.134 -13.324   0.200
   57    HE1  PHE   8           HE1      PHE   8   3.530  -9.119   0.667
   58    HE2  PHE   8           HE2      PHE   8   4.796 -12.914   2.246
   59    HZ   PHE   8           HZ       PHE   8   3.481 -10.821   2.476
   60    H    LEU   9           H        LEU   9   7.368  -8.420  -1.244
   61    HA   LEU   9           HA       LEU   9   6.272  -7.129  -3.616
   62   1HB   LEU   9          HB2       LEU   9   7.414  -6.057  -0.999
   63   2HB   LEU   9          HB3       LEU   9   6.686  -5.049  -2.236
   64    HG   LEU   9           HG       LEU   9   5.200  -7.224  -0.705
   65   1HD1  LEU   9          HD11      LEU   9   5.845  -5.286   0.693
   66   2HD1  LEU   9          HD12      LEU   9   5.115  -4.184  -0.491
   67   3HD1  LEU   9          HD13      LEU   9   4.096  -5.330   0.413
   68   1HD2  LEU   9          HD21      LEU   9   4.265  -5.121  -2.714
   69   2HD2  LEU   9          HD22      LEU   9   4.172  -6.890  -2.897
   70   3HD2  LEU   9          HD23      LEU   9   3.186  -6.074  -1.677
   71    H    ARG  10           H        ARG  10   9.521  -7.634  -2.438
   72    HA   ARG  10           HA       ARG  10  10.592  -5.178  -2.656
   73   1HB   ARG  10          HB2       ARG  10  12.729  -6.156  -2.315
   74   2HB   ARG  10          HB3       ARG  10  11.539  -7.172  -1.516
   75   1HG   ARG  10          HG2       ARG  10  11.610  -8.699  -3.579
   76   2HG   ARG  10          HG3       ARG  10  12.958  -7.715  -4.165
   77   1HD   ARG  10          HD2       ARG  10  14.218  -8.235  -2.063
   78   2HD   ARG  10          HD3       ARG  10  12.868  -9.243  -1.535
   79    HE   ARG  10           HE       ARG  10  13.450 -10.907  -3.042
   80   1HH1  ARG  10          HH22      ARG  10  15.501  -8.134  -3.716
   81   2HH1  ARG  10          HH21      ARG  10  16.552  -9.062  -4.763
   82   1HH2  ARG  10          HH12      ARG  10  14.830 -12.016  -4.373
   83   2HH2  ARG  10          HH11      ARG  10  16.178 -11.196  -5.118
   84    H    ASN  11           H        ASN  11  10.019  -6.909  -5.519
   85    HA   ASN  11           HA       ASN  11  11.616  -4.959  -7.118
   86   1HB   ASN  11          HB2       ASN  11  12.459  -6.753  -8.500
   87   2HB   ASN  11          HB3       ASN  11  12.874  -7.101  -6.822
   88   1HD2  ASN  11          HD21      ASN  11  13.026  -9.149  -8.603
   89   2HD2  ASN  11          HD22      ASN  11  11.682 -10.261  -8.346
   90    H    GLN  12           H        GLN  12   8.514  -5.921  -6.564
   91    HA   GLN  12           HA       GLN  12   7.686  -6.940  -9.070
   92   1HB   GLN  12          HB2       GLN  12   6.093  -5.677  -6.806
   93   2HB   GLN  12          HB3       GLN  12   5.362  -6.524  -8.167
   94   1HG   GLN  12          HG2       GLN  12   7.338  -7.782  -6.207
   95   2HG   GLN  12          HG3       GLN  12   5.582  -7.942  -6.135
   96   1HE2  GLN  12          HE21      GLN  12   8.488  -9.229  -7.594
   97   2HE2  GLN  12          HE22      GLN  12   7.653 -10.363  -8.643
   98    HA   PRO  13           HA       PRO  13   7.171  -3.489 -11.798
   99   1HB   PRO  13          HB2       PRO  13   4.503  -4.742 -12.477
  100   2HB   PRO  13          HB3       PRO  13   5.755  -4.094 -13.581
  101   1HG   PRO  13          HG2       PRO  13   5.574  -6.753 -13.182
  102   2HG   PRO  13          HG3       PRO  13   7.186  -5.965 -13.171
  103   1HD   PRO  13          HD2       PRO  13   5.480  -6.791 -10.820
  104   2HD   PRO  13          HD3       PRO  13   7.240  -7.014 -11.086
  105    H    GLN  14           H        GLN  14   4.370  -4.207  -9.699
  106    HA   GLN  14           HA       GLN  14   3.280  -1.488  -9.890
  107   1HB   GLN  14          HB2       GLN  14   2.687  -3.787  -7.984
  108   2HB   GLN  14          HB3       GLN  14   1.819  -2.246  -8.029
  109   1HG   GLN  14          HG2       GLN  14   1.203  -2.671 -10.407
  110   2HG   GLN  14          HG3       GLN  14   1.983  -4.250 -10.325
  111   1HE2  GLN  14          HE21      GLN  14  -0.635  -4.220 -11.085
  112   2HE2  GLN  14          HE22      GLN  14  -1.644  -4.800  -9.769
  113    H    PHE  15           H        PHE  15   5.397  -3.235  -7.612
  114    HA   PHE  15           HA       PHE  15   5.417  -1.221  -5.527
  115   1HB   PHE  15          HB2       PHE  15   5.893  -3.617  -5.185
  116   2HB   PHE  15          HB3       PHE  15   7.311  -3.500  -6.218
  117    HD1  PHE  15           HD1      PHE  15   5.866  -2.373  -2.951
  118    HD2  PHE  15           HD2      PHE  15   9.427  -2.919  -5.320
  119    HE1  PHE  15           HE1      PHE  15   7.264  -2.039  -0.931
  120    HE2  PHE  15           HE2      PHE  15  10.819  -2.599  -3.291
  121    HZ   PHE  15           HZ       PHE  15   9.743  -2.165  -1.096
  122    H    GLN  16           H        GLN  16   7.303  -1.747  -8.449
  123    HA   GLN  16           HA       GLN  16   9.291   0.281  -8.150
  124   1HB   GLN  16          HB2       GLN  16   7.860  -1.001 -10.495
  125   2HB   GLN  16          HB3       GLN  16   9.129   0.209 -10.726
  126   1HG   GLN  16          HG2       GLN  16  10.759  -1.219  -9.566
  127   2HG   GLN  16          HG3       GLN  16   9.513  -2.416  -9.222
  128   1HE2  GLN  16          HE21      GLN  16  10.115  -4.211 -10.526
  129   2HE2  GLN  16          HE22      GLN  16  10.409  -4.057 -12.249
  130    H    GLN  17           H        GLN  17   5.846   0.695  -8.552
  131    HA   GLN  17           HA       GLN  17   6.194   3.496  -9.579
  132   1HB   GLN  17          HB2       GLN  17   4.117   1.397 -10.311
  133   2HB   GLN  17          HB3       GLN  17   4.144   3.072 -10.881
  134   1HG   GLN  17          HG2       GLN  17   6.372   2.652 -11.933
  135   2HG   GLN  17          HG3       GLN  17   6.284   0.964 -11.431
  136   1HE2  GLN  17          HE21      GLN  17   4.889  -0.480 -12.544
  137   2HE2  GLN  17          HE22      GLN  17   4.068  -0.003 -14.032
  138    H    MET  18           H        MET  18   3.842   1.422  -7.734
  139    HA   MET  18           HA       MET  18   2.027   3.483  -7.137
  140   1HB   MET  18          HB2       MET  18   1.114   1.979  -5.553
  141   2HB   MET  18          HB3       MET  18   1.606   1.098  -6.994
  142   1HG   MET  18          HG2       MET  18   3.749   0.448  -5.711
  143   2HG   MET  18          HG3       MET  18   2.992   1.133  -4.279
  144   1HE   MET  18          HE1       MET  18   3.977  -1.680  -3.877
  145   2HE   MET  18          HE2       MET  18   2.897  -0.864  -2.720
  146   3HE   MET  18          HE3       MET  18   2.549  -2.526  -3.243
  147    H    ARG  19           H        ARG  19   4.958   2.618  -5.370
  148    HA   ARG  19           HA       ARG  19   4.601   4.344  -3.099
  149   1HB   ARG  19          HB2       ARG  19   7.174   3.413  -4.455
  150   2HB   ARG  19          HB3       ARG  19   7.007   4.002  -2.796
  151   1HG   ARG  19          HG2       ARG  19   5.340   2.087  -2.439
  152   2HG   ARG  19          HG3       ARG  19   5.867   1.420  -3.972
  153   1HD   ARG  19          HD2       ARG  19   7.847   2.067  -1.762
  154   2HD   ARG  19          HD3       ARG  19   7.086   0.476  -1.955
  155    HE   ARG  19           HE       ARG  19   8.070   0.818  -4.426
  156   1HH1  ARG  19          HH22      ARG  19   9.677   1.001  -1.345
  157   2HH1  ARG  19          HH21      ARG  19  11.246   0.670  -1.994
  158   1HH2  ARG  19          HH12      ARG  19  10.037   0.290  -5.231
  159   2HH2  ARG  19          HH11      ARG  19  11.436   0.236  -4.176
  160    H    GLN  20           H        GLN  20   5.828   4.977  -6.330
  161    HA   GLN  20           HA       GLN  20   6.964   7.594  -5.857
  162   1HB   GLN  20          HB2       GLN  20   5.586   6.677  -8.414
  163   2HB   GLN  20          HB3       GLN  20   6.686   8.022  -8.212
  164   1HG   GLN  20          HG2       GLN  20   8.520   6.391  -7.615
  165   2HG   GLN  20          HG3       GLN  20   7.393   5.074  -7.971
  166   1HE2  GLN  20          HE21      GLN  20   8.400   4.192  -9.860
  167   2HE2  GLN  20          HE22      GLN  20   8.634   5.162 -11.309
  168    H    ILE  21           H        ILE  21   3.664   6.456  -6.394
  169    HA   ILE  21           HA       ILE  21   2.461   9.015  -6.812
  170    HB   ILE  21           HB       ILE  21   1.060   6.540  -5.706
  171   1HG1  ILE  21          HG12      ILE  21   1.861   7.120  -8.576
  172   2HG1  ILE  21          HG13      ILE  21   2.392   5.766  -7.585
  173   1HG2  ILE  21          HG21      ILE  21  -0.886   7.482  -6.838
  174   2HG2  ILE  21          HG22      ILE  21  -0.193   8.703  -5.778
  175   3HG2  ILE  21          HG23      ILE  21   0.107   8.787  -7.527
  176   1HD1  ILE  21          HD11      ILE  21  -0.408   6.139  -8.658
  177   2HD1  ILE  21          HD12      ILE  21   0.794   4.910  -9.098
  178   3HD1  ILE  21          HD13      ILE  21   0.079   4.886  -7.480
  179    H    ILE  22           H        ILE  22   2.851   6.884  -3.999
  180    HA   ILE  22           HA       ILE  22   1.443   8.542  -2.108
  181    HB   ILE  22           HB       ILE  22   3.497   6.378  -1.529
  182   1HG1  ILE  22          HG12      ILE  22   1.914   5.194  -2.780
  183   2HG1  ILE  22          HG13      ILE  22   1.376   4.959  -1.135
  184   1HG2  ILE  22          HG21      ILE  22   1.220   7.435   0.199
  185   2HG2  ILE  22          HG22      ILE  22   2.333   6.116   0.605
  186   3HG2  ILE  22          HG23      ILE  22   2.953   7.757   0.457
  187   1HD1  ILE  22          HD11      ILE  22  -0.578   5.352  -2.387
  188   2HD1  ILE  22          HD12      ILE  22  -0.284   6.877  -1.518
  189   3HD1  ILE  22          HD13      ILE  22   0.117   6.736  -3.244
  190    H    GLN  23           H        GLN  23   4.894   8.350  -2.975
  191    HA   GLN  23           HA       GLN  23   5.867  10.243  -1.109
  192   1HB   GLN  23          HB2       GLN  23   6.741   8.986  -3.686
  193   2HB   GLN  23          HB3       GLN  23   7.585  10.445  -3.196
  194   1HG   GLN  23          HG2       GLN  23   8.768   8.511  -2.414
  195   2HG   GLN  23          HG3       GLN  23   8.199   9.472  -1.045
  196   1HE2  GLN  23          HE21      GLN  23   8.657   6.311  -2.000
  197   2HE2  GLN  23          HE22      GLN  23   7.374   5.579  -1.065
  198    H    GLN  24           H        GLN  24   3.607  10.934  -3.473
  199    HA   GLN  24           HA       GLN  24   4.288  13.865  -3.452
  200   1HB   GLN  24          HB2       GLN  24   2.751  12.343  -5.595
  201   2HB   GLN  24          HB3       GLN  24   3.187  14.056  -5.614
  202   1HG   GLN  24          HG2       GLN  24   5.572  13.451  -5.747
  203   2HG   GLN  24          HG3       GLN  24   5.139  11.736  -5.599
  204   1HE2  GLN  24          HE21      GLN  24   4.867  10.604  -7.465
  205   2HE2  GLN  24          HE22      GLN  24   4.617  11.330  -9.056
  206    H    ASN  25           H        ASN  25   1.791  11.403  -3.359
  207    HA   ASN  25           HA       ASN  25   0.009  13.213  -1.785
  208   1HB   ASN  25          HB2       ASN  25  -0.643  11.586  -4.226
  209   2HB   ASN  25          HB3       ASN  25  -1.853  11.722  -2.943
  210   1HD2  ASN  25          HD21      ASN  25  -2.341  13.927  -2.101
  211   2HD2  ASN  25          HD22      ASN  25  -2.405  15.209  -3.311
  212    HA   PRO  26           HA       PRO  26   0.871   9.475   0.776
  213   1HB   PRO  26          HB2       PRO  26   0.949  10.765   3.195
  214   2HB   PRO  26          HB3       PRO  26   2.355  10.626   2.093
  215   1HG   PRO  26          HG2       PRO  26   0.415  12.940   2.339
  216   2HG   PRO  26          HG3       PRO  26   2.212  12.996   2.349
  217   1HD   PRO  26          HD2       PRO  26   0.776  13.501   0.133
  218   2HD   PRO  26          HD3       PRO  26   2.300  12.562   0.016
  219    H    SER  27           H        SER  27  -1.561  11.996   0.813
  220    HA   SER  27           HA       SER  27  -3.595  10.845   2.422
  221   1HB   SER  27          HB2       SER  27  -5.098  12.208   0.937
  222   2HB   SER  27          HB3       SER  27  -3.766  13.104   1.677
  223    HG   SER  27           HG       SER  27  -4.107  13.492  -0.604
  224    H    LEU  28           H        LEU  28  -2.342   9.712  -0.626
  225    HA   LEU  28           HA       LEU  28  -4.734   8.006  -1.092
  226   1HB   LEU  28          HB2       LEU  28  -2.345   8.615  -2.866
  227   2HB   LEU  28          HB3       LEU  28  -3.705   7.578  -3.295
  228    HG   LEU  28           HG       LEU  28  -3.821  10.579  -2.805
  229   1HD1  LEU  28          HD11      LEU  28  -4.405  10.632  -5.194
  230   2HD1  LEU  28          HD12      LEU  28  -2.843   9.823  -4.963
  231   3HD1  LEU  28          HD13      LEU  28  -4.305   8.857  -5.269
  232   1HD2  LEU  28          HD21      LEU  28  -6.179  10.422  -3.574
  233   2HD2  LEU  28          HD22      LEU  28  -6.078   8.649  -3.497
  234   3HD2  LEU  28          HD23      LEU  28  -5.937   9.632  -2.017
  235    H    LEU  29           H        LEU  29  -2.064   7.621   0.793
  236    HA   LEU  29           HA       LEU  29  -1.242   4.959   0.191
  237   1HB   LEU  29          HB2       LEU  29  -0.092   6.332   1.796
  238   2HB   LEU  29          HB3       LEU  29  -1.479   6.469   2.827
  239    HG   LEU  29           HG       LEU  29  -1.397   4.073   3.388
  240   1HD1  LEU  29          HD11      LEU  29  -0.503   3.049   1.387
  241   2HD1  LEU  29          HD12      LEU  29   0.978   4.023   1.486
  242   3HD1  LEU  29          HD13      LEU  29   0.650   2.756   2.696
  243   1HD2  LEU  29          HD21      LEU  29   1.311   5.439   3.667
  244   2HD2  LEU  29          HD22      LEU  29  -0.098   5.691   4.720
  245   3HD2  LEU  29          HD23      LEU  29   0.689   4.107   4.670
  246    HA   PRO  30           HA       PRO  30  -5.242   3.482   2.714
  247   1HB   PRO  30          HB2       PRO  30  -6.989   5.807   1.899
  248   2HB   PRO  30          HB3       PRO  30  -7.037   4.846   3.388
  249   1HG   PRO  30          HG2       PRO  30  -5.963   7.394   3.064
  250   2HG   PRO  30          HG3       PRO  30  -5.501   6.270   4.391
  251   1HD   PRO  30          HD2       PRO  30  -3.920   7.153   2.089
  252   2HD   PRO  30          HD3       PRO  30  -3.404   6.214   3.508
  253    H    ALA  31           H        ALA  31  -5.673   5.654  -0.041
  254    HA   ALA  31           HA       ALA  31  -7.477   4.029  -1.505
  255   1HB   ALA  31          HB1       ALA  31  -7.186   5.707  -3.209
  256   2HB   ALA  31          HB2       ALA  31  -7.134   6.503  -1.616
  257   3HB   ALA  31          HB3       ALA  31  -5.633   6.224  -2.522
  258    H    LEU  32           H        LEU  32  -4.048   3.570  -1.131
  259    HA   LEU  32           HA       LEU  32  -3.795   2.008  -3.653
  260   1HB   LEU  32          HB2       LEU  32  -1.995   3.544  -3.096
  261   2HB   LEU  32          HB3       LEU  32  -1.877   2.841  -1.470
  262    HG   LEU  32           HG       LEU  32  -1.004   0.772  -2.343
  263   1HD1  LEU  32          HD11      LEU  32  -0.477   0.473  -4.741
  264   2HD1  LEU  32          HD12      LEU  32  -2.208   0.612  -4.486
  265   3HD1  LEU  32          HD13      LEU  32  -1.306   2.010  -5.113
  266   1HD2  LEU  32          HD21      LEU  32   0.514   2.719  -1.919
  267   2HD2  LEU  32          HD22      LEU  32   1.169   1.590  -3.108
  268   3HD2  LEU  32          HD23      LEU  32   0.449   3.117  -3.649
  269    H    LEU  33           H        LEU  33  -3.697   1.655  -0.092
  270    HA   LEU  33           HA       LEU  33  -3.486  -1.199   0.038
  271   1HB   LEU  33          HB2       LEU  33  -4.843   0.856   1.822
  272   2HB   LEU  33          HB3       LEU  33  -4.605  -0.833   2.271
  273    HG   LEU  33           HG       LEU  33  -2.180   0.788   1.436
  274   1HD1  LEU  33          HD11      LEU  33  -3.513   0.904   4.163
  275   2HD1  LEU  33          HD12      LEU  33  -1.885   1.524   3.760
  276   3HD1  LEU  33          HD13      LEU  33  -3.315   2.235   2.996
  277   1HD2  LEU  33          HD21      LEU  33  -2.624  -1.419   3.489
  278   2HD2  LEU  33          HD22      LEU  33  -1.965  -1.639   1.854
  279   3HD2  LEU  33          HD23      LEU  33  -1.068  -0.685   3.047
  280    H    GLN  34           H        GLN  34  -6.396   0.934  -0.119
  281    HA   GLN  34           HA       GLN  34  -8.324  -1.148  -0.398
  282   1HB   GLN  34          HB2       GLN  34  -8.245   1.739  -1.351
  283   2HB   GLN  34          HB3       GLN  34  -9.642   0.709  -1.612
  284   1HG   GLN  34          HG2       GLN  34  -8.469   1.336   1.133
  285   2HG   GLN  34          HG3       GLN  34  -9.837   2.175   0.412
  286   1HE2  GLN  34          HE21      GLN  34  -9.558   0.355   2.902
  287   2HE2  GLN  34          HE22      GLN  34 -10.857  -0.808   2.662
  288    H    GLN  35           H        GLN  35  -6.105   0.257  -2.845
  289    HA   GLN  35           HA       GLN  35  -7.608  -0.853  -5.080
  290   1HB   GLN  35          HB2       GLN  35  -6.401   1.179  -5.433
  291   2HB   GLN  35          HB3       GLN  35  -4.901   0.504  -4.776
  292   1HG   GLN  35          HG2       GLN  35  -4.606  -0.932  -6.661
  293   2HG   GLN  35          HG3       GLN  35  -6.218  -0.532  -7.291
  294   1HE2  GLN  35          HE21      GLN  35  -5.500   0.340  -9.307
  295   2HE2  GLN  35          HE22      GLN  35  -4.534   1.814  -9.379
  296    H    ILE  36           H        ILE  36  -4.667  -1.779  -3.272
  297    HA   ILE  36           HA       ILE  36  -4.104  -4.227  -4.615
  298    HB   ILE  36           HB       ILE  36  -3.755  -3.412  -1.730
  299   1HG1  ILE  36          HG12      ILE  36  -1.604  -3.653  -3.877
  300   2HG1  ILE  36          HG13      ILE  36  -2.507  -2.159  -3.658
  301   1HG2  ILE  36          HG21      ILE  36  -3.733  -5.899  -1.871
  302   2HG2  ILE  36          HG22      ILE  36  -2.628  -5.840  -3.244
  303   3HG2  ILE  36          HG23      ILE  36  -2.091  -5.332  -1.628
  304   1HD1  ILE  36          HD11      ILE  36  -0.764  -3.495  -1.566
  305   2HD1  ILE  36          HD12      ILE  36  -0.461  -1.974  -2.429
  306   3HD1  ILE  36          HD13      ILE  36  -1.802  -2.078  -1.268
  307    H    GLY  37           H        GLY  37  -6.434  -3.524  -1.912
  308   1HA   GLY  37          HA2       GLY  37  -7.444  -6.124  -1.601
  309   2HA   GLY  37          HA3       GLY  37  -8.324  -4.629  -1.268
  310    H    ARG  38           H        ARG  38  -8.082  -3.968  -4.332
  311    HA   ARG  38           HA       ARG  38 -10.468  -5.488  -5.208
  312   1HB   ARG  38          HB2       ARG  38  -8.971  -3.260  -6.625
  313   2HB   ARG  38          HB3       ARG  38 -10.512  -3.961  -7.092
  314   1HG   ARG  38          HG2       ARG  38  -9.930  -2.199  -4.712
  315   2HG   ARG  38          HG3       ARG  38 -11.020  -1.927  -6.073
  316   1HD   ARG  38          HD2       ARG  38 -12.474  -3.782  -5.266
  317   2HD   ARG  38          HD3       ARG  38 -11.437  -3.980  -3.856
  318    HE   ARG  38           HE       ARG  38 -13.440  -1.915  -4.310
  319   1HH1  ARG  38          HH22      ARG  38 -10.437  -2.368  -2.505
  320   2HH1  ARG  38          HH21      ARG  38 -11.095  -1.517  -1.127
  321   1HH2  ARG  38          HH11      ARG  38 -14.048  -0.684  -2.529
  322   2HH2  ARG  38          HH12      ARG  38 -12.941  -0.545  -1.179
  323    H    GLU  39           H        GLU  39  -7.132  -6.020  -5.535
  324    HA   GLU  39           HA       GLU  39  -7.627  -7.828  -7.882
  325   1HB   GLU  39          HB2       GLU  39  -5.689  -7.078  -9.011
  326   2HB   GLU  39          HB3       GLU  39  -6.705  -5.676  -8.638
  327   1HG   GLU  39          HG2       GLU  39  -5.224  -5.118  -6.734
  328   2HG   GLU  39          HG3       GLU  39  -4.215  -6.519  -7.116
  329    H    ASN  40           H        ASN  40  -5.804  -7.287  -4.963
  330    HA   ASN  40           HA       ASN  40  -5.284 -10.165  -4.795
  331   1HB   ASN  40          HB2       ASN  40  -3.188  -8.913  -5.763
  332   2HB   ASN  40          HB3       ASN  40  -2.983  -8.291  -4.143
  333   1HD2  ASN  40          HD21      ASN  40  -1.267 -10.172  -5.672
  334   2HD2  ASN  40          HD22      ASN  40  -1.238 -11.653  -4.714
  335    HA   PRO  41           HA       PRO  41  -6.921  -8.182  -0.873
  336   1HB   PRO  41          HB2       PRO  41  -8.814 -10.090  -0.300
  337   2HB   PRO  41          HB3       PRO  41  -9.093  -8.667  -1.356
  338   1HG   PRO  41          HG2       PRO  41  -8.336 -11.464  -2.205
  339   2HG   PRO  41          HG3       PRO  41  -9.682 -10.448  -2.827
  340   1HD   PRO  41          HD2       PRO  41  -7.336 -10.581  -4.135
  341   2HD   PRO  41          HD3       PRO  41  -8.161  -9.002  -3.960
  342    H    GLN  42           H        GLN  42  -5.649 -11.315  -1.774
  343    HA   GLN  42           HA       GLN  42  -5.063 -12.310   0.884
  344   1HB   GLN  42          HB2       GLN  42  -3.724 -12.990  -1.753
  345   2HB   GLN  42          HB3       GLN  42  -3.720 -13.951  -0.265
  346   1HG   GLN  42          HG2       GLN  42  -6.231 -14.150  -0.463
  347   2HG   GLN  42          HG3       GLN  42  -6.130 -13.304  -2.009
  348   1HE2  GLN  42          HE21      GLN  42  -7.224 -15.328  -2.840
  349   2HE2  GLN  42          HE22      GLN  42  -6.180 -16.682  -3.254
  350    H    LEU  43           H        LEU  43  -3.161 -10.490  -1.581
  351    HA   LEU  43           HA       LEU  43  -0.817 -10.136   0.076
  352   1HB   LEU  43          HB2       LEU  43  -0.967  -9.763  -2.459
  353   2HB   LEU  43          HB3       LEU  43  -1.974  -8.358  -2.126
  354    HG   LEU  43           HG       LEU  43  -0.207  -7.161  -1.107
  355   1HD1  LEU  43          HD11      LEU  43   0.986  -8.870   0.145
  356   2HD1  LEU  43          HD12      LEU  43   1.480  -9.687  -1.359
  357   3HD1  LEU  43          HD13      LEU  43   2.116  -8.075  -0.953
  358   1HD2  LEU  43          HD21      LEU  43  -0.299  -7.197  -3.576
  359   2HD2  LEU  43          HD22      LEU  43   1.352  -6.966  -2.984
  360   3HD2  LEU  43          HD23      LEU  43   0.848  -8.556  -3.599
  361    H    LEU  44           H        LEU  44  -3.899  -8.467  -0.255
  362    HA   LEU  44           HA       LEU  44  -3.087  -6.057   1.058
  363   1HB   LEU  44          HB2       LEU  44  -5.158  -6.491  -0.394
  364   2HB   LEU  44          HB3       LEU  44  -5.918  -7.208   0.985
  365    HG   LEU  44           HG       LEU  44  -6.214  -4.670   0.251
  366   1HD1  LEU  44          HD11      LEU  44  -7.135  -4.146   2.390
  367   2HD1  LEU  44          HD12      LEU  44  -7.539  -5.795   1.913
  368   3HD1  LEU  44          HD13      LEU  44  -6.276  -5.516   3.150
  369   1HD2  LEU  44          HD21      LEU  44  -4.095  -4.360   2.431
  370   2HD2  LEU  44          HD22      LEU  44  -3.901  -3.916   0.712
  371   3HD2  LEU  44          HD23      LEU  44  -5.093  -3.090   1.731
  372    H    GLN  45           H        GLN  45  -5.053  -8.711   2.297
  373    HA   GLN  45           HA       GLN  45  -4.924  -8.030   5.048
  374   1HB   GLN  45          HB2       GLN  45  -5.649 -10.216   5.594
  375   2HB   GLN  45          HB3       GLN  45  -6.461  -9.704   4.113
  376   1HG   GLN  45          HG2       GLN  45  -4.836 -11.085   2.796
  377   2HG   GLN  45          HG3       GLN  45  -4.107 -11.639   4.312
  378   1HE2  GLN  45          HE21      GLN  45  -4.687 -13.806   3.281
  379   2HE2  GLN  45          HE22      GLN  45  -6.303 -14.410   3.626
  380    H    GLN  46           H        GLN  46  -2.392  -9.657   3.136
  381    HA   GLN  46           HA       GLN  46  -0.730 -10.334   5.436
  382   1HB   GLN  46          HB2       GLN  46  -0.401 -10.217   2.420
  383   2HB   GLN  46          HB3       GLN  46   1.012 -10.380   3.447
  384   1HG   GLN  46          HG2       GLN  46   0.012 -12.386   4.526
  385   2HG   GLN  46          HG3       GLN  46  -1.423 -12.230   3.519
  386   1HE2  GLN  46          HE21      GLN  46  -1.175 -12.513   1.179
  387   2HE2  GLN  46          HE22      GLN  46   0.151 -13.515   0.562
  388    H    ILE  47           H        ILE  47  -0.720  -7.591   3.108
  389    HA   ILE  47           HA       ILE  47   1.384  -6.089   4.326
  390    HB   ILE  47           HB       ILE  47  -1.005  -5.381   2.614
  391   1HG1  ILE  47          HG12      ILE  47   2.009  -5.207   2.151
  392   2HG1  ILE  47          HG13      ILE  47   1.034  -6.619   1.724
  393   1HG2  ILE  47          HG21      ILE  47   0.014  -3.062   2.423
  394   2HG2  ILE  47          HG22      ILE  47  -0.748  -3.397   3.970
  395   3HG2  ILE  47          HG23      ILE  47   1.022  -3.467   3.828
  396   1HD1  ILE  47          HD11      ILE  47   1.340  -5.338  -0.256
  397   2HD1  ILE  47          HD12      ILE  47  -0.358  -5.152   0.243
  398   3HD1  ILE  47          HD13      ILE  47   0.816  -3.839   0.527
  399    H    SER  48           H        SER  48  -2.104  -6.225   5.012
  400    HA   SER  48           HA       SER  48  -2.186  -4.182   7.010
  401   1HB   SER  48          HB2       SER  48  -3.985  -6.621   6.729
  402   2HB   SER  48          HB3       SER  48  -4.324  -5.178   7.695
  403    HG   SER  48           HG       SER  48  -4.004  -5.316   4.880
  404    H    GLN  49           H        GLN  49  -1.543  -7.668   7.301
  405    HA   GLN  49           HA       GLN  49  -1.297  -7.775  10.163
  406   1HB   GLN  49          HB2       GLN  49  -0.501  -9.510   7.819
  407   2HB   GLN  49          HB3       GLN  49   0.093  -9.916   9.427
  408   1HG   GLN  49          HG2       GLN  49  -2.154 -10.095  10.316
  409   2HG   GLN  49          HG3       GLN  49  -2.860  -9.473   8.825
  410   1HE2  GLN  49          HE21      GLN  49  -2.791 -10.807   6.911
  411   2HE2  GLN  49          HE22      GLN  49  -2.617 -12.566   7.062
  412    H    HIS  50           H        HIS  50   0.758  -6.210   7.948
  413    HA   HIS  50           HA       HIS  50   3.004  -6.134   9.913
  414   1HB   HIS  50          HB2       HIS  50   3.208  -6.544   6.906
  415   2HB   HIS  50          HB3       HIS  50   4.575  -6.356   8.011
  416    HD1  HIS  50           HD1      HIS  50   2.059  -8.955   6.861
  417    HD2  HIS  50           HD2      HIS  50   5.211  -8.470   9.590
  418    HE1  HIS  50           HE1      HIS  50   2.682 -11.299   7.653
  419    H    GLN  51           H        GLN  51   0.773  -4.168   9.087
  420    HA   GLN  51           HA       GLN  51   1.474  -2.421   7.176
  421   1HB   GLN  51          HB2       GLN  51  -0.674  -2.652   8.497
  422   2HB   GLN  51          HB3       GLN  51   0.039  -1.574   9.712
  423   1HG   GLN  51          HG2       GLN  51   0.300   0.176   7.934
  424   2HG   GLN  51          HG3       GLN  51  -0.372  -0.963   6.759
  425   1HE2  GLN  51          HE21      GLN  51  -2.336   0.054   6.213
  426   2HE2  GLN  51          HE22      GLN  51  -3.555   0.467   7.419
  427    H    GLU  52           H        GLU  52   2.616  -2.049  10.559
  428    HA   GLU  52           HA       GLU  52   3.828   0.534  10.228
  429   1HB   GLU  52          HB2       GLU  52   4.513  -1.751  12.121
  430   2HB   GLU  52          HB3       GLU  52   5.170  -0.113  12.229
  431   1HG   GLU  52          HG2       GLU  52   2.862   0.789  12.488
  432   2HG   GLU  52          HG3       GLU  52   2.223  -0.851  12.465
  433    H    HIS  53           H        HIS  53   4.998  -2.695   9.424
  434    HA   HIS  53           HA       HIS  53   7.726  -1.786   8.736
  435   1HB   HIS  53          HB2       HIS  53   6.432  -4.498   8.298
  436   2HB   HIS  53          HB3       HIS  53   8.144  -4.088   8.234
  437    HD1  HIS  53           HD1      HIS  53   9.213  -3.326  10.759
  438    HD2  HIS  53           HD2      HIS  53   5.501  -5.293  10.611
  439    HE1  HIS  53           HE1      HIS  53   8.767  -4.186  13.111
  440    H    PHE  54           H        PHE  54   4.667  -2.645   7.104
  441    HA   PHE  54           HA       PHE  54   5.608  -2.575   4.400
  442   1HB   PHE  54          HB2       PHE  54   3.347  -3.340   4.918
  443   2HB   PHE  54          HB3       PHE  54   2.930  -1.761   5.582
  444    HD1  PHE  54           HD1      PHE  54   1.774  -0.247   4.222
  445    HD2  PHE  54           HD2      PHE  54   4.257  -3.246   2.366
  446    HE1  PHE  54           HE1      PHE  54   1.013   0.501   1.981
  447    HE2  PHE  54           HE2      PHE  54   3.499  -2.481   0.130
  448    HZ   PHE  54           HZ       PHE  54   1.877  -0.610  -0.065
  449    H    ILE  55           H        ILE  55   4.386   0.093   6.505
  450    HA   ILE  55           HA       ILE  55   4.730   2.183   4.674
  451    HB   ILE  55           HB       ILE  55   4.776   2.184   7.640
  452   1HG1  ILE  55          HG12      ILE  55   2.818   3.185   5.509
  453   2HG1  ILE  55          HG13      ILE  55   2.703   1.611   6.299
  454   1HG2  ILE  55          HG21      ILE  55   6.148   4.144   6.953
  455   2HG2  ILE  55          HG22      ILE  55   4.906   4.625   5.782
  456   3HG2  ILE  55          HG23      ILE  55   4.584   4.681   7.525
  457   1HD1  ILE  55          HD11      ILE  55   1.151   3.062   7.351
  458   2HD1  ILE  55          HD12      ILE  55   2.478   2.766   8.500
  459   3HD1  ILE  55          HD13      ILE  55   2.377   4.316   7.614
  460    H    GLN  56           H        GLN  56   7.292   0.596   6.648
  461    HA   GLN  56           HA       GLN  56   9.333   2.534   6.017
  462   1HB   GLN  56          HB2       GLN  56   9.794  -0.412   6.601
  463   2HB   GLN  56          HB3       GLN  56  10.927   0.923   6.789
  464   1HG   GLN  56          HG2       GLN  56   8.524   0.205   8.463
  465   2HG   GLN  56          HG3       GLN  56  10.196   0.341   8.975
  466   1HE2  GLN  56          HE21      GLN  56   7.338   1.757   9.466
  467   2HE2  GLN  56          HE22      GLN  56   7.844   3.435   9.669
  468    H    MET  57           H        MET  57   8.275  -0.429   4.340
  469    HA   MET  57           HA       MET  57  10.274  -0.271   2.195
  470   1HB   MET  57          HB2       MET  57   7.712  -1.872   2.465
  471   2HB   MET  57          HB3       MET  57   8.924  -2.066   1.194
  472   1HG   MET  57          HG2       MET  57   9.365  -2.550   4.167
  473   2HG   MET  57          HG3       MET  57   9.129  -3.749   2.906
  474   1HE   MET  57          HE1       MET  57  13.072  -1.811   4.110
  475   2HE   MET  57          HE2       MET  57  11.680  -0.739   3.879
  476   3HE   MET  57          HE3       MET  57  11.604  -2.052   5.079
  477    H    LEU  58           H        LEU  58   6.971   0.872   2.670
  478    HA   LEU  58           HA       LEU  58   6.328   1.638  -0.013
  479   1HB   LEU  58          HB2       LEU  58   4.795   0.855   1.552
  480   2HB   LEU  58          HB3       LEU  58   5.339   1.972   2.788
  481    HG   LEU  58           HG       LEU  58   3.112   2.232   1.838
  482   1HD1  LEU  58          HD11      LEU  58   4.244   3.886   3.291
  483   2HD1  LEU  58          HD12      LEU  58   4.819   4.751   1.842
  484   3HD1  LEU  58          HD13      LEU  58   3.086   4.623   2.189
  485   1HD2  LEU  58          HD21      LEU  58   2.691   3.466  -0.158
  486   2HD2  LEU  58          HD22      LEU  58   4.419   3.707  -0.479
  487   3HD2  LEU  58          HD23      LEU  58   3.702   2.079  -0.579
  488    H    ASN  59           H        ASN  59   7.635   3.440   2.822
  489    HA   ASN  59           HA       ASN  59   7.145   6.020   1.580
  490   1HB   ASN  59          HB2       ASN  59   6.797   5.362   3.994
  491   2HB   ASN  59          HB3       ASN  59   8.555   5.315   4.186
  492   1HD2  ASN  59          HD21      ASN  59   5.710   7.336   3.720
  493   2HD2  ASN  59          HD22      ASN  59   6.498   8.819   4.249
  494    H    GLU  60           H        GLU  60   9.900   3.914   1.724
  495    HA   GLU  60           HA       GLU  60  12.013   5.820   1.303
  496   1HB   GLU  60          HB2       GLU  60  13.373   3.921   0.837
  497   2HB   GLU  60          HB3       GLU  60  12.222   3.438   2.089
  498   1HG   GLU  60          HG2       GLU  60  10.805   2.389   0.400
  499   2HG   GLU  60          HG3       GLU  60  11.899   2.910  -0.883
  500    HA   PRO  61           HA       PRO  61  11.501   6.699  -3.063
  501   1HB   PRO  61          HB2       PRO  61  14.033   7.152  -3.936
  502   2HB   PRO  61          HB3       PRO  61  13.181   8.251  -2.807
  503   1HG   PRO  61          HG2       PRO  61  15.204   6.106  -2.170
  504   2HG   PRO  61          HG3       PRO  61  15.123   7.784  -1.536
  505   1HD   PRO  61          HD2       PRO  61  14.169   5.577  -0.200
  506   2HD   PRO  61          HD3       PRO  61  13.431   7.194   0.006
  507    H    VAL  62           H        VAL  62  11.309   5.504  -4.957
  508    HA   VAL  62           HA       VAL  62  11.672   2.735  -4.846
  509    HB   VAL  62           HB       VAL  62  10.952   2.708  -7.176
  510   1HG1  VAL  62          HG11      VAL  62   9.348   2.999  -5.286
  511   2HG1  VAL  62          HG12      VAL  62   9.347   4.750  -5.591
  512   3HG1  VAL  62          HG13      VAL  62   8.769   3.619  -6.836
  513   1HG2  VAL  62          HG21      VAL  62  11.075   5.759  -7.114
  514   2HG2  VAL  62          HG22      VAL  62  12.150   4.702  -8.056
  515   3HG2  VAL  62          HG23      VAL  62  10.425   4.737  -8.412
  516    H    GLN  63           H        GLN  63  14.024   5.026  -5.846
  517    HA   GLN  63           HA       GLN  63  15.968   2.871  -6.373
  518   1HB   GLN  63          HB2       GLN  63  15.464   5.230  -8.244
  519   2HB   GLN  63          HB3       GLN  63  16.933   4.268  -8.273
  520   1HG   GLN  63          HG2       GLN  63  14.150   3.141  -8.814
  521   2HG   GLN  63          HG3       GLN  63  15.286   3.671 -10.041
  522   1HE2  GLN  63          HE21      GLN  63  14.662   1.136  -7.634
  523   2HE2  GLN  63          HE22      GLN  63  15.873   0.026  -8.274
  524    H    GLU  64           H        GLU  64  18.136   3.536  -5.950
  525    HA   GLU  64           HA       GLU  64  18.690   6.181  -4.798
  526   1HB   GLU  64          HB2       GLU  64  17.614   4.830  -2.965
  527   2HB   GLU  64          HB3       GLU  64  18.919   3.645  -3.115
  528   1HG   GLU  64          HG2       GLU  64  20.557   5.315  -2.397
  529   2HG   GLU  64          HG3       GLU  64  19.339   6.588  -2.453
  530    H    ALA  65           H        ALA  65  20.992   6.518  -4.467
  531    HA   ALA  65           HA       ALA  65  22.636   5.529  -6.494
  532   1HB   ALA  65          HB1       ALA  65  22.920   7.684  -5.340
  533   2HB   ALA  65          HB2       ALA  65  23.419   6.838  -3.857
  534   3HB   ALA  65          HB3       ALA  65  24.423   6.749  -5.317
  535    H    GLY  66           H        GLY  66  22.112   4.017  -3.368
  536   1HA   GLY  66          HA2       GLY  66  24.425   2.338  -3.231
  537   2HA   GLY  66          HA3       GLY  66  22.849   2.016  -2.500
  538    H    GLY  67           H        GLY  67  21.623   2.164  -5.341
  539   1HA   GLY  67          HA2       GLY  67  21.549  -0.579  -6.032
  540   2HA   GLY  67          HA3       GLY  67  21.049   0.774  -7.051
  541    H    GLN  68           H        GLN  68  24.042   1.720  -6.771
  542    HA   GLN  68           HA       GLN  68  25.144   0.578  -9.162
  543   1HB   GLN  68          HB2       GLN  68  26.389   2.138  -6.868
  544   2HB   GLN  68          HB3       GLN  68  27.243   1.725  -8.356
  545   1HG   GLN  68          HG2       GLN  68  25.667   3.010  -9.707
  546   2HG   GLN  68          HG3       GLN  68  24.679   3.378  -8.291
  547   1HE2  GLN  68          HE21      GLN  68  25.727   4.660  -6.524
  548   2HE2  GLN  68          HE22      GLN  68  26.960   5.838  -6.983
  549    H    GLY  69           H        GLY  69  25.160  -0.633  -5.875
  550   1HA   GLY  69          HA2       GLY  69  25.877  -3.180  -6.412
  551   2HA   GLY  69          HA3       GLY  69  27.468  -2.429  -6.281
  552    H    GLY  70           H        GLY  70  26.222  -0.581  -4.080
  553   1HA   GLY  70          HA2       GLY  70  25.384  -2.070  -1.858
  554   2HA   GLY  70          HA3       GLY  70  27.147  -2.070  -1.809
  555    H    GLY  71           H        GLY  71  26.124  -0.991   0.299
  556   1HA   GLY  71          HA2       GLY  71  25.358   1.801   0.112
  557   2HA   GLY  71          HA3       GLY  71  25.619   0.860   1.577
  558    H    GLY  72           H        GLY  72  28.430   0.574  -0.210
  559   1HA   GLY  72          HA2       GLY  72  29.783   3.082   0.252
  560   2HA   GLY  72          HA3       GLY  72  30.152   1.930   1.537
  Start of MODEL    2
    1   1H    GLY   1           H1       GLY   1  16.708  -2.068  10.491
    2   2H    GLY   1           H2       GLY   1  17.971  -2.696   9.651
    3   3H    GLY   1           H3       GLY   1  16.997  -3.684  10.526
    4   1HA   GLY   1          HA2       GLY   1  15.114  -3.198   9.098
    5   2HA   GLY   1          HA3       GLY   1  16.182  -2.153   8.141
    6    H    SER   2           H        SER   2  16.150  -3.276   6.236
    7    HA   SER   2           HA       SER   2  16.708  -4.740   4.637
    8   1HB   SER   2          HB2       SER   2  18.852  -5.636   6.578
    9   2HB   SER   2          HB3       SER   2  18.873  -5.808   4.817
   10    HG   SER   2           HG       SER   2  20.032  -3.964   5.513
   11    H    HIS   3           H        HIS   3  15.049  -6.044   7.067
   12    HA   HIS   3           HA       HIS   3  14.990  -8.787   5.889
   13   1HB   HIS   3          HB2       HIS   3  15.128  -8.084   8.848
   14   2HB   HIS   3          HB3       HIS   3  14.916  -9.703   8.190
   15    HD1  HIS   3           HD1      HIS   3  17.144 -10.349   6.374
   16    HD2  HIS   3           HD2      HIS   3  17.589  -7.619   9.537
   17    HE1  HIS   3           HE1      HIS   3  19.638 -10.211   6.849
   18    H    MET   4           H        MET   4  13.173  -6.546   5.456
   19    HA   MET   4           HA       MET   4  10.881  -6.581   7.098
   20   1HB   MET   4          HB2       MET   4  11.031  -5.956   4.115
   21   2HB   MET   4          HB3       MET   4   9.725  -5.490   5.205
   22   1HG   MET   4          HG2       MET   4  12.583  -4.528   5.329
   23   2HG   MET   4          HG3       MET   4  11.180  -3.619   4.766
   24   1HE   MET   4          HE1       MET   4  11.885  -1.598   6.256
   25   2HE   MET   4          HE2       MET   4  12.223  -1.708   7.999
   26   3HE   MET   4          HE3       MET   4  13.293  -2.516   6.831
   27    HA   PRO   5           HA       PRO   5   8.902 -10.425   5.936
   28   1HB   PRO   5          HB2       PRO   5   6.334 -10.012   6.800
   29   2HB   PRO   5          HB3       PRO   5   7.723 -10.238   7.905
   30   1HG   PRO   5          HG2       PRO   5   6.499  -7.631   6.966
   31   2HG   PRO   5          HG3       PRO   5   6.879  -8.133   8.651
   32   1HD   PRO   5          HD2       PRO   5   8.563  -6.563   7.211
   33   2HD   PRO   5          HD3       PRO   5   9.192  -7.827   8.312
   34    H    LEU   6           H        LEU   6   8.184  -7.477   4.414
   35    HA   LEU   6           HA       LEU   6   6.415  -8.703   2.341
   36   1HB   LEU   6          HB2       LEU   6   6.934  -5.806   3.097
   37   2HB   LEU   6          HB3       LEU   6   5.839  -6.345   1.824
   38    HG   LEU   6           HG       LEU   6   5.481  -6.981   4.787
   39   1HD1  LEU   6          HD11      LEU   6   3.649  -5.324   4.665
   40   2HD1  LEU   6          HD12      LEU   6   5.234  -4.601   4.352
   41   3HD1  LEU   6          HD13      LEU   6   4.132  -4.925   2.998
   42   1HD2  LEU   6          HD21      LEU   6   4.405  -8.674   3.370
   43   2HD2  LEU   6          HD22      LEU   6   3.185  -7.630   4.101
   44   3HD2  LEU   6          HD23      LEU   6   3.636  -7.402   2.394
   45    H    GLU   7           H        GLU   7   9.646  -8.401   2.716
   46    HA   GLU   7           HA       GLU   7  10.482  -6.833   0.518
   47   1HB   GLU   7          HB2       GLU   7  12.649  -7.579   0.927
   48   2HB   GLU   7          HB3       GLU   7  11.846  -7.509   2.475
   49   1HG   GLU   7          HG2       GLU   7  13.036  -9.486   2.637
   50   2HG   GLU   7          HG3       GLU   7  11.435 -10.065   2.199
   51    H    PHE   8           H        PHE   8   9.066  -9.976   0.324
   52    HA   PHE   8           HA       PHE   8  10.178 -10.870  -2.146
   53   1HB   PHE   8          HB2       PHE   8   8.198 -12.255  -2.317
   54   2HB   PHE   8          HB3       PHE   8   8.847 -12.289  -0.684
   55    HD1  PHE   8           HD1      PHE   8   6.050 -11.097  -2.816
   56    HD2  PHE   8           HD2      PHE   8   7.546 -11.453   1.214
   57    HE1  PHE   8           HE1      PHE   8   3.804 -10.535  -1.927
   58    HE2  PHE   8           HE2      PHE   8   5.298 -10.890   2.092
   59    HZ   PHE   8           HZ       PHE   8   3.428 -10.418   0.528
   60    H    LEU   9           H        LEU   9   8.062  -8.184  -1.548
   61    HA   LEU   9           HA       LEU   9   6.952  -7.956  -4.222
   62   1HB   LEU   9          HB2       LEU   9   7.259  -5.926  -1.971
   63   2HB   LEU   9          HB3       LEU   9   6.274  -5.710  -3.414
   64    HG   LEU   9           HG       LEU   9   5.768  -7.849  -1.301
   65   1HD1  LEU   9          HD11      LEU   9   5.381  -5.532  -0.490
   66   2HD1  LEU   9          HD12      LEU   9   4.286  -5.247  -1.860
   67   3HD1  LEU   9          HD13      LEU   9   3.883  -6.467  -0.625
   68   1HD2  LEU   9          HD21      LEU   9   4.924  -8.538  -3.490
   69   2HD2  LEU   9          HD22      LEU   9   3.577  -8.065  -2.455
   70   3HD2  LEU   9          HD23      LEU   9   4.143  -6.953  -3.723
   71    H    ARG  10           H        ARG  10  10.095  -7.243  -3.016
   72    HA   ARG  10           HA       ARG  10  10.704  -4.739  -3.895
   73   1HB   ARG  10          HB2       ARG  10  12.981  -5.268  -3.557
   74   2HB   ARG  10          HB3       ARG  10  12.091  -6.317  -2.468
   75   1HG   ARG  10          HG2       ARG  10  12.230  -8.068  -4.441
   76   2HG   ARG  10          HG3       ARG  10  13.437  -6.962  -5.103
   77   1HD   ARG  10          HD2       ARG  10  14.930  -8.215  -4.033
   78   2HD   ARG  10          HD3       ARG  10  14.456  -7.292  -2.605
   79    HE   ARG  10           HE       ARG  10  13.650  -9.255  -1.706
   80   1HH1  ARG  10          HH22      ARG  10  13.596  -9.809  -5.203
   81   2HH1  ARG  10          HH21      ARG  10  13.176 -11.483  -4.976
   82   1HH2  ARG  10          HH12      ARG  10  12.945 -11.297  -1.556
   83   2HH2  ARG  10          HH11      ARG  10  12.827 -12.311  -2.972
   84    H    ASN  11           H        ASN  11  10.370  -7.356  -6.135
   85    HA   ASN  11           HA       ASN  11  11.670  -5.764  -8.323
   86   1HB   ASN  11          HB2       ASN  11  11.183  -8.764  -8.051
   87   2HB   ASN  11          HB3       ASN  11  11.892  -7.976  -9.463
   88   1HD2  ASN  11          HD21      ASN  11  13.929  -6.596  -8.975
   89   2HD2  ASN  11          HD22      ASN  11  15.044  -7.344  -7.833
   90    H    GLN  12           H        GLN  12   8.558  -6.355  -7.206
   91    HA   GLN  12           HA       GLN  12   7.321  -7.262  -9.646
   92   1HB   GLN  12          HB2       GLN  12   6.105  -6.116  -7.109
   93   2HB   GLN  12          HB3       GLN  12   5.206  -6.829  -8.457
   94   1HG   GLN  12          HG2       GLN  12   6.558  -8.954  -8.150
   95   2HG   GLN  12          HG3       GLN  12   7.255  -8.242  -6.692
   96   1HE2  GLN  12          HE21      GLN  12   6.269 -10.375  -5.856
   97   2HE2  GLN  12          HE22      GLN  12   4.589 -10.280  -5.330
   98    HA   PRO  13           HA       PRO  13   7.316  -3.419 -11.872
   99   1HB   PRO  13          HB2       PRO  13   4.706  -4.480 -12.982
  100   2HB   PRO  13          HB3       PRO  13   6.058  -3.692 -13.853
  101   1HG   PRO  13          HG2       PRO  13   5.845  -6.377 -13.877
  102   2HG   PRO  13          HG3       PRO  13   7.447  -5.619 -13.588
  103   1HD   PRO  13          HD2       PRO  13   5.526  -6.789 -11.578
  104   2HD   PRO  13          HD3       PRO  13   7.310  -6.953 -11.687
  105    H    GLN  14           H        GLN  14   4.178  -4.253 -10.312
  106    HA   GLN  14           HA       GLN  14   3.221  -1.499 -10.308
  107   1HB   GLN  14          HB2       GLN  14   2.345  -3.946  -8.720
  108   2HB   GLN  14          HB3       GLN  14   1.529  -2.380  -8.704
  109   1HG   GLN  14          HG2       GLN  14   1.148  -2.554 -11.163
  110   2HG   GLN  14          HG3       GLN  14   1.870  -4.165 -11.147
  111   1HE2  GLN  14          HE21      GLN  14  -0.968  -2.251 -10.139
  112   2HE2  GLN  14          HE22      GLN  14  -1.954  -3.642  -9.727
  113    H    PHE  15           H        PHE  15   5.183  -3.423  -8.061
  114    HA   PHE  15           HA       PHE  15   4.782  -1.689  -5.746
  115   1HB   PHE  15          HB2       PHE  15   5.299  -4.126  -5.631
  116   2HB   PHE  15          HB3       PHE  15   6.903  -3.793  -6.286
  117    HD1  PHE  15           HD1      PHE  15   4.603  -2.870  -3.455
  118    HD2  PHE  15           HD2      PHE  15   8.678  -3.327  -4.783
  119    HE1  PHE  15           HE1      PHE  15   5.402  -2.557  -1.125
  120    HE2  PHE  15           HE2      PHE  15   9.469  -3.020  -2.449
  121    HZ   PHE  15           HZ       PHE  15   7.822  -2.648  -0.616
  122    H    GLN  16           H        GLN  16   7.024  -1.877  -8.426
  123    HA   GLN  16           HA       GLN  16   8.856   0.171  -7.474
  124   1HB   GLN  16          HB2       GLN  16   8.302  -1.119 -10.176
  125   2HB   GLN  16          HB3       GLN  16   9.618   0.034  -9.898
  126   1HG   GLN  16          HG2       GLN  16   9.299  -2.709  -8.590
  127   2HG   GLN  16          HG3       GLN  16  10.477  -2.251  -9.813
  128   1HE2  GLN  16          HE21      GLN  16  12.345  -0.972  -9.154
  129   2HE2  GLN  16          HE22      GLN  16  12.641  -0.632  -7.452
  130    H    GLN  17           H        GLN  17   5.657   0.483  -8.518
  131    HA   GLN  17           HA       GLN  17   6.114   3.312  -9.407
  132   1HB   GLN  17          HB2       GLN  17   4.002   1.295 -10.251
  133   2HB   GLN  17          HB3       GLN  17   4.046   3.001 -10.733
  134   1HG   GLN  17          HG2       GLN  17   6.263   2.653 -11.783
  135   2HG   GLN  17          HG3       GLN  17   6.233   0.953 -11.333
  136   1HE2  GLN  17          HE21      GLN  17   5.009  -0.508 -12.549
  137   2HE2  GLN  17          HE22      GLN  17   4.143  -0.032 -14.017
  138    H    MET  18           H        MET  18   3.730   1.236  -7.588
  139    HA   MET  18           HA       MET  18   1.998   3.305  -6.874
  140   1HB   MET  18          HB2       MET  18   1.156   1.819  -5.228
  141   2HB   MET  18          HB3       MET  18   1.532   0.924  -6.700
  142   1HG   MET  18          HG2       MET  18   3.652   0.111  -5.636
  143   2HG   MET  18          HG3       MET  18   3.261   1.028  -4.182
  144   1HE   MET  18          HE1       MET  18   2.318  -2.197  -6.314
  145   2HE   MET  18          HE2       MET  18   0.895  -2.766  -5.421
  146   3HE   MET  18          HE3       MET  18   0.801  -1.259  -6.353
  147    H    ARG  19           H        ARG  19   5.007   2.408  -5.249
  148    HA   ARG  19           HA       ARG  19   4.605   4.025  -2.877
  149   1HB   ARG  19          HB2       ARG  19   7.233   3.088  -4.138
  150   2HB   ARG  19          HB3       ARG  19   6.958   3.553  -2.454
  151   1HG   ARG  19          HG2       ARG  19   5.257   1.639  -2.345
  152   2HG   ARG  19          HG3       ARG  19   5.839   1.096  -3.895
  153   1HD   ARG  19          HD2       ARG  19   7.779   1.533  -1.607
  154   2HD   ARG  19          HD3       ARG  19   6.895   0.012  -1.806
  155    HE   ARG  19           HE       ARG  19   7.913   0.110  -4.219
  156   1HH1  ARG  19          HH22      ARG  19   9.707   0.943  -1.290
  157   2HH1  ARG  19          HH21      ARG  19  11.195   0.326  -1.946
  158   1HH2  ARG  19          HH12      ARG  19   9.917  -0.663  -4.954
  159   2HH2  ARG  19          HH11      ARG  19  11.285  -0.563  -3.905
  160    H    GLN  20           H        GLN  20   5.875   4.734  -6.039
  161    HA   GLN  20           HA       GLN  20   7.047   7.323  -5.461
  162   1HB   GLN  20          HB2       GLN  20   5.752   6.438  -8.068
  163   2HB   GLN  20          HB3       GLN  20   6.844   7.783  -7.820
  164   1HG   GLN  20          HG2       GLN  20   8.651   6.128  -7.132
  165   2HG   GLN  20          HG3       GLN  20   7.548   4.824  -7.581
  166   1HE2  GLN  20          HE21      GLN  20   8.458   3.972  -9.500
  167   2HE2  GLN  20          HE22      GLN  20   8.873   4.986 -10.876
  168    H    ILE  21           H        ILE  21   3.730   6.214  -6.039
  169    HA   ILE  21           HA       ILE  21   2.593   8.802  -6.467
  170    HB   ILE  21           HB       ILE  21   1.124   6.357  -5.376
  171   1HG1  ILE  21          HG12      ILE  21   1.919   6.953  -8.244
  172   2HG1  ILE  21          HG13      ILE  21   2.423   5.577  -7.270
  173   1HG2  ILE  21          HG21      ILE  21   0.221   8.652  -7.164
  174   2HG2  ILE  21          HG22      ILE  21  -0.804   7.364  -6.486
  175   3HG2  ILE  21          HG23      ILE  21  -0.076   8.553  -5.413
  176   1HD1  ILE  21          HD11      ILE  21  -0.380   6.030  -8.311
  177   2HD1  ILE  21          HD12      ILE  21   0.782   4.775  -8.777
  178   3HD1  ILE  21          HD13      ILE  21   0.088   4.753  -7.151
  179    H    ILE  22           H        ILE  22   2.914   6.652  -3.670
  180    HA   ILE  22           HA       ILE  22   1.513   8.304  -1.764
  181    HB   ILE  22           HB       ILE  22   3.551   6.118  -1.213
  182   1HG1  ILE  22          HG12      ILE  22   1.970   4.976  -2.509
  183   2HG1  ILE  22          HG13      ILE  22   1.453   4.674  -0.869
  184   1HG2  ILE  22          HG21      ILE  22   1.275   7.152   0.531
  185   2HG2  ILE  22          HG22      ILE  22   2.366   5.811   0.912
  186   3HG2  ILE  22          HG23      ILE  22   3.012   7.445   0.798
  187   1HD1  ILE  22          HD11      ILE  22  -0.524   5.115  -2.095
  188   2HD1  ILE  22          HD12      ILE  22  -0.223   6.606  -1.171
  189   3HD1  ILE  22          HD13      ILE  22   0.168   6.529  -2.903
  190    H    GLN  23           H        GLN  23   4.901   8.091  -2.692
  191    HA   GLN  23           HA       GLN  23   5.999   9.938  -0.809
  192   1HB   GLN  23          HB2       GLN  23   6.777   8.848  -3.519
  193   2HB   GLN  23          HB3       GLN  23   7.786  10.069  -2.718
  194   1HG   GLN  23          HG2       GLN  23   8.098   8.655  -0.771
  195   2HG   GLN  23          HG3       GLN  23   6.938   7.474  -1.374
  196   1HE2  GLN  23          HE21      GLN  23   8.331   5.736  -1.420
  197   2HE2  GLN  23          HE22      GLN  23   9.798   5.668  -2.376
  198    H    GLN  24           H        GLN  24   3.676  10.685  -3.088
  199    HA   GLN  24           HA       GLN  24   4.430  13.597  -3.088
  200   1HB   GLN  24          HB2       GLN  24   2.865  12.115  -5.240
  201   2HB   GLN  24          HB3       GLN  24   3.329  13.821  -5.248
  202   1HG   GLN  24          HG2       GLN  24   5.701  13.182  -5.397
  203   2HG   GLN  24          HG3       GLN  24   5.246  11.473  -5.253
  204   1HE2  GLN  24          HE21      GLN  24   4.976  10.353  -7.124
  205   2HE2  GLN  24          HE22      GLN  24   4.716  11.086  -8.709
  206    H    ASN  25           H        ASN  25   1.873  11.191  -3.052
  207    HA   ASN  25           HA       ASN  25   0.124  13.009  -1.451
  208   1HB   ASN  25          HB2       ASN  25  -0.546  11.452  -3.934
  209   2HB   ASN  25          HB3       ASN  25  -1.764  11.604  -2.661
  210   1HD2  ASN  25          HD21      ASN  25  -2.211  13.799  -1.798
  211   2HD2  ASN  25          HD22      ASN  25  -2.205  15.111  -2.977
  212    HA   PRO  26           HA       PRO  26   0.780   9.188   1.051
  213   1HB   PRO  26          HB2       PRO  26   0.845  10.436   3.493
  214   2HB   PRO  26          HB3       PRO  26   2.277  10.253   2.431
  215   1HG   PRO  26          HG2       PRO  26   0.434  12.645   2.665
  216   2HG   PRO  26          HG3       PRO  26   2.230  12.622   2.725
  217   1HD   PRO  26          HD2       PRO  26   0.874  13.227   0.479
  218   2HD   PRO  26          HD3       PRO  26   2.367  12.237   0.387
  219    H    SER  27           H        SER  27  -1.530  11.826   1.051
  220    HA   SER  27           HA       SER  27  -3.672  10.727   2.558
  221   1HB   SER  27          HB2       SER  27  -5.060  12.194   1.069
  222   2HB   SER  27          HB3       SER  27  -3.715  13.011   1.872
  223    HG   SER  27           HG       SER  27  -3.982  13.465  -0.411
  224    H    LEU  28           H        LEU  28  -2.344   9.601  -0.451
  225    HA   LEU  28           HA       LEU  28  -4.779   7.988  -1.035
  226   1HB   LEU  28          HB2       LEU  28  -2.350   8.616  -2.749
  227   2HB   LEU  28          HB3       LEU  28  -3.714   7.612  -3.237
  228    HG   LEU  28           HG       LEU  28  -3.818  10.594  -2.634
  229   1HD1  LEU  28          HD11      LEU  28  -4.326  10.758  -5.034
  230   2HD1  LEU  28          HD12      LEU  28  -2.777   9.932  -4.792
  231   3HD1  LEU  28          HD13      LEU  28  -4.230   8.988  -5.188
  232   1HD2  LEU  28          HD21      LEU  28  -6.061   8.709  -3.482
  233   2HD2  LEU  28          HD22      LEU  28  -5.963   9.621  -1.955
  234   3HD2  LEU  28          HD23      LEU  28  -6.151  10.484  -3.481
  235    H    LEU  29           H        LEU  29  -2.202   7.491   0.911
  236    HA   LEU  29           HA       LEU  29  -1.434   4.814   0.265
  237   1HB   LEU  29          HB2       LEU  29  -0.270   6.117   1.907
  238   2HB   LEU  29          HB3       LEU  29  -1.669   6.297   2.915
  239    HG   LEU  29           HG       LEU  29  -1.685   3.910   3.474
  240   1HD1  LEU  29          HD11      LEU  29   0.242   2.469   2.775
  241   2HD1  LEU  29          HD12      LEU  29  -0.834   2.873   1.437
  242   3HD1  LEU  29          HD13      LEU  29   0.711   3.733   1.606
  243   1HD2  LEU  29          HD21      LEU  29  -0.283   5.451   4.805
  244   2HD2  LEU  29          HD22      LEU  29   0.415   3.824   4.742
  245   3HD2  LEU  29          HD23      LEU  29   1.099   5.119   3.738
  246    HA   PRO  30           HA       PRO  30  -5.563   3.451   2.665
  247   1HB   PRO  30          HB2       PRO  30  -7.182   5.839   1.783
  248   2HB   PRO  30          HB3       PRO  30  -7.331   4.872   3.263
  249   1HG   PRO  30          HG2       PRO  30  -6.149   7.377   3.009
  250   2HG   PRO  30          HG3       PRO  30  -5.780   6.224   4.341
  251   1HD   PRO  30          HD2       PRO  30  -4.083   7.071   2.108
  252   2HD   PRO  30          HD3       PRO  30  -3.649   6.103   3.534
  253    H    ALA  31           H        ALA  31  -5.774   5.637  -0.095
  254    HA   ALA  31           HA       ALA  31  -7.521   4.051  -1.693
  255   1HB   ALA  31          HB1       ALA  31  -7.199   6.538  -1.722
  256   2HB   ALA  31          HB2       ALA  31  -5.649   6.290  -2.550
  257   3HB   ALA  31          HB3       ALA  31  -7.155   5.778  -3.333
  258    H    LEU  32           H        LEU  32  -4.171   3.474  -1.078
  259    HA   LEU  32           HA       LEU  32  -3.821   1.974  -3.632
  260   1HB   LEU  32          HB2       LEU  32  -2.013   3.473  -3.020
  261   2HB   LEU  32          HB3       LEU  32  -1.966   2.778  -1.386
  262    HG   LEU  32           HG       LEU  32  -1.114   0.677  -2.223
  263   1HD1  LEU  32          HD11      LEU  32  -1.252   1.935  -5.000
  264   2HD1  LEU  32          HD12      LEU  32  -0.507   0.362  -4.593
  265   3HD1  LEU  32          HD13      LEU  32  -2.239   0.574  -4.423
  266   1HD2  LEU  32          HD21      LEU  32   0.425   3.027  -3.406
  267   2HD2  LEU  32          HD22      LEU  32   0.423   2.549  -1.694
  268   3HD2  LEU  32          HD23      LEU  32   1.111   1.468  -2.913
  269    H    LEU  33           H        LEU  33  -3.819   1.595  -0.071
  270    HA   LEU  33           HA       LEU  33  -3.706  -1.255   0.079
  271   1HB   LEU  33          HB2       LEU  33  -5.114   0.853   1.755
  272   2HB   LEU  33          HB3       LEU  33  -4.980  -0.839   2.234
  273    HG   LEU  33           HG       LEU  33  -2.448   0.697   1.561
  274   1HD1  LEU  33          HD11      LEU  33  -2.269   1.405   3.897
  275   2HD1  LEU  33          HD12      LEU  33  -3.648   2.153   3.074
  276   3HD1  LEU  33          HD13      LEU  33  -3.920   0.808   4.214
  277   1HD2  LEU  33          HD21      LEU  33  -2.313  -1.741   1.962
  278   2HD2  LEU  33          HD22      LEU  33  -1.480  -0.823   3.229
  279   3HD2  LEU  33          HD23      LEU  33  -3.078  -1.523   3.553
  280    H    GLN  34           H        GLN  34  -6.512   0.945  -0.411
  281    HA   GLN  34           HA       GLN  34  -8.481  -1.038  -0.801
  282   1HB   GLN  34          HB2       GLN  34  -8.948   1.355  -0.496
  283   2HB   GLN  34          HB3       GLN  34  -8.191   1.722  -2.045
  284   1HG   GLN  34          HG2       GLN  34 -10.609   1.791  -2.246
  285   2HG   GLN  34          HG3       GLN  34  -9.972   0.496  -3.241
  286   1HE2  GLN  34          HE21      GLN  34 -10.308  -1.764  -2.476
  287   2HE2  GLN  34          HE22      GLN  34 -11.636  -2.084  -1.360
  288    H    GLN  35           H        GLN  35  -5.989   0.097  -3.141
  289    HA   GLN  35           HA       GLN  35  -7.353  -1.261  -5.381
  290   1HB   GLN  35          HB2       GLN  35  -4.713   0.229  -5.118
  291   2HB   GLN  35          HB3       GLN  35  -5.142  -0.678  -6.572
  292   1HG   GLN  35          HG2       GLN  35  -7.137   0.661  -6.927
  293   2HG   GLN  35          HG3       GLN  35  -6.893   1.522  -5.409
  294   1HE2  GLN  35          HE21      GLN  35  -5.410   3.252  -5.359
  295   2HE2  GLN  35          HE22      GLN  35  -4.549   3.811  -6.799
  296    H    ILE  36           H        ILE  36  -4.580  -1.906  -3.253
  297    HA   ILE  36           HA       ILE  36  -3.862  -4.463  -4.333
  298    HB   ILE  36           HB       ILE  36  -3.722  -3.401  -1.514
  299   1HG1  ILE  36          HG12      ILE  36  -1.433  -3.683  -3.511
  300   2HG1  ILE  36          HG13      ILE  36  -2.402  -2.217  -3.439
  301   1HG2  ILE  36          HG21      ILE  36  -2.251  -5.816  -2.743
  302   2HG2  ILE  36          HG22      ILE  36  -2.085  -5.226  -1.080
  303   3HG2  ILE  36          HG23      ILE  36  -3.591  -5.952  -1.611
  304   1HD1  ILE  36          HD11      ILE  36  -0.773  -3.342  -1.146
  305   2HD1  ILE  36          HD12      ILE  36  -0.419  -1.904  -2.125
  306   3HD1  ILE  36          HD13      ILE  36  -1.837  -1.918  -1.055
  307    H    GLY  37           H        GLY  37  -6.375  -3.523  -1.859
  308   1HA   GLY  37          HA2       GLY  37  -7.470  -6.068  -1.437
  309   2HA   GLY  37          HA3       GLY  37  -8.335  -4.533  -1.299
  310    H    ARG  38           H        ARG  38  -8.064  -3.910  -4.220
  311    HA   ARG  38           HA       ARG  38 -10.304  -5.481  -5.271
  312   1HB   ARG  38          HB2       ARG  38  -8.549  -3.316  -6.481
  313   2HB   ARG  38          HB3       ARG  38  -9.816  -4.142  -7.380
  314   1HG   ARG  38          HG2       ARG  38 -10.275  -2.559  -4.826
  315   2HG   ARG  38          HG3       ARG  38 -10.537  -1.977  -6.476
  316   1HD   ARG  38          HD2       ARG  38 -12.028  -4.241  -5.103
  317   2HD   ARG  38          HD3       ARG  38 -12.629  -2.619  -5.450
  318    HE   ARG  38           HE       ARG  38 -12.002  -3.408  -7.946
  319   1HH1  ARG  38          HH22      ARG  38 -13.899  -5.085  -5.515
  320   2HH1  ARG  38          HH21      ARG  38 -14.809  -5.974  -6.716
  321   1HH2  ARG  38          HH12      ARG  38 -13.186  -4.576  -9.412
  322   2HH2  ARG  38          HH11      ARG  38 -14.419  -5.678  -8.858
  323    H    GLU  39           H        GLU  39  -6.798  -5.336  -6.138
  324    HA   GLU  39           HA       GLU  39  -7.162  -7.406  -8.166
  325   1HB   GLU  39          HB2       GLU  39  -4.790  -5.802  -7.122
  326   2HB   GLU  39          HB3       GLU  39  -4.727  -6.963  -8.457
  327   1HG   GLU  39          HG2       GLU  39  -6.559  -5.588  -9.580
  328   2HG   GLU  39          HG3       GLU  39  -6.255  -4.339  -8.367
  329    H    ASN  40           H        ASN  40  -5.833  -7.233  -4.915
  330    HA   ASN  40           HA       ASN  40  -5.183 -10.121  -4.802
  331   1HB   ASN  40          HB2       ASN  40  -3.248  -7.814  -4.272
  332   2HB   ASN  40          HB3       ASN  40  -2.997  -9.497  -3.787
  333   1HD2  ASN  40          HD21      ASN  40  -1.878 -10.788  -5.032
  334   2HD2  ASN  40          HD22      ASN  40  -1.335 -10.310  -6.637
  335    HA   PRO  41           HA       PRO  41  -7.151  -8.172  -0.921
  336   1HB   PRO  41          HB2       PRO  41  -8.977 -10.188  -0.433
  337   2HB   PRO  41          HB3       PRO  41  -9.286  -8.738  -1.441
  338   1HG   PRO  41          HG2       PRO  41  -8.409 -11.472  -2.372
  339   2HG   PRO  41          HG3       PRO  41  -9.768 -10.473  -2.997
  340   1HD   PRO  41          HD2       PRO  41  -7.395 -10.478  -4.254
  341   2HD   PRO  41          HD3       PRO  41  -8.252  -8.927  -4.014
  342    H    GLN  42           H        GLN  42  -5.727 -11.248  -1.743
  343    HA   GLN  42           HA       GLN  42  -5.268 -12.199   0.963
  344   1HB   GLN  42          HB2       GLN  42  -3.757 -13.069  -1.528
  345   2HB   GLN  42          HB3       GLN  42  -4.113 -13.979  -0.063
  346   1HG   GLN  42          HG2       GLN  42  -5.760 -14.889  -1.322
  347   2HG   GLN  42          HG3       GLN  42  -6.647 -13.430  -0.849
  348   1HE2  GLN  42          HE21      GLN  42  -6.810 -15.187  -3.373
  349   2HE2  GLN  42          HE22      GLN  42  -6.606 -14.019  -4.674
  350    H    LEU  43           H        LEU  43  -3.306 -10.485  -1.495
  351    HA   LEU  43           HA       LEU  43  -0.949 -10.186   0.191
  352   1HB   LEU  43          HB2       LEU  43  -0.939  -9.933  -2.307
  353   2HB   LEU  43          HB3       LEU  43  -1.957  -8.514  -2.176
  354    HG   LEU  43           HG       LEU  43  -0.247  -7.276  -1.015
  355   1HD1  LEU  43          HD11      LEU  43   0.910  -9.025   0.269
  356   2HD1  LEU  43          HD12      LEU  43   1.486  -9.779  -1.239
  357   3HD1  LEU  43          HD13      LEU  43   2.060  -8.165  -0.743
  358   1HD2  LEU  43          HD21      LEU  43   1.365  -7.070  -2.828
  359   2HD2  LEU  43          HD22      LEU  43   0.904  -8.667  -3.462
  360   3HD2  LEU  43          HD23      LEU  43  -0.258  -7.321  -3.486
  361    H    LEU  44           H        LEU  44  -4.024  -8.563  -0.191
  362    HA   LEU  44           HA       LEU  44  -3.203  -6.121   1.112
  363   1HB   LEU  44          HB2       LEU  44  -5.267  -6.501  -0.369
  364   2HB   LEU  44          HB3       LEU  44  -6.057  -7.204   1.007
  365    HG   LEU  44           HG       LEU  44  -6.289  -4.655   0.304
  366   1HD1  LEU  44          HD11      LEU  44  -7.151  -4.112   2.452
  367   2HD1  LEU  44          HD12      LEU  44  -7.614  -5.746   1.978
  368   3HD1  LEU  44          HD13      LEU  44  -6.322  -5.510   3.197
  369   1HD2  LEU  44          HD21      LEU  44  -5.097  -3.102   1.719
  370   2HD2  LEU  44          HD22      LEU  44  -4.149  -4.390   2.462
  371   3HD2  LEU  44          HD23      LEU  44  -3.923  -3.995   0.738
  372    H    GLN  45           H        GLN  45  -5.224  -8.745   2.281
  373    HA   GLN  45           HA       GLN  45  -5.180  -8.247   5.062
  374   1HB   GLN  45          HB2       GLN  45  -5.268 -10.867   3.524
  375   2HB   GLN  45          HB3       GLN  45  -5.441 -10.792   5.273
  376   1HG   GLN  45          HG2       GLN  45  -7.262  -9.338   3.304
  377   2HG   GLN  45          HG3       GLN  45  -7.626 -10.881   4.081
  378   1HE2  GLN  45          HE21      GLN  45  -8.314  -7.630   4.315
  379   2HE2  GLN  45          HE22      GLN  45  -8.646  -7.570   6.042
  380    H    GLN  46           H        GLN  46  -2.521  -9.669   3.147
  381    HA   GLN  46           HA       GLN  46  -0.878 -10.265   5.497
  382   1HB   GLN  46          HB2       GLN  46  -0.498 -10.166   2.484
  383   2HB   GLN  46          HB3       GLN  46   0.886 -10.306   3.552
  384   1HG   GLN  46          HG2       GLN  46  -0.074 -12.345   4.573
  385   2HG   GLN  46          HG3       GLN  46  -1.529 -12.188   3.597
  386   1HE2  GLN  46          HE21      GLN  46  -1.384 -12.521   1.289
  387   2HE2  GLN  46          HE22      GLN  46  -0.053 -13.474   0.611
  388    H    ILE  47           H        ILE  47  -0.946  -7.557   3.119
  389    HA   ILE  47           HA       ILE  47   1.242  -6.119   4.286
  390    HB   ILE  47           HB       ILE  47  -1.022  -5.408   2.417
  391   1HG1  ILE  47          HG12      ILE  47   2.028  -5.466   2.182
  392   2HG1  ILE  47          HG13      ILE  47   0.955  -6.776   1.684
  393   1HG2  ILE  47          HG21      ILE  47  -0.704  -3.347   3.712
  394   2HG2  ILE  47          HG22      ILE  47   1.059  -3.468   3.499
  395   3HG2  ILE  47          HG23      ILE  47  -0.012  -3.150   2.114
  396   1HD1  ILE  47          HD11      ILE  47   1.169  -4.020   0.436
  397   2HD1  ILE  47          HD12      ILE  47   1.572  -5.587  -0.281
  398   3HD1  ILE  47          HD13      ILE  47  -0.128  -5.189   0.067
  399    H    SER  48           H        SER  48  -2.263  -6.077   5.007
  400    HA   SER  48           HA       SER  48  -2.092  -3.840   6.824
  401   1HB   SER  48          HB2       SER  48  -4.311  -4.423   7.549
  402   2HB   SER  48          HB3       SER  48  -4.205  -4.516   5.787
  403    HG   SER  48           HG       SER  48  -5.293  -6.310   6.783
  404    H    GLN  49           H        GLN  49  -1.717  -7.322   7.290
  405    HA   GLN  49           HA       GLN  49  -1.355  -7.304  10.144
  406   1HB   GLN  49          HB2       GLN  49  -0.751  -9.198   7.865
  407   2HB   GLN  49          HB3       GLN  49  -0.074  -9.534   9.456
  408   1HG   GLN  49          HG2       GLN  49  -2.324  -9.466  10.469
  409   2HG   GLN  49          HG3       GLN  49  -3.038  -9.095   8.898
  410   1HE2  GLN  49          HE21      GLN  49  -2.969 -10.762   7.230
  411   2HE2  GLN  49          HE22      GLN  49  -2.791 -12.463   7.692
  412    H    HIS  50           H        HIS  50   0.694  -6.006   7.732
  413    HA   HIS  50           HA       HIS  50   3.005  -5.877   9.612
  414   1HB   HIS  50          HB2       HIS  50   3.116  -6.627   6.664
  415   2HB   HIS  50          HB3       HIS  50   4.507  -6.420   7.734
  416    HD1  HIS  50           HD1      HIS  50   1.951  -8.978   6.733
  417    HD2  HIS  50           HD2      HIS  50   4.754  -8.327   9.782
  418    HE1  HIS  50           HE1      HIS  50   2.324 -11.243   7.850
  419    H    GLN  51           H        GLN  51   0.905  -3.879   8.767
  420    HA   GLN  51           HA       GLN  51   1.774  -2.367   6.639
  421   1HB   GLN  51          HB2       GLN  51  -0.493  -2.503   7.921
  422   2HB   GLN  51          HB3       GLN  51   0.121  -1.119   8.839
  423   1HG   GLN  51          HG2       GLN  51   0.418   0.130   6.707
  424   2HG   GLN  51          HG3       GLN  51  -0.103  -1.293   5.797
  425   1HE2  GLN  51          HE21      GLN  51  -1.216   1.628   7.150
  426   2HE2  GLN  51          HE22      GLN  51  -2.932   1.223   7.130
  427    H    GLU  52           H        GLU  52   2.987  -2.060   9.914
  428    HA   GLU  52           HA       GLU  52   4.237   0.539   9.640
  429   1HB   GLU  52          HB2       GLU  52   5.012  -1.903  11.289
  430   2HB   GLU  52          HB3       GLU  52   5.779  -0.316  11.412
  431   1HG   GLU  52          HG2       GLU  52   3.588   0.693  12.023
  432   2HG   GLU  52          HG3       GLU  52   2.839  -0.897  11.963
  433    H    HIS  53           H        HIS  53   5.304  -2.771   8.751
  434    HA   HIS  53           HA       HIS  53   7.899  -1.896   7.758
  435   1HB   HIS  53          HB2       HIS  53   6.385  -4.489   7.285
  436   2HB   HIS  53          HB3       HIS  53   8.077  -4.180   6.908
  437    HD1  HIS  53           HD1      HIS  53   9.251  -3.008   9.487
  438    HD2  HIS  53           HD2      HIS  53   6.239  -5.932   9.453
  439    HE1  HIS  53           HE1      HIS  53   9.386  -4.192  11.733
  440    H    PHE  54           H        PHE  54   4.678  -2.427   6.323
  441    HA   PHE  54           HA       PHE  54   5.425  -1.862   3.588
  442   1HB   PHE  54          HB2       PHE  54   3.200  -2.774   4.402
  443   2HB   PHE  54          HB3       PHE  54   2.827  -1.161   5.003
  444    HD1  PHE  54           HD1      PHE  54   4.273  -2.451   1.736
  445    HD2  PHE  54           HD2      PHE  54   1.135  -0.236   3.702
  446    HE1  PHE  54           HE1      PHE  54   3.249  -1.930  -0.464
  447    HE2  PHE  54           HE2      PHE  54   0.104   0.245   1.498
  448    HZ   PHE  54           HZ       PHE  54   1.171  -0.584  -0.586
  449    H    ILE  55           H        ILE  55   4.387   0.421   6.187
  450    HA   ILE  55           HA       ILE  55   4.891   2.791   4.716
  451    HB   ILE  55           HB       ILE  55   4.781   2.201   7.629
  452   1HG1  ILE  55          HG12      ILE  55   3.072   3.859   5.710
  453   2HG1  ILE  55          HG13      ILE  55   2.761   2.164   6.093
  454   1HG2  ILE  55          HG21      ILE  55   4.861   4.679   8.032
  455   2HG2  ILE  55          HG22      ILE  55   6.398   4.079   7.444
  456   3HG2  ILE  55          HG23      ILE  55   5.311   4.932   6.333
  457   1HD1  ILE  55          HD11      ILE  55   2.510   2.772   8.493
  458   2HD1  ILE  55          HD12      ILE  55   2.631   4.493   8.022
  459   3HD1  ILE  55          HD13      ILE  55   1.299   3.495   7.409
  460    H    GLN  56           H        GLN  56   7.236   0.874   6.714
  461    HA   GLN  56           HA       GLN  56   9.452   2.609   6.297
  462   1HB   GLN  56          HB2       GLN  56   9.316  -0.380   6.815
  463   2HB   GLN  56          HB3       GLN  56  10.833   0.517   6.714
  464   1HG   GLN  56          HG2       GLN  56  10.221   1.957   8.560
  465   2HG   GLN  56          HG3       GLN  56   8.623   1.240   8.686
  466   1HE2  GLN  56          HE21      GLN  56  11.354   1.300  10.398
  467   2HE2  GLN  56          HE22      GLN  56  11.393  -0.366  10.966
  468    H    MET  57           H        MET  57   8.350  -0.117   4.211
  469    HA   MET  57           HA       MET  57  10.477   0.297   2.249
  470   1HB   MET  57          HB2       MET  57   7.860  -1.255   2.116
  471   2HB   MET  57          HB3       MET  57   9.106  -1.242   0.857
  472   1HG   MET  57          HG2       MET  57  10.754  -2.132   2.518
  473   2HG   MET  57          HG3       MET  57   9.459  -2.228   3.709
  474   1HE   MET  57          HE1       MET  57   9.872  -4.843  -0.091
  475   2HE   MET  57          HE2       MET  57  10.064  -3.083  -0.051
  476   3HE   MET  57          HE3       MET  57  11.266  -4.117   0.745
  477    H    LEU  58           H        LEU  58   7.193   1.504   2.614
  478    HA   LEU  58           HA       LEU  58   6.736   2.609   0.032
  479   1HB   LEU  58          HB2       LEU  58   5.683   2.776   2.818
  480   2HB   LEU  58          HB3       LEU  58   5.312   4.184   1.825
  481    HG   LEU  58           HG       LEU  58   4.648   1.330   0.996
  482   1HD1  LEU  58          HD11      LEU  58   3.481   1.868   3.100
  483   2HD1  LEU  58          HD12      LEU  58   2.996   3.448   2.464
  484   3HD1  LEU  58          HD13      LEU  58   2.347   1.955   1.741
  485   1HD2  LEU  58          HD21      LEU  58   4.788   3.140  -0.769
  486   2HD2  LEU  58          HD22      LEU  58   3.145   2.471  -0.568
  487   3HD2  LEU  58          HD23      LEU  58   3.581   4.053   0.136
  488    H    ASN  59           H        ASN  59   8.354   3.897   2.844
  489    HA   ASN  59           HA       ASN  59   8.302   6.650   1.855
  490   1HB   ASN  59          HB2       ASN  59   7.551   5.759   4.129
  491   2HB   ASN  59          HB3       ASN  59   9.262   5.552   4.524
  492   1HD2  ASN  59          HD21      ASN  59   8.357   6.954   6.315
  493   2HD2  ASN  59          HD22      ASN  59   8.330   8.695   6.052
  494    H    GLU  60           H        GLU  60  10.170   4.752   0.565
  495    HA   GLU  60           HA       GLU  60  12.663   6.314   0.760
  496   1HB   GLU  60          HB2       GLU  60  14.075   4.381   1.057
  497   2HB   GLU  60          HB3       GLU  60  12.930   4.506   2.396
  498   1HG   GLU  60          HG2       GLU  60  11.536   2.757   1.430
  499   2HG   GLU  60          HG3       GLU  60  12.560   2.720  -0.015
  500    HA   PRO  61           HA       PRO  61  12.821   6.036  -3.594
  501   1HB   PRO  61          HB2       PRO  61  15.644   5.000  -3.489
  502   2HB   PRO  61          HB3       PRO  61  14.965   6.421  -4.362
  503   1HG   PRO  61          HG2       PRO  61  16.413   6.730  -2.093
  504   2HG   PRO  61          HG3       PRO  61  15.001   7.760  -2.484
  505   1HD   PRO  61          HD2       PRO  61  15.171   5.464  -0.563
  506   2HD   PRO  61          HD3       PRO  61  14.252   7.012  -0.478
  507    H    VAL  62           H        VAL  62  12.117   4.607  -5.135
  508    HA   VAL  62           HA       VAL  62  11.903   1.815  -4.577
  509    HB   VAL  62           HB       VAL  62  10.857   1.665  -6.759
  510   1HG1  VAL  62          HG11      VAL  62   9.582   2.550  -4.803
  511   2HG1  VAL  62          HG12      VAL  62   9.914   4.202  -5.362
  512   3HG1  VAL  62          HG13      VAL  62   8.962   3.094  -6.369
  513   1HG2  VAL  62          HG21      VAL  62  10.535   3.622  -8.211
  514   2HG2  VAL  62          HG22      VAL  62  11.629   4.586  -7.203
  515   3HG2  VAL  62          HG23      VAL  62  12.238   3.181  -8.112
  516    H    GLN  63           H        GLN  63  14.447   3.578  -6.078
  517    HA   GLN  63           HA       GLN  63  15.977   1.147  -6.607
  518   1HB   GLN  63          HB2       GLN  63  16.455   1.644  -8.936
  519   2HB   GLN  63          HB3       GLN  63  14.721   1.451  -8.721
  520   1HG   GLN  63          HG2       GLN  63  14.453   3.947  -8.737
  521   2HG   GLN  63          HG3       GLN  63  16.195   4.117  -8.937
  522   1HE2  GLN  63          HE21      GLN  63  16.084   5.171 -10.967
  523   2HE2  GLN  63          HE22      GLN  63  15.523   4.330 -12.410
  524    H    GLU  64           H        GLU  64  18.243   1.707  -7.282
  525    HA   GLU  64           HA       GLU  64  19.153   4.414  -6.348
  526   1HB   GLU  64          HB2       GLU  64  20.416   1.707  -5.785
  527   2HB   GLU  64          HB3       GLU  64  21.138   3.276  -5.392
  528   1HG   GLU  64          HG2       GLU  64  19.170   3.799  -3.949
  529   2HG   GLU  64          HG3       GLU  64  18.541   2.181  -4.247
  530    H    ALA  65           H        ALA  65  19.052   2.410  -9.039
  531    HA   ALA  65           HA       ALA  65  21.664   2.822 -10.164
  532   1HB   ALA  65          HB1       ALA  65  20.122   1.016 -10.841
  533   2HB   ALA  65          HB2       ALA  65  18.983   2.219 -11.486
  534   3HB   ALA  65          HB3       ALA  65  20.583   2.017 -12.226
  535    H    GLY  66           H        GLY  66  18.885   4.931  -9.961
  536   1HA   GLY  66          HA2       GLY  66  20.181   7.285 -10.666
  537   2HA   GLY  66          HA3       GLY  66  19.469   6.700 -12.171
  538    H    GLY  67           H        GLY  67  18.677   9.097 -11.230
  539   1HA   GLY  67          HA2       GLY  67  15.801   8.818 -10.843
  540   2HA   GLY  67          HA3       GLY  67  16.635   9.386  -9.394
  541    H    GLN  68           H        GLN  68  17.536  10.214 -12.740
  542    HA   GLN  68           HA       GLN  68  16.391  12.905 -12.612
  543   1HB   GLN  68          HB2       GLN  68  18.501  14.087 -12.820
  544   2HB   GLN  68          HB3       GLN  68  18.455  13.190 -11.312
  545   1HG   GLN  68          HG2       GLN  68  19.897  11.424 -12.290
  546   2HG   GLN  68          HG3       GLN  68  19.936  12.287 -13.828
  547   1HE2  GLN  68          HE21      GLN  68  21.817  11.739 -11.151
  548   2HE2  GLN  68          HE22      GLN  68  22.713  13.252 -11.154
  549    H    GLY  69           H        GLY  69  17.074  14.187 -14.619
  550   1HA   GLY  69          HA2       GLY  69  17.358  12.449 -17.046
  551   2HA   GLY  69          HA3       GLY  69  16.029  13.596 -16.874
  552    H    GLY  70           H        GLY  70  19.208  14.460 -15.681
  553   1HA   GLY  70          HA2       GLY  70  20.037  15.918 -18.111
  554   2HA   GLY  70          HA3       GLY  70  19.529  16.917 -16.746
  555    H    GLY  71           H        GLY  71  21.211  13.854 -16.228
  556   1HA   GLY  71          HA2       GLY  71  23.907  14.630 -16.165
  557   2HA   GLY  71          HA3       GLY  71  23.242  15.022 -14.578
  558    H    GLY  72           H        GLY  72  25.138  13.346 -14.322
  559   1HA   GLY  72          HA2       GLY  72  24.105  10.945 -13.192
  560   2HA   GLY  72          HA3       GLY  72  24.784  10.557 -14.771
  Start of MODEL    3
    1   1H    GLY   1           H1       GLY   1  17.467 -10.282   0.910
    2   2H    GLY   1           H2       GLY   1  15.989 -10.267   1.631
    3   3H    GLY   1           H3       GLY   1  16.411 -11.521   0.659
    4   1HA   GLY   1          HA2       GLY   1  18.137 -12.193   2.208
    5   2HA   GLY   1          HA3       GLY   1  17.650 -10.836   3.243
    6    H    SER   2           H        SER   2  16.951 -11.990   4.991
    7    HA   SER   2           HA       SER   2  14.441 -13.537   4.820
    8   1HB   SER   2          HB2       SER   2  15.500 -15.479   5.992
    9   2HB   SER   2          HB3       SER   2  16.078 -15.235   4.346
   10    HG   SER   2           HG       SER   2  17.786 -15.628   5.828
   11    H    HIS   3           H        HIS   3  14.804 -11.029   5.969
   12    HA   HIS   3           HA       HIS   3  15.328 -11.453   8.884
   13   1HB   HIS   3          HB2       HIS   3  15.946  -8.935   7.347
   14   2HB   HIS   3          HB3       HIS   3  16.614  -9.480   8.881
   15    HD1  HIS   3           HD1      HIS   3  18.030 -12.111   8.302
   16    HD2  HIS   3           HD2      HIS   3  17.587  -9.108   5.397
   17    HE1  HIS   3           HE1      HIS   3  19.728 -12.628   6.481
   18    H    MET   4           H        MET   4  13.109 -10.051   6.601
   19    HA   MET   4           HA       MET   4  11.406  -8.965   8.795
   20   1HB   MET   4          HB2       MET   4  12.263  -7.602   6.201
   21   2HB   MET   4          HB3       MET   4  10.876  -7.063   7.141
   22   1HG   MET   4          HG2       MET   4  13.698  -7.181   8.203
   23   2HG   MET   4          HG3       MET   4  12.905  -5.742   7.551
   24   1HE   MET   4          HE1       MET   4  13.570  -4.417   9.739
   25   2HE   MET   4          HE2       MET   4  13.165  -4.958  11.382
   26   3HE   MET   4          HE3       MET   4  14.324  -5.883  10.406
   27    HA   PRO   5           HA       PRO   5   8.106 -10.757   6.196
   28   1HB   PRO   5          HB2       PRO   5   5.951  -9.266   6.911
   29   2HB   PRO   5          HB3       PRO   5   6.682 -10.467   8.019
   30   1HG   PRO   5          HG2       PRO   5   7.174  -7.483   7.919
   31   2HG   PRO   5          HG3       PRO   5   6.774  -8.478   9.360
   32   1HD   PRO   5          HD2       PRO   5   9.337  -7.790   8.732
   33   2HD   PRO   5          HD3       PRO   5   8.948  -9.380   9.450
   34    H    LEU   6           H        LEU   6   6.805 -10.073   4.379
   35    HA   LEU   6           HA       LEU   6   6.382  -9.072   2.415
   36   1HB   LEU   6          HB2       LEU   6   6.879  -6.451   3.846
   37   2HB   LEU   6          HB3       LEU   6   5.960  -6.688   2.371
   38    HG   LEU   6           HG       LEU   6   5.139  -7.724   5.116
   39   1HD1  LEU   6          HD11      LEU   6   3.414  -5.947   4.932
   40   2HD1  LEU   6          HD12      LEU   6   5.058  -5.292   4.954
   41   3HD1  LEU   6          HD13      LEU   6   4.164  -5.392   3.418
   42   1HD2  LEU   6          HD21      LEU   6   3.614  -7.689   2.470
   43   2HD2  LEU   6          HD22      LEU   6   4.221  -9.142   3.300
   44   3HD2  LEU   6          HD23      LEU   6   2.955  -8.160   4.049
   45    H    GLU   7           H        GLU   7   9.592  -8.625   3.559
   46    HA   GLU   7           HA       GLU   7  10.616  -6.785   1.778
   47   1HB   GLU   7          HB2       GLU   7  12.794  -7.592   2.261
   48   2HB   GLU   7          HB3       GLU   7  11.822  -7.694   3.723
   49   1HG   GLU   7          HG2       GLU   7  11.593 -10.127   3.449
   50   2HG   GLU   7          HG3       GLU   7  12.413 -10.067   1.894
   51    H    PHE   8           H        PHE   8   9.805 -10.061   0.915
   52    HA   PHE   8           HA       PHE   8  11.288 -10.301  -1.517
   53   1HB   PHE   8          HB2       PHE   8   8.610 -11.559  -0.844
   54   2HB   PHE   8          HB3       PHE   8   9.843 -12.180  -1.942
   55    HD1  PHE   8           HD1      PHE   8   8.580 -12.253   1.426
   56    HD2  PHE   8           HD2      PHE   8  12.180 -12.758  -0.893
   57    HE1  PHE   8           HE1      PHE   8   9.641 -13.444   3.327
   58    HE2  PHE   8           HE2      PHE   8  13.232 -13.955   1.012
   59    HZ   PHE   8           HZ       PHE   8  11.968 -14.293   3.123
   60    H    LEU   9           H        LEU   9   8.700  -8.209  -0.808
   61    HA   LEU   9           HA       LEU   9   7.616  -8.051  -3.565
   62   1HB   LEU   9          HB2       LEU   9   6.886  -6.562  -1.018
   63   2HB   LEU   9          HB3       LEU   9   5.993  -6.536  -2.526
   64    HG   LEU   9           HG       LEU   9   6.380  -9.074  -0.863
   65   1HD1  LEU   9          HD11      LEU   9   4.053  -7.132  -0.966
   66   2HD1  LEU   9          HD12      LEU   9   4.093  -8.694  -0.094
   67   3HD1  LEU   9          HD13      LEU   9   5.161  -7.372   0.401
   68   1HD2  LEU   9          HD21      LEU   9   4.465  -8.387  -3.138
   69   2HD2  LEU   9          HD22      LEU   9   5.844  -9.508  -3.236
   70   3HD2  LEU   9          HD23      LEU   9   4.466  -9.893  -2.195
   71    H    ARG  10           H        ARG  10   9.930  -6.526  -1.520
   72    HA   ARG  10           HA       ARG  10   9.566  -3.832  -1.869
   73   1HB   ARG  10          HB2       ARG  10  11.076  -5.147  -0.293
   74   2HB   ARG  10          HB3       ARG  10  12.284  -5.182  -1.585
   75   1HG   ARG  10          HG2       ARG  10  12.361  -2.720  -1.572
   76   2HG   ARG  10          HG3       ARG  10  11.033  -2.682  -0.390
   77   1HD   ARG  10          HD2       ARG  10  12.487  -3.914   1.233
   78   2HD   ARG  10          HD3       ARG  10  13.812  -3.852   0.059
   79    HE   ARG  10           HE       ARG  10  13.734  -1.378   0.200
   80   1HH1  ARG  10          HH22      ARG  10  12.317  -2.965   3.019
   81   2HH1  ARG  10          HH21      ARG  10  12.158  -1.404   3.816
   82   1HH2  ARG  10          HH12      ARG  10  13.588   0.352   1.266
   83   2HH2  ARG  10          HH11      ARG  10  12.758   0.433   2.829
   84    H    ASN  11           H        ASN  11  11.162  -5.919  -4.171
   85    HA   ASN  11           HA       ASN  11  11.989  -3.573  -5.825
   86   1HB   ASN  11          HB2       ASN  11  12.951  -6.463  -5.819
   87   2HB   ASN  11          HB3       ASN  11  13.577  -5.180  -6.855
   88   1HD2  ASN  11          HD21      ASN  11  15.398  -6.520  -5.427
   89   2HD2  ASN  11          HD22      ASN  11  15.971  -5.517  -4.095
   90    H    GLN  12           H        GLN  12   9.328  -5.546  -5.780
   91    HA   GLN  12           HA       GLN  12   9.320  -6.629  -8.434
   92   1HB   GLN  12          HB2       GLN  12   7.010  -6.064  -6.534
   93   2HB   GLN  12          HB3       GLN  12   6.902  -7.068  -7.972
   94   1HG   GLN  12          HG2       GLN  12   8.640  -7.642  -5.536
   95   2HG   GLN  12          HG3       GLN  12   7.095  -8.409  -5.913
   96   1HE2  GLN  12          HE21      GLN  12   9.502  -9.846  -5.417
   97   2HE2  GLN  12          HE22      GLN  12   9.945 -10.647  -6.920
   98    HA   PRO  13           HA       PRO  13   8.267  -3.390 -11.158
   99   1HB   PRO  13          HB2       PRO  13   5.899  -5.038 -12.069
  100   2HB   PRO  13          HB3       PRO  13   7.108  -4.165 -13.059
  101   1HG   PRO  13          HG2       PRO  13   7.361  -6.820 -12.697
  102   2HG   PRO  13          HG3       PRO  13   8.805  -5.768 -12.529
  103   1HD   PRO  13          HD2       PRO  13   7.061  -6.933 -10.359
  104   2HD   PRO  13          HD3       PRO  13   8.849  -6.841 -10.453
  105    H    GLN  14           H        GLN  14   5.374  -4.495  -9.342
  106    HA   GLN  14           HA       GLN  14   3.939  -1.968  -9.725
  107   1HB   GLN  14          HB2       GLN  14   3.509  -4.255  -7.760
  108   2HB   GLN  14          HB3       GLN  14   2.422  -2.881  -7.989
  109   1HG   GLN  14          HG2       GLN  14   2.102  -3.523 -10.369
  110   2HG   GLN  14          HG3       GLN  14   3.104  -4.953 -10.117
  111   1HE2  GLN  14          HE21      GLN  14  -0.120  -3.839 -10.068
  112   2HE2  GLN  14          HE22      GLN  14  -0.792  -5.149  -9.115
  113    H    PHE  15           H        PHE  15   6.194  -3.230  -7.304
  114    HA   PHE  15           HA       PHE  15   5.665  -1.113  -5.330
  115   1HB   PHE  15          HB2       PHE  15   7.561  -3.462  -5.491
  116   2HB   PHE  15          HB3       PHE  15   7.729  -2.215  -4.259
  117    HD1  PHE  15           HD1      PHE  15   5.176  -4.631  -5.647
  118    HD2  PHE  15           HD2      PHE  15   6.509  -2.317  -2.258
  119    HE1  PHE  15           HE1      PHE  15   3.396  -5.643  -4.251
  120    HE2  PHE  15           HE2      PHE  15   4.754  -3.367  -0.861
  121    HZ   PHE  15           HZ       PHE  15   3.170  -5.001  -1.860
  122    H    GLN  16           H        GLN  16   7.817  -1.600  -8.039
  123    HA   GLN  16           HA       GLN  16   9.536   0.679  -7.600
  124   1HB   GLN  16          HB2       GLN  16   8.564  -0.798 -10.070
  125   2HB   GLN  16          HB3       GLN  16   9.724   0.533 -10.142
  126   1HG   GLN  16          HG2       GLN  16  11.334  -0.717  -8.787
  127   2HG   GLN  16          HG3       GLN  16  10.177  -2.025  -8.551
  128   1HE2  GLN  16          HE21      GLN  16  11.288  -3.718  -9.639
  129   2HE2  GLN  16          HE22      GLN  16  11.675  -3.621 -11.351
  130    H    GLN  17           H        GLN  17   6.126   0.590  -8.176
  131    HA   GLN  17           HA       GLN  17   6.123   3.361  -9.328
  132   1HB   GLN  17          HB2       GLN  17   4.291   0.999  -9.885
  133   2HB   GLN  17          HB3       GLN  17   4.083   2.640 -10.519
  134   1HG   GLN  17          HG2       GLN  17   6.297   2.475 -11.646
  135   2HG   GLN  17          HG3       GLN  17   6.486   0.829 -11.052
  136   1HE2  GLN  17          HE21      GLN  17   5.436  -0.867 -12.116
  137   2HE2  GLN  17          HE22      GLN  17   4.448  -0.616 -13.560
  138    H    MET  18           H        MET  18   4.017   1.162  -7.293
  139    HA   MET  18           HA       MET  18   2.077   3.121  -6.794
  140   1HB   MET  18          HB2       MET  18   1.326   1.708  -5.045
  141   2HB   MET  18          HB3       MET  18   1.809   0.722  -6.426
  142   1HG   MET  18          HG2       MET  18   3.951   0.170  -5.250
  143   2HG   MET  18          HG3       MET  18   3.456   1.188  -3.894
  144   1HE   MET  18          HE1       MET  18   1.507  -1.610  -5.993
  145   2HE   MET  18          HE2       MET  18   3.111  -2.295  -5.625
  146   3HE   MET  18          HE3       MET  18   1.659  -2.963  -4.853
  147    H    ARG  19           H        ARG  19   5.097   2.643  -5.033
  148    HA   ARG  19           HA       ARG  19   4.528   4.458  -2.865
  149   1HB   ARG  19          HB2       ARG  19   7.260   3.721  -4.030
  150   2HB   ARG  19          HB3       ARG  19   6.885   4.250  -2.383
  151   1HG   ARG  19          HG2       ARG  19   5.439   2.163  -2.180
  152   2HG   ARG  19          HG3       ARG  19   6.127   1.587  -3.682
  153   1HD   ARG  19          HD2       ARG  19   7.992   2.455  -1.463
  154   2HD   ARG  19          HD3       ARG  19   7.277   0.831  -1.470
  155    HE   ARG  19           HE       ARG  19   8.287   0.958  -3.973
  156   1HH1  ARG  19          HH22      ARG  19   9.980   1.696  -0.936
  157   2HH1  ARG  19          HH21      ARG  19  11.413   0.879  -1.556
  158   1HH2  ARG  19          HH12      ARG  19  10.227  -0.069  -4.502
  159   2HH2  ARG  19          HH11      ARG  19  11.533   0.022  -3.327
  160    H    GLN  20           H        GLN  20   5.684   4.995  -6.122
  161    HA   GLN  20           HA       GLN  20   6.661   7.704  -5.807
  162   1HB   GLN  20          HB2       GLN  20   5.277   6.523  -8.259
  163   2HB   GLN  20          HB3       GLN  20   6.222   7.995  -8.179
  164   1HG   GLN  20          HG2       GLN  20   8.248   6.633  -7.589
  165   2HG   GLN  20          HG3       GLN  20   7.276   5.169  -7.807
  166   1HE2  GLN  20          HE21      GLN  20   8.222   4.282  -9.718
  167   2HE2  GLN  20          HE22      GLN  20   8.290   5.190 -11.224
  168    H    ILE  21           H        ILE  21   3.443   6.306  -6.245
  169    HA   ILE  21           HA       ILE  21   2.015   8.715  -6.765
  170    HB   ILE  21           HB       ILE  21   0.910   6.189  -5.445
  171   1HG1  ILE  21          HG12      ILE  21   1.512   6.697  -8.371
  172   2HG1  ILE  21          HG13      ILE  21   2.225   5.457  -7.345
  173   1HG2  ILE  21          HG21      ILE  21  -0.577   8.202  -5.551
  174   2HG2  ILE  21          HG22      ILE  21  -0.365   8.229  -7.315
  175   3HG2  ILE  21          HG23      ILE  21  -1.179   6.862  -6.520
  176   1HD1  ILE  21          HD11      ILE  21  -0.643   5.478  -8.297
  177   2HD1  ILE  21          HD12      ILE  21   0.664   4.358  -8.730
  178   3HD1  ILE  21          HD13      ILE  21   0.023   4.351  -7.082
  179    H    ILE  22           H        ILE  22   2.719   6.888  -3.829
  180    HA   ILE  22           HA       ILE  22   1.185   8.598  -2.044
  181    HB   ILE  22           HB       ILE  22   3.252   6.477  -1.356
  182   1HG1  ILE  22          HG12      ILE  22   1.729   5.207  -2.569
  183   2HG1  ILE  22          HG13      ILE  22   1.104   5.061  -0.940
  184   1HG2  ILE  22          HG21      ILE  22   2.074   6.288   0.773
  185   2HG2  ILE  22          HG22      ILE  22   2.666   7.927   0.563
  186   3HG2  ILE  22          HG23      ILE  22   0.940   7.570   0.297
  187   1HD1  ILE  22          HD11      ILE  22  -0.783   5.378  -2.266
  188   2HD1  ILE  22          HD12      ILE  22  -0.507   6.975  -1.525
  189   3HD1  ILE  22          HD13      ILE  22  -0.048   6.675  -3.219
  190    H    GLN  23           H        GLN  23   4.599   8.375  -2.909
  191    HA   GLN  23           HA       GLN  23   5.566  10.317  -1.021
  192   1HB   GLN  23          HB2       GLN  23   6.623   9.006  -3.532
  193   2HB   GLN  23          HB3       GLN  23   7.583  10.206  -2.644
  194   1HG   GLN  23          HG2       GLN  23   7.541   8.885  -0.614
  195   2HG   GLN  23          HG3       GLN  23   6.382   7.748  -1.298
  196   1HE2  GLN  23          HE21      GLN  23   7.790   5.977  -0.807
  197   2HE2  GLN  23          HE22      GLN  23   9.257   5.716  -1.725
  198    H    GLN  24           H        GLN  24   3.449  10.918  -3.423
  199    HA   GLN  24           HA       GLN  24   4.230  13.818  -3.574
  200   1HB   GLN  24          HB2       GLN  24   2.714  12.231  -5.690
  201   2HB   GLN  24          HB3       GLN  24   3.134  13.949  -5.758
  202   1HG   GLN  24          HG2       GLN  24   5.526  13.365  -5.826
  203   2HG   GLN  24          HG3       GLN  24   5.101  11.649  -5.643
  204   1HE2  GLN  24          HE21      GLN  24   4.534  10.468  -7.457
  205   2HE2  GLN  24          HE22      GLN  24   4.431  11.158  -9.082
  206    H    ASN  25           H        ASN  25   1.652  11.417  -3.507
  207    HA   ASN  25           HA       ASN  25  -0.117  13.321  -2.024
  208   1HB   ASN  25          HB2       ASN  25  -0.725  11.608  -4.411
  209   2HB   ASN  25          HB3       ASN  25  -1.967  11.788  -3.166
  210   1HD2  ASN  25          HD21      ASN  25  -2.481  14.015  -2.415
  211   2HD2  ASN  25          HD22      ASN  25  -2.508  15.257  -3.667
  212    HA   PRO  26           HA       PRO  26   0.653   9.701   0.723
  213   1HB   PRO  26          HB2       PRO  26   0.674  11.088   3.092
  214   2HB   PRO  26          HB3       PRO  26   2.103  10.909   2.025
  215   1HG   PRO  26          HG2       PRO  26   0.150  13.222   2.137
  216   2HG   PRO  26          HG3       PRO  26   1.946  13.288   2.183
  217   1HD   PRO  26          HD2       PRO  26   0.557  13.696  -0.082
  218   2HD   PRO  26          HD3       PRO  26   2.084  12.756  -0.129
  219    H    SER  27           H        SER  27  -1.801  12.192   0.606
  220    HA   SER  27           HA       SER  27  -3.857  11.100   2.227
  221   1HB   SER  27          HB2       SER  27  -5.339  12.361   0.630
  222   2HB   SER  27          HB3       SER  27  -4.041  13.313   1.359
  223    HG   SER  27           HG       SER  27  -4.319  13.578  -0.949
  224    H    LEU  28           H        LEU  28  -2.523   9.842  -0.740
  225    HA   LEU  28           HA       LEU  28  -4.883   8.098  -1.200
  226   1HB   LEU  28          HB2       LEU  28  -2.418   8.618  -2.900
  227   2HB   LEU  28          HB3       LEU  28  -3.768   7.574  -3.341
  228    HG   LEU  28           HG       LEU  28  -3.887  10.594  -2.974
  229   1HD1  LEU  28          HD11      LEU  28  -2.802   9.767  -5.050
  230   2HD1  LEU  28          HD12      LEU  28  -4.243   8.786  -5.400
  231   3HD1  LEU  28          HD13      LEU  28  -4.350  10.563  -5.391
  232   1HD2  LEU  28          HD21      LEU  28  -6.201  10.416  -3.854
  233   2HD2  LEU  28          HD22      LEU  28  -6.114   8.646  -3.714
  234   3HD2  LEU  28          HD23      LEU  28  -6.041   9.677  -2.261
  235    H    LEU  29           H        LEU  29  -2.295   7.801   0.811
  236    HA   LEU  29           HA       LEU  29  -1.362   5.165   0.321
  237   1HB   LEU  29          HB2       LEU  29  -0.361   6.637   1.947
  238   2HB   LEU  29          HB3       LEU  29  -1.793   6.702   2.917
  239    HG   LEU  29           HG       LEU  29  -1.587   4.313   3.506
  240   1HD1  LEU  29          HD11      LEU  29   0.543   3.115   2.937
  241   2HD1  LEU  29          HD12      LEU  29  -0.511   3.368   1.538
  242   3HD1  LEU  29          HD13      LEU  29   0.912   4.407   1.769
  243   1HD2  LEU  29          HD21      LEU  29   0.444   4.505   4.880
  244   2HD2  LEU  29          HD22      LEU  29   1.002   5.875   3.893
  245   3HD2  LEU  29          HD23      LEU  29  -0.464   6.025   4.885
  246    HA   PRO  30           HA       PRO  30  -5.418   3.533   2.659
  247   1HB   PRO  30          HB2       PRO  30  -7.212   5.786   1.753
  248   2HB   PRO  30          HB3       PRO  30  -7.292   4.827   3.242
  249   1HG   PRO  30          HG2       PRO  30  -6.316   7.417   2.971
  250   2HG   PRO  30          HG3       PRO  30  -5.851   6.305   4.308
  251   1HD   PRO  30          HD2       PRO  30  -4.239   7.257   2.044
  252   2HD   PRO  30          HD3       PRO  30  -3.724   6.380   3.504
  253    H    ALA  31           H        ALA  31  -5.789   5.693  -0.116
  254    HA   ALA  31           HA       ALA  31  -7.474   4.014  -1.654
  255   1HB   ALA  31          HB1       ALA  31  -7.191   5.701  -3.341
  256   2HB   ALA  31          HB2       ALA  31  -7.210   6.499  -1.750
  257   3HB   ALA  31          HB3       ALA  31  -5.676   6.269  -2.614
  258    H    LEU  32           H        LEU  32  -4.074   3.601  -1.118
  259    HA   LEU  32           HA       LEU  32  -3.680   2.033  -3.623
  260   1HB   LEU  32          HB2       LEU  32  -1.894   3.522  -3.015
  261   2HB   LEU  32          HB3       LEU  32  -1.900   2.908  -1.347
  262    HG   LEU  32           HG       LEU  32  -1.006   0.781  -2.049
  263   1HD1  LEU  32          HD11      LEU  32  -0.315   0.332  -4.360
  264   2HD1  LEU  32          HD12      LEU  32  -2.050   0.572  -4.286
  265   3HD1  LEU  32          HD13      LEU  32  -1.022   1.889  -4.888
  266   1HD2  LEU  32          HD21      LEU  32   0.519   2.693  -1.567
  267   2HD2  LEU  32          HD22      LEU  32   1.251   1.559  -2.705
  268   3HD2  LEU  32          HD23      LEU  32   0.570   3.078  -3.299
  269    H    LEU  33           H        LEU  33  -3.742   1.679  -0.064
  270    HA   LEU  33           HA       LEU  33  -3.540  -1.170   0.080
  271   1HB   LEU  33          HB2       LEU  33  -4.977   0.883   1.806
  272   2HB   LEU  33          HB3       LEU  33  -4.717  -0.794   2.281
  273    HG   LEU  33           HG       LEU  33  -2.313   0.894   1.499
  274   1HD1  LEU  33          HD11      LEU  33  -3.529   2.293   3.044
  275   2HD1  LEU  33          HD12      LEU  33  -3.681   0.949   4.207
  276   3HD1  LEU  33          HD13      LEU  33  -2.080   1.634   3.817
  277   1HD2  LEU  33          HD21      LEU  33  -2.712  -1.330   3.538
  278   2HD2  LEU  33          HD22      LEU  33  -2.031  -1.531   1.907
  279   3HD2  LEU  33          HD23      LEU  33  -1.176  -0.546   3.107
  280    H    GLN  34           H        GLN  34  -6.417   0.965  -0.246
  281    HA   GLN  34           HA       GLN  34  -8.362  -1.085  -0.614
  282   1HB   GLN  34          HB2       GLN  34  -8.185   1.786  -1.581
  283   2HB   GLN  34          HB3       GLN  34  -9.600   0.768  -1.862
  284   1HG   GLN  34          HG2       GLN  34  -9.961   0.451   0.515
  285   2HG   GLN  34          HG3       GLN  34  -8.506   1.348   0.928
  286   1HE2  GLN  34          HE21      GLN  34 -11.202   1.978   1.847
  287   2HE2  GLN  34          HE22      GLN  34 -11.569   3.575   1.202
  288    H    GLN  35           H        GLN  35  -5.992   0.261  -2.996
  289    HA   GLN  35           HA       GLN  35  -7.390  -0.899  -5.254
  290   1HB   GLN  35          HB2       GLN  35  -5.914   1.148  -5.276
  291   2HB   GLN  35          HB3       GLN  35  -4.506   0.111  -5.044
  292   1HG   GLN  35          HG2       GLN  35  -6.494  -0.100  -7.330
  293   2HG   GLN  35          HG3       GLN  35  -5.024   0.873  -7.400
  294   1HE2  GLN  35          HE21      GLN  35  -5.980  -1.685  -8.918
  295   2HE2  GLN  35          HE22      GLN  35  -4.604  -2.769  -8.733
  296    H    ILE  36           H        ILE  36  -4.568  -1.821  -3.271
  297    HA   ILE  36           HA       ILE  36  -3.922  -4.286  -4.513
  298    HB   ILE  36           HB       ILE  36  -3.759  -3.384  -1.634
  299   1HG1  ILE  36          HG12      ILE  36  -1.522  -3.672  -3.690
  300   2HG1  ILE  36          HG13      ILE  36  -2.420  -2.171  -3.496
  301   1HG2  ILE  36          HG21      ILE  36  -3.714  -5.904  -1.743
  302   2HG2  ILE  36          HG22      ILE  36  -2.411  -5.818  -2.932
  303   3HG2  ILE  36          HG23      ILE  36  -2.154  -5.254  -1.268
  304   1HD1  ILE  36          HD11      ILE  36  -0.416  -1.966  -2.230
  305   2HD1  ILE  36          HD12      ILE  36  -1.764  -2.108  -1.080
  306   3HD1  ILE  36          HD13      ILE  36  -0.698  -3.503  -1.393
  307    H    GLY  37           H        GLY  37  -6.433  -3.562  -2.008
  308   1HA   GLY  37          HA2       GLY  37  -7.487  -6.133  -1.682
  309   2HA   GLY  37          HA3       GLY  37  -8.381  -4.620  -1.501
  310    H    ARG  38           H        ARG  38  -7.894  -4.075  -4.528
  311    HA   ARG  38           HA       ARG  38 -10.253  -5.563  -5.527
  312   1HB   ARG  38          HB2       ARG  38  -8.637  -3.301  -6.757
  313   2HB   ARG  38          HB3       ARG  38 -10.071  -4.033  -7.467
  314   1HG   ARG  38          HG2       ARG  38  -9.967  -2.478  -4.873
  315   2HG   ARG  38          HG3       ARG  38 -10.668  -1.981  -6.418
  316   1HD   ARG  38          HD2       ARG  38 -11.667  -4.183  -4.580
  317   2HD   ARG  38          HD3       ARG  38 -12.411  -2.610  -4.894
  318    HE   ARG  38           HE       ARG  38 -12.328  -3.668  -7.404
  319   1HH1  ARG  38          HH22      ARG  38 -13.660  -4.950  -4.421
  320   2HH1  ARG  38          HH21      ARG  38 -14.844  -5.925  -5.266
  321   1HH2  ARG  38          HH12      ARG  38 -13.846  -4.936  -8.411
  322   2HH2  ARG  38          HH11      ARG  38 -14.946  -5.903  -7.462
  323    H    GLU  39           H        GLU  39  -6.916  -6.135  -5.652
  324    HA   GLU  39           HA       GLU  39  -7.327  -8.008  -7.965
  325   1HB   GLU  39          HB2       GLU  39  -5.193  -7.461  -8.890
  326   2HB   GLU  39          HB3       GLU  39  -6.210  -6.016  -8.775
  327   1HG   GLU  39          HG2       GLU  39  -4.960  -5.258  -6.810
  328   2HG   GLU  39          HG3       GLU  39  -4.002  -6.746  -6.822
  329    H    ASN  40           H        ASN  40  -5.662  -7.415  -4.956
  330    HA   ASN  40           HA       ASN  40  -5.225 -10.316  -4.551
  331   1HB   ASN  40          HB2       ASN  40  -3.116  -8.135  -4.305
  332   2HB   ASN  40          HB3       ASN  40  -3.007  -9.703  -3.484
  333   1HD2  ASN  40          HD21      ASN  40  -1.193  -8.504  -5.415
  334   2HD2  ASN  40          HD22      ASN  40  -0.972  -9.861  -6.518
  335    HA   PRO  41           HA       PRO  41  -7.115  -8.167  -0.818
  336   1HB   PRO  41          HB2       PRO  41  -9.006 -10.083  -0.291
  337   2HB   PRO  41          HB3       PRO  41  -9.257  -8.694  -1.397
  338   1HG   PRO  41          HG2       PRO  41  -8.419 -11.499  -2.137
  339   2HG   PRO  41          HG3       PRO  41  -9.756 -10.524  -2.841
  340   1HD   PRO  41          HD2       PRO  41  -7.351 -10.649  -4.044
  341   2HD   PRO  41          HD3       PRO  41  -8.217  -9.085  -3.955
  342    H    GLN  42           H        GLN  42  -5.733 -11.260  -1.642
  343    HA   GLN  42           HA       GLN  42  -5.150 -12.211   1.030
  344   1HB   GLN  42          HB2       GLN  42  -3.718 -12.813  -1.593
  345   2HB   GLN  42          HB3       GLN  42  -3.691 -13.782  -0.111
  346   1HG   GLN  42          HG2       GLN  42  -6.188 -14.070  -0.348
  347   2HG   GLN  42          HG3       GLN  42  -6.088 -13.258  -1.912
  348   1HE2  GLN  42          HE22      GLN  42  -6.190 -16.331  -0.550
  349   2HE2  GLN  42          HE21      GLN  42  -5.379 -17.195  -1.849
  350    H    LEU  43           H        LEU  43  -3.182 -10.408  -1.431
  351    HA   LEU  43           HA       LEU  43  -0.922  -9.995   0.316
  352   1HB   LEU  43          HB2       LEU  43  -0.824  -9.756  -2.155
  353   2HB   LEU  43          HB3       LEU  43  -1.935  -8.388  -2.085
  354    HG   LEU  43           HG       LEU  43  -0.348  -7.024  -0.923
  355   1HD1  LEU  43          HD11      LEU  43   1.601  -9.369  -1.034
  356   2HD1  LEU  43          HD12      LEU  43   1.945  -7.706  -0.481
  357   3HD1  LEU  43          HD13      LEU  43   0.851  -8.718   0.446
  358   1HD2  LEU  43          HD21      LEU  43  -0.231  -7.100  -3.374
  359   2HD2  LEU  43          HD22      LEU  43   1.365  -6.811  -2.667
  360   3HD2  LEU  43          HD23      LEU  43   0.956  -8.425  -3.289
  361    H    LEU  44           H        LEU  44  -3.954  -8.312  -0.224
  362    HA   LEU  44           HA       LEU  44  -3.292  -5.877   1.106
  363   1HB   LEU  44          HB2       LEU  44  -5.299  -6.427  -0.377
  364   2HB   LEU  44          HB3       LEU  44  -6.049  -7.182   0.991
  365    HG   LEU  44           HG       LEU  44  -6.369  -4.603   0.195
  366   1HD1  LEU  44          HD11      LEU  44  -7.863  -5.834   1.622
  367   2HD1  LEU  44          HD12      LEU  44  -6.765  -5.601   3.016
  368   3HD1  LEU  44          HD13      LEU  44  -7.568  -4.206   2.238
  369   1HD2  LEU  44          HD21      LEU  44  -4.165  -3.811   0.981
  370   2HD2  LEU  44          HD22      LEU  44  -5.509  -3.054   1.847
  371   3HD2  LEU  44          HD23      LEU  44  -4.577  -4.321   2.645
  372    H    GLN  45           H        GLN  45  -5.231  -8.552   2.346
  373    HA   GLN  45           HA       GLN  45  -5.201  -7.919   5.102
  374   1HB   GLN  45          HB2       GLN  45  -5.348 -10.595   3.678
  375   2HB   GLN  45          HB3       GLN  45  -5.552 -10.428   5.424
  376   1HG   GLN  45          HG2       GLN  45  -7.489  -9.015   5.178
  377   2HG   GLN  45          HG3       GLN  45  -7.261  -8.884   3.429
  378   1HE2  GLN  45          HE21      GLN  45  -7.524 -10.851   2.125
  379   2HE2  GLN  45          HE22      GLN  45  -8.628 -12.110   2.697
  380    H    GLN  46           H        GLN  46  -2.594  -9.547   3.260
  381    HA   GLN  46           HA       GLN  46  -0.990 -10.171   5.610
  382   1HB   GLN  46          HB2       GLN  46  -0.547 -10.052   2.610
  383   2HB   GLN  46          HB3       GLN  46   0.815 -10.224   3.706
  384   1HG   GLN  46          HG2       GLN  46  -0.188 -12.249   4.699
  385   2HG   GLN  46          HG3       GLN  46  -1.630 -12.064   3.708
  386   1HE2  GLN  46          HE21      GLN  46  -1.435 -12.335   1.384
  387   2HE2  GLN  46          HE22      GLN  46  -0.127 -13.332   0.721
  388    H    ILE  47           H        ILE  47  -0.978  -7.400   3.307
  389    HA   ILE  47           HA       ILE  47   1.151  -5.966   4.589
  390    HB   ILE  47           HB       ILE  47  -1.130  -5.173   2.776
  391   1HG1  ILE  47          HG12      ILE  47   1.908  -5.135   2.447
  392   2HG1  ILE  47          HG13      ILE  47   0.895  -6.507   1.987
  393   1HG2  ILE  47          HG21      ILE  47  -0.822  -3.200   4.163
  394   2HG2  ILE  47          HG22      ILE  47   0.945  -3.336   4.047
  395   3HG2  ILE  47          HG23      ILE  47  -0.027  -2.899   2.626
  396   1HD1  ILE  47          HD11      ILE  47  -0.371  -5.032   0.432
  397   2HD1  ILE  47          HD12      ILE  47   0.801  -3.731   0.764
  398   3HD1  ILE  47          HD13      ILE  47   1.348  -5.241   0.016
  399    H    SER  48           H        SER  48  -2.378  -6.038   5.191
  400    HA   SER  48           HA       SER  48  -2.431  -4.037   7.230
  401   1HB   SER  48          HB2       SER  48  -4.200  -6.496   6.926
  402   2HB   SER  48          HB3       SER  48  -4.536  -5.118   7.980
  403    HG   SER  48           HG       SER  48  -4.642  -3.797   6.147
  404    H    GLN  49           H        GLN  49  -1.685  -7.499   7.441
  405    HA   GLN  49           HA       GLN  49  -1.454  -7.620  10.322
  406   1HB   GLN  49          HB2       GLN  49  -0.709  -9.388   7.979
  407   2HB   GLN  49          HB3       GLN  49  -0.168  -9.809   9.603
  408   1HG   GLN  49          HG2       GLN  49  -2.439  -9.901  10.438
  409   2HG   GLN  49          HG3       GLN  49  -3.087  -9.259   8.929
  410   1HE2  GLN  49          HE21      GLN  49  -3.097 -10.610   7.045
  411   2HE2  GLN  49          HE22      GLN  49  -2.958 -12.370   7.200
  412    H    HIS  50           H        HIS  50   0.666  -6.229   8.003
  413    HA   HIS  50           HA       HIS  50   2.943  -6.206   9.930
  414   1HB   HIS  50          HB2       HIS  50   3.126  -6.908   6.978
  415   2HB   HIS  50          HB3       HIS  50   4.475  -6.825   8.117
  416    HD1  HIS  50           HD1      HIS  50   1.811  -9.158   6.892
  417    HD2  HIS  50           HD2      HIS  50   4.524  -8.835  10.074
  418    HE1  HIS  50           HE1      HIS  50   2.001 -11.497   7.905
  419    H    GLN  51           H        GLN  51   0.981  -4.105   9.133
  420    HA   GLN  51           HA       GLN  51   1.776  -2.636   6.980
  421   1HB   GLN  51          HB2       GLN  51  -0.370  -2.607   8.421
  422   2HB   GLN  51          HB3       GLN  51   0.427  -1.326   9.352
  423   1HG   GLN  51          HG2       GLN  51   0.681  -0.006   7.251
  424   2HG   GLN  51          HG3       GLN  51  -0.066  -1.324   6.338
  425   1HE2  GLN  51          HE21      GLN  51  -0.748   1.645   7.802
  426   2HE2  GLN  51          HE22      GLN  51  -2.486   1.410   7.984
  427    H    GLU  52           H        GLU  52   3.194  -2.250  10.231
  428    HA   GLU  52           HA       GLU  52   4.591   0.193   9.732
  429   1HB   GLU  52          HB2       GLU  52   4.228  -0.925  11.942
  430   2HB   GLU  52          HB3       GLU  52   5.390  -2.178  11.476
  431   1HG   GLU  52          HG2       GLU  52   7.153  -0.479  11.268
  432   2HG   GLU  52          HG3       GLU  52   5.981   0.801  11.592
  433    H    HIS  53           H        HIS  53   5.377  -3.198   8.924
  434    HA   HIS  53           HA       HIS  53   8.050  -2.628   7.906
  435   1HB   HIS  53          HB2       HIS  53   6.288  -5.065   7.470
  436   2HB   HIS  53          HB3       HIS  53   8.009  -4.933   7.144
  437    HD1  HIS  53           HD1      HIS  53   9.654  -4.930   9.334
  438    HD2  HIS  53           HD2      HIS  53   5.543  -5.470  10.022
  439    HE1  HIS  53           HE1      HIS  53   9.434  -5.768  11.722
  440    H    PHE  54           H        PHE  54   4.778  -2.899   6.496
  441    HA   PHE  54           HA       PHE  54   5.564  -2.491   3.736
  442   1HB   PHE  54          HB2       PHE  54   3.314  -3.243   4.366
  443   2HB   PHE  54          HB3       PHE  54   3.021  -1.735   5.226
  444    HD1  PHE  54           HD1      PHE  54   1.965   0.055   4.122
  445    HD2  PHE  54           HD2      PHE  54   3.849  -3.049   1.795
  446    HE1  PHE  54           HE1      PHE  54   1.006   1.020   2.044
  447    HE2  PHE  54           HE2      PHE  54   2.904  -2.054  -0.281
  448    HZ   PHE  54           HZ       PHE  54   1.487  -0.024  -0.156
  449    H    ILE  55           H        ILE  55   4.749  -0.105   6.343
  450    HA   ILE  55           HA       ILE  55   5.372   2.212   4.815
  451    HB   ILE  55           HB       ILE  55   5.325   1.734   7.740
  452   1HG1  ILE  55          HG12      ILE  55   3.592   3.381   5.838
  453   2HG1  ILE  55          HG13      ILE  55   3.235   1.713   6.301
  454   1HG2  ILE  55          HG21      ILE  55   7.017   3.538   7.346
  455   2HG2  ILE  55          HG22      ILE  55   5.845   4.398   6.325
  456   3HG2  ILE  55          HG23      ILE  55   5.552   4.181   8.061
  457   1HD1  ILE  55          HD11      ILE  55   1.903   3.160   7.639
  458   2HD1  ILE  55          HD12      ILE  55   3.140   2.421   8.685
  459   3HD1  ILE  55          HD13      ILE  55   3.311   4.115   8.140
  460    H    GLN  56           H        GLN  56   7.646   0.031   6.606
  461    HA   GLN  56           HA       GLN  56   9.952   1.654   6.059
  462   1HB   GLN  56          HB2       GLN  56   9.979  -1.363   6.400
  463   2HB   GLN  56          HB3       GLN  56  11.321  -0.248   6.571
  464   1HG   GLN  56          HG2       GLN  56   9.089  -0.807   8.484
  465   2HG   GLN  56          HG3       GLN  56  10.809  -0.739   8.762
  466   1HE2  GLN  56          HE21      GLN  56   7.882   0.970   9.066
  467   2HE2  GLN  56          HE22      GLN  56   8.579   2.530   9.517
  468    H    MET  57           H        MET  57   8.093  -0.142   3.821
  469    HA   MET  57           HA       MET  57  10.250  -0.041   1.739
  470   1HB   MET  57          HB2       MET  57   7.439  -1.244   1.671
  471   2HB   MET  57          HB3       MET  57   8.591  -1.248   0.339
  472   1HG   MET  57          HG2       MET  57  10.177  -2.521   1.834
  473   2HG   MET  57          HG3       MET  57   8.861  -2.685   2.998
  474   1HE   MET  57          HE1       MET  57   6.311  -3.138   1.065
  475   2HE   MET  57          HE2       MET  57   6.293  -4.905   0.929
  476   3HE   MET  57          HE3       MET  57   6.617  -4.145   2.505
  477    H    LEU  58           H        LEU  58   6.814   0.829   2.164
  478    HA   LEU  58           HA       LEU  58   6.276   2.461   0.015
  479   1HB   LEU  58          HB2       LEU  58   4.774   1.313   1.388
  480   2HB   LEU  58          HB3       LEU  58   5.307   2.144   2.834
  481    HG   LEU  58           HG       LEU  58   3.081   2.621   1.928
  482   1HD1  LEU  58          HD11      LEU  58   3.096   4.909   2.721
  483   2HD1  LEU  58          HD12      LEU  58   4.218   3.942   3.684
  484   3HD1  LEU  58          HD13      LEU  58   4.841   5.051   2.444
  485   1HD2  LEU  58          HD21      LEU  58   2.713   4.160   0.177
  486   2HD2  LEU  58          HD22      LEU  58   4.445   4.488  -0.047
  487   3HD2  LEU  58          HD23      LEU  58   3.765   2.898  -0.472
  488    H    ASN  59           H        ASN  59   7.829   3.472   3.080
  489    HA   ASN  59           HA       ASN  59   7.632   6.308   2.406
  490   1HB   ASN  59          HB2       ASN  59   7.372   5.223   4.703
  491   2HB   ASN  59          HB3       ASN  59   9.122   4.958   4.682
  492   1HD2  ASN  59          HD21      ASN  59   9.487   6.288   6.492
  493   2HD2  ASN  59          HD22      ASN  59   9.175   8.023   6.461
  494    H    GLU  60           H        GLU  60   9.704   4.000   1.206
  495    HA   GLU  60           HA       GLU  60  12.139   5.728   1.268
  496   1HB   GLU  60          HB2       GLU  60  11.833   2.752   0.849
  497   2HB   GLU  60          HB3       GLU  60  13.348   3.645   0.738
  498   1HG   GLU  60          HG2       GLU  60  11.586   3.323   3.198
  499   2HG   GLU  60          HG3       GLU  60  13.170   2.605   2.900
  500    HA   PRO  61           HA       PRO  61  11.558   6.649  -2.945
  501   1HB   PRO  61          HB2       PRO  61  14.079   7.268  -3.834
  502   2HB   PRO  61          HB3       PRO  61  13.143   8.273  -2.682
  503   1HG   PRO  61          HG2       PRO  61  15.273   6.212  -2.082
  504   2HG   PRO  61          HG3       PRO  61  15.122   7.876  -1.423
  505   1HD   PRO  61          HD2       PRO  61  14.262   5.683  -0.067
  506   2HD   PRO  61          HD3       PRO  61  13.366   7.235   0.016
  507    H    VAL  62           H        VAL  62  11.236   5.593  -4.830
  508    HA   VAL  62           HA       VAL  62  11.888   2.882  -5.120
  509    HB   VAL  62           HB       VAL  62  10.826   3.033  -7.293
  510   1HG1  VAL  62          HG11      VAL  62   9.463   2.965  -5.218
  511   2HG1  VAL  62          HG12      VAL  62   9.326   4.738  -5.261
  512   3HG1  VAL  62          HG13      VAL  62   8.639   3.754  -6.566
  513   1HG2  VAL  62          HG21      VAL  62  10.699   6.059  -6.910
  514   2HG2  VAL  62          HG22      VAL  62  11.768   5.223  -8.058
  515   3HG2  VAL  62          HG23      VAL  62  10.024   5.100  -8.249
  516    H    GLN  63           H        GLN  63  13.963   5.478  -5.948
  517    HA   GLN  63           HA       GLN  63  15.525   4.373  -8.047
  518   1HB   GLN  63          HB2       GLN  63  15.681   6.665  -7.051
  519   2HB   GLN  63          HB3       GLN  63  16.455   5.964  -5.624
  520   1HG   GLN  63          HG2       GLN  63  18.355   5.199  -7.018
  521   2HG   GLN  63          HG3       GLN  63  17.517   5.749  -8.473
  522   1HE2  GLN  63          HE21      GLN  63  19.388   7.116  -8.977
  523   2HE2  GLN  63          HE22      GLN  63  19.617   8.619  -8.090
  524    H    GLU  64           H        GLU  64  15.185   3.381  -4.741
  525    HA   GLU  64           HA       GLU  64  17.203   1.562  -4.164
  526   1HB   GLU  64          HB2       GLU  64  15.346   2.212  -2.742
  527   2HB   GLU  64          HB3       GLU  64  14.184   1.496  -3.868
  528   1HG   GLU  64          HG2       GLU  64  15.056  -0.758  -3.312
  529   2HG   GLU  64          HG3       GLU  64  16.190  -0.017  -2.170
  530    H    ALA  65           H        ALA  65  14.581   1.132  -6.563
  531    HA   ALA  65           HA       ALA  65  15.763  -1.465  -7.434
  532   1HB   ALA  65          HB1       ALA  65  14.059  -1.908  -5.698
  533   2HB   ALA  65          HB2       ALA  65  12.854  -1.007  -6.644
  534   3HB   ALA  65          HB3       ALA  65  13.547  -2.514  -7.284
  535    H    GLY  66           H        GLY  66  14.292   1.489  -8.433
  536   1HA   GLY  66          HA2       GLY  66  12.852   0.748 -10.715
  537   2HA   GLY  66          HA3       GLY  66  13.616   2.315 -10.446
  538    H    GLY  67           H        GLY  67  16.375   1.079 -10.432
  539   1HA   GLY  67          HA2       GLY  67  17.093  -0.498 -12.550
  540   2HA   GLY  67          HA3       GLY  67  16.890   1.078 -13.313
  541    H    GLN  68           H        GLN  68  19.228   0.162 -13.654
  542    HA   GLN  68           HA       GLN  68  21.026   1.792 -11.915
  543   1HB   GLN  68          HB2       GLN  68  21.061  -0.690 -11.397
  544   2HB   GLN  68          HB3       GLN  68  21.716  -0.961 -13.013
  545   1HG   GLN  68          HG2       GLN  68  23.737   0.337 -12.425
  546   2HG   GLN  68          HG3       GLN  68  23.004   0.806 -10.888
  547   1HE2  GLN  68          HE21      GLN  68  24.797  -0.123  -9.692
  548   2HE2  GLN  68          HE22      GLN  68  24.957  -1.871  -9.565
  549    H    GLY  69           H        GLY  69  19.859   1.279 -15.024
  550   1HA   GLY  69          HA2       GLY  69  21.423   3.260 -16.270
  551   2HA   GLY  69          HA3       GLY  69  22.085   1.693 -16.746
  552    H    GLY  70           H        GLY  70  21.135   3.157 -18.762
  553   1HA   GLY  70          HA2       GLY  70  19.238   1.584 -20.098
  554   2HA   GLY  70          HA3       GLY  70  18.330   2.899 -19.354
  555    H    GLY  71           H        GLY  71  17.997   2.941 -21.854
  556   1HA   GLY  71          HA2       GLY  71  19.351   5.335 -22.872
  557   2HA   GLY  71          HA3       GLY  71  19.710   3.861 -23.774
  558    H    GLY  72           H        GLY  72  16.540   4.398 -22.310
  559   1HA   GLY  72          HA2       GLY  72  15.097   5.641 -24.387
  560   2HA   GLY  72          HA3       GLY  72  15.076   3.912 -24.736
  Start of MODEL    4
    1   1H    GLY   1           H1       GLY   1  21.772 -12.745  14.667
    2   2H    GLY   1           H2       GLY   1  20.348 -12.955  15.457
    3   3H    GLY   1           H3       GLY   1  20.757 -11.472  14.882
    4   1HA   GLY   1          HA2       GLY   1  20.631 -12.246  12.607
    5   2HA   GLY   1          HA3       GLY   1  20.202 -13.852  13.226
    6    H    SER   2           H        SER   2  18.825 -11.489  11.651
    7    HA   SER   2           HA       SER   2  16.160 -11.657  12.976
    8   1HB   SER   2          HB2       SER   2  17.510  -9.067  12.114
    9   2HB   SER   2          HB3       SER   2  15.852  -9.227  12.708
   10    HG   SER   2           HG       SER   2  17.301  -8.577  14.351
   11    H    HIS   3           H        HIS   3  14.415 -10.845  11.588
   12    HA   HIS   3           HA       HIS   3  14.905 -10.938   8.653
   13   1HB   HIS   3          HB2       HIS   3  12.854 -12.629  10.136
   14   2HB   HIS   3          HB3       HIS   3  13.074 -12.559   8.393
   15    HD1  HIS   3           HD1      HIS   3  14.133 -14.603  11.266
   16    HD2  HIS   3           HD2      HIS   3  15.709 -13.416   7.555
   17    HE1  HIS   3           HE1      HIS   3  16.006 -16.239  10.732
   18    H    MET   4           H        MET   4  12.881 -10.364   7.426
   19    HA   MET   4           HA       MET   4  10.975  -8.590   8.826
   20   1HB   MET   4          HB2       MET   4  12.978  -7.215   8.252
   21   2HB   MET   4          HB3       MET   4  12.784  -7.655   6.554
   22   1HG   MET   4          HG2       MET   4  10.566  -6.547   6.534
   23   2HG   MET   4          HG3       MET   4  10.773  -6.121   8.245
   24   1HE   MET   4          HE1       MET   4  10.170  -3.562   7.519
   25   2HE   MET   4          HE2       MET   4  11.026  -2.730   6.203
   26   3HE   MET   4          HE3       MET   4  10.018  -4.148   5.845
   27    HA   PRO   5           HA       PRO   5   8.479 -10.510   5.594
   28   1HB   PRO   5          HB2       PRO   5   6.072  -9.331   6.011
   29   2HB   PRO   5          HB3       PRO   5   6.816 -10.405   7.228
   30   1HG   PRO   5          HG2       PRO   5   6.951  -7.372   7.127
   31   2HG   PRO   5          HG3       PRO   5   6.435  -8.402   8.504
   32   1HD   PRO   5          HD2       PRO   5   8.974  -7.469   8.295
   33   2HD   PRO   5          HD3       PRO   5   8.641  -9.108   8.928
   34    H    LEU   6           H        LEU   6   7.008  -9.848   3.763
   35    HA   LEU   6           HA       LEU   6   6.491  -8.813   1.848
   36   1HB   LEU   6          HB2       LEU   6   7.032  -6.217   3.305
   37   2HB   LEU   6          HB3       LEU   6   6.018  -6.447   1.884
   38    HG   LEU   6           HG       LEU   6   5.440  -7.589   4.656
   39   1HD1  LEU   6          HD11      LEU   6   5.233  -5.162   4.570
   40   2HD1  LEU   6          HD12      LEU   6   4.169  -5.289   3.147
   41   3HD1  LEU   6          HD13      LEU   6   3.647  -5.932   4.723
   42   1HD2  LEU   6          HD21      LEU   6   3.189  -8.082   3.738
   43   2HD2  LEU   6          HD22      LEU   6   3.738  -7.588   2.123
   44   3HD2  LEU   6          HD23      LEU   6   4.445  -9.015   2.916
   45    H    GLU   7           H        GLU   7   9.629  -8.923   2.628
   46    HA   GLU   7           HA       GLU   7  11.104  -7.399   0.771
   47   1HB   GLU   7          HB2       GLU   7  12.000  -8.926   2.520
   48   2HB   GLU   7          HB3       GLU   7  11.366 -10.306   1.646
   49   1HG   GLU   7          HG2       GLU   7  13.728 -10.190   1.310
   50   2HG   GLU   7          HG3       GLU   7  12.917  -9.904  -0.217
   51    H    PHE   8           H        PHE   8   9.099 -10.252   0.115
   52    HA   PHE   8           HA       PHE   8   9.909 -10.679  -2.590
   53   1HB   PHE   8          HB2       PHE   8   7.810 -12.005  -2.712
   54   2HB   PHE   8          HB3       PHE   8   8.856 -12.411  -1.361
   55    HD1  PHE   8           HD1      PHE   8   5.681 -10.695  -2.301
   56    HD2  PHE   8           HD2      PHE   8   8.100 -12.231   0.920
   57    HE1  PHE   8           HE1      PHE   8   3.776 -10.425  -0.734
   58    HE2  PHE   8           HE2      PHE   8   6.187 -11.971   2.477
   59    HZ   PHE   8           HZ       PHE   8   4.020 -11.071   1.650
   60    H    LEU   9           H        LEU   9   7.987  -8.071  -1.351
   61    HA   LEU   9           HA       LEU   9   6.625  -7.527  -3.919
   62   1HB   LEU   9          HB2       LEU   9   6.926  -5.788  -1.436
   63   2HB   LEU   9          HB3       LEU   9   5.864  -5.488  -2.801
   64    HG   LEU   9           HG       LEU   9   5.606  -7.766  -0.796
   65   1HD1  LEU   9          HD11      LEU   9   4.949  -5.487  -0.011
   66   2HD1  LEU   9          HD12      LEU   9   3.817  -5.366  -1.373
   67   3HD1  LEU   9          HD13      LEU   9   3.577  -6.603  -0.117
   68   1HD2  LEU   9          HD21      LEU   9   3.872  -7.074  -3.213
   69   2HD2  LEU   9          HD22      LEU   9   4.859  -8.542  -3.008
   70   3HD2  LEU   9          HD23      LEU   9   3.474  -8.273  -1.958
   71    H    ARG  10           H        ARG  10   9.627  -6.638  -2.361
   72    HA   ARG  10           HA       ARG  10   9.924  -4.008  -3.254
   73   1HB   ARG  10          HB2       ARG  10  11.963  -6.107  -2.438
   74   2HB   ARG  10          HB3       ARG  10  12.401  -4.427  -2.781
   75   1HG   ARG  10          HG2       ARG  10  10.863  -3.660  -0.981
   76   2HG   ARG  10          HG3       ARG  10  10.393  -5.340  -0.675
   77   1HD   ARG  10          HD2       ARG  10  12.043  -4.834   0.954
   78   2HD   ARG  10          HD3       ARG  10  12.817  -5.870  -0.261
   79    HE   ARG  10           HE       ARG  10  13.182  -3.035  -0.803
   80   1HH1  ARG  10          HH22      ARG  10  14.547  -5.686   1.073
   81   2HH1  ARG  10          HH21      ARG  10  16.070  -4.863   1.278
   82   1HH2  ARG  10          HH12      ARG  10  15.166  -2.079  -0.534
   83   2HH2  ARG  10          HH11      ARG  10  16.408  -2.886   0.387
   84    H    ASN  11           H        ASN  11  10.525  -6.836  -5.170
   85    HA   ASN  11           HA       ASN  11  11.863  -5.207  -7.284
   86   1HB   ASN  11          HB2       ASN  11  12.963  -7.268  -6.318
   87   2HB   ASN  11          HB3       ASN  11  11.647  -8.226  -7.008
   88   1HD2  ASN  11          HD21      ASN  11  12.550  -9.312  -8.744
   89   2HD2  ASN  11          HD22      ASN  11  13.562  -8.536  -9.961
   90    H    GLN  12           H        GLN  12   8.694  -6.029  -6.602
   91    HA   GLN  12           HA       GLN  12   7.908  -7.101  -9.175
   92   1HB   GLN  12          HB2       GLN  12   6.231  -5.993  -6.885
   93   2HB   GLN  12          HB3       GLN  12   5.600  -6.789  -8.334
   94   1HG   GLN  12          HG2       GLN  12   7.018  -8.816  -7.760
   95   2HG   GLN  12          HG3       GLN  12   7.427  -8.026  -6.235
   96   1HE2  GLN  12          HE21      GLN  12   6.475  -9.830  -5.094
   97   2HE2  GLN  12          HE22      GLN  12   4.722 -10.028  -5.035
   98    HA   PRO  13           HA       PRO  13   7.570  -3.497 -11.661
   99   1HB   PRO  13          HB2       PRO  13   4.851  -4.536 -12.484
  100   2HB   PRO  13          HB3       PRO  13   6.174  -3.906 -13.513
  101   1HG   PRO  13          HG2       PRO  13   5.819  -6.566 -13.272
  102   2HG   PRO  13          HG3       PRO  13   7.475  -5.881 -13.172
  103   1HD   PRO  13          HD2       PRO  13   5.650  -6.731 -10.922
  104   2HD   PRO  13          HD3       PRO  13   7.401  -7.046 -11.153
  105    H    GLN  14           H        GLN  14   4.587  -4.118  -9.747
  106    HA   GLN  14           HA       GLN  14   3.631  -1.381  -9.989
  107   1HB   GLN  14          HB2       GLN  14   2.883  -3.619  -8.064
  108   2HB   GLN  14          HB3       GLN  14   2.096  -2.039  -8.131
  109   1HG   GLN  14          HG2       GLN  14   1.580  -2.467 -10.576
  110   2HG   GLN  14          HG3       GLN  14   2.160  -4.119 -10.353
  111   1HE2  GLN  14          HE21      GLN  14  -0.408  -1.795  -9.482
  112   2HE2  GLN  14          HE22      GLN  14  -1.510  -3.014  -8.869
  113    H    PHE  15           H        PHE  15   5.919  -2.920  -7.798
  114    HA   PHE  15           HA       PHE  15   5.598  -0.983  -5.610
  115   1HB   PHE  15          HB2       PHE  15   6.286  -3.343  -5.265
  116   2HB   PHE  15          HB3       PHE  15   7.745  -3.063  -6.207
  117    HD1  PHE  15           HD1      PHE  15   6.196  -2.809  -2.927
  118    HD2  PHE  15           HD2      PHE  15   9.544  -1.515  -5.317
  119    HE1  PHE  15           HE1      PHE  15   7.435  -2.184  -0.868
  120    HE2  PHE  15           HE2      PHE  15  10.773  -0.890  -3.259
  121    HZ   PHE  15           HZ       PHE  15   9.724  -1.211  -1.037
  122    H    GLN  16           H        GLN  16   7.385  -1.250  -8.556
  123    HA   GLN  16           HA       GLN  16   9.335   0.838  -8.088
  124   1HB   GLN  16          HB2       GLN  16   8.161  -0.235 -10.666
  125   2HB   GLN  16          HB3       GLN  16   9.700   0.626 -10.488
  126   1HG   GLN  16          HG2       GLN  16   8.972  -2.226  -9.999
  127   2HG   GLN  16          HG3       GLN  16  10.402  -1.564 -10.746
  128   1HE2  GLN  16          HE21      GLN  16   9.316  -3.210  -8.064
  129   2HE2  GLN  16          HE22      GLN  16  10.657  -2.852  -6.976
  130    H    GLN  17           H        GLN  17   5.929   0.961  -8.608
  131    HA   GLN  17           HA       GLN  17   6.011   3.720  -9.787
  132   1HB   GLN  17          HB2       GLN  17   4.112   1.396 -10.303
  133   2HB   GLN  17          HB3       GLN  17   3.947   3.024 -10.971
  134   1HG   GLN  17          HG2       GLN  17   6.132   2.765 -12.127
  135   2HG   GLN  17          HG3       GLN  17   6.305   1.142 -11.464
  136   1HE2  GLN  17          HE21      GLN  17   5.211  -0.590 -12.417
  137   2HE2  GLN  17          HE22      GLN  17   4.216  -0.396 -13.864
  138    H    MET  18           H        MET  18   3.842   1.547  -7.822
  139    HA   MET  18           HA       MET  18   1.926   3.511  -7.209
  140   1HB   MET  18          HB2       MET  18   1.150   1.981  -5.574
  141   2HB   MET  18          HB3       MET  18   1.679   1.084  -6.991
  142   1HG   MET  18          HG2       MET  18   3.883   0.629  -5.739
  143   2HG   MET  18          HG3       MET  18   3.141   1.353  -4.322
  144   1HE   MET  18          HE1       MET  18   3.259  -0.520  -2.632
  145   2HE   MET  18          HE2       MET  18   3.037  -2.235  -3.037
  146   3HE   MET  18          HE3       MET  18   4.357  -1.311  -3.785
  147    H    ARG  19           H        ARG  19   4.962   2.843  -5.547
  148    HA   ARG  19           HA       ARG  19   4.542   4.558  -3.280
  149   1HB   ARG  19          HB2       ARG  19   7.197   3.819  -4.557
  150   2HB   ARG  19          HB3       ARG  19   6.865   4.238  -2.867
  151   1HG   ARG  19          HG2       ARG  19   5.334   2.162  -2.822
  152   2HG   ARG  19          HG3       ARG  19   6.020   1.718  -4.373
  153   1HD   ARG  19          HD2       ARG  19   7.535   1.939  -1.758
  154   2HD   ARG  19          HD3       ARG  19   7.218   0.495  -2.723
  155    HE   ARG  19           HE       ARG  19   8.827   1.200  -4.323
  156   1HH1  ARG  19          HH22      ARG  19   8.637   3.505  -1.674
  157   2HH1  ARG  19          HH21      ARG  19  10.155   4.250  -2.075
  158   1HH2  ARG  19          HH12      ARG  19  10.887   2.076  -4.652
  159   2HH2  ARG  19          HH11      ARG  19  11.423   3.408  -3.654
  160    H    GLN  20           H        GLN  20   5.664   5.230  -6.544
  161    HA   GLN  20           HA       GLN  20   6.713   7.895  -6.095
  162   1HB   GLN  20          HB2       GLN  20   5.305   6.863  -8.597
  163   2HB   GLN  20          HB3       GLN  20   6.288   8.303  -8.452
  164   1HG   GLN  20          HG2       GLN  20   8.281   6.890  -7.915
  165   2HG   GLN  20          HG3       GLN  20   7.297   5.441  -8.157
  166   1HE2  GLN  20          HE21      GLN  20   8.287   4.593 -10.060
  167   2HE2  GLN  20          HE22      GLN  20   8.386   5.521 -11.551
  168    H    ILE  21           H        ILE  21   3.461   6.593  -6.513
  169    HA   ILE  21           HA       ILE  21   2.112   9.081  -6.880
  170    HB   ILE  21           HB       ILE  21   0.892   6.534  -5.719
  171   1HG1  ILE  21          HG12      ILE  21   1.522   7.170  -8.620
  172   2HG1  ILE  21          HG13      ILE  21   2.205   5.858  -7.663
  173   1HG2  ILE  21          HG21      ILE  21  -1.145   7.364  -6.781
  174   2HG2  ILE  21          HG22      ILE  21  -0.488   8.617  -5.732
  175   3HG2  ILE  21          HG23      ILE  21  -0.255   8.731  -7.491
  176   1HD1  ILE  21          HD11      ILE  21   0.622   4.873  -9.090
  177   2HD1  ILE  21          HD12      ILE  21  -0.025   4.804  -7.447
  178   3HD1  ILE  21          HD13      ILE  21  -0.657   6.009  -8.607
  179    H    ILE  22           H        ILE  22   2.778   7.008  -4.089
  180    HA   ILE  22           HA       ILE  22   1.369   8.626  -2.134
  181    HB   ILE  22           HB       ILE  22   3.454   6.472  -1.637
  182   1HG1  ILE  22          HG12      ILE  22   1.853   5.289  -2.865
  183   2HG1  ILE  22          HG13      ILE  22   1.372   5.019  -1.208
  184   1HG2  ILE  22          HG21      ILE  22   1.212   7.478   0.164
  185   2HG2  ILE  22          HG22      ILE  22   2.359   6.179   0.533
  186   3HG2  ILE  22          HG23      ILE  22   2.940   7.834   0.380
  187   1HD1  ILE  22          HD11      ILE  22  -0.633   5.413  -2.391
  188   2HD1  ILE  22          HD12      ILE  22  -0.323   6.935  -1.519
  189   3HD1  ILE  22          HD13      ILE  22   0.021   6.809  -3.256
  190    H    GLN  23           H        GLN  23   4.744   8.480  -3.177
  191    HA   GLN  23           HA       GLN  23   5.854  10.326  -1.315
  192   1HB   GLN  23          HB2       GLN  23   6.548   9.378  -4.102
  193   2HB   GLN  23          HB3       GLN  23   7.546  10.597  -3.317
  194   1HG   GLN  23          HG2       GLN  23   6.979   7.859  -2.093
  195   2HG   GLN  23          HG3       GLN  23   8.374   8.233  -3.106
  196   1HE2  GLN  23          HE21      GLN  23   9.491   7.392  -1.023
  197   2HE2  GLN  23          HE22      GLN  23   9.761   8.588   0.230
  198    H    GLN  24           H        GLN  24   3.454  11.034  -3.552
  199    HA   GLN  24           HA       GLN  24   4.099  13.975  -3.502
  200   1HB   GLN  24          HB2       GLN  24   2.549  12.465  -5.646
  201   2HB   GLN  24          HB3       GLN  24   2.941  14.191  -5.637
  202   1HG   GLN  24          HG2       GLN  24   5.339  13.644  -5.818
  203   2HG   GLN  24          HG3       GLN  24   4.943  11.916  -5.717
  204   1HE2  GLN  24          HE21      GLN  24   4.514  10.827  -7.599
  205   2HE2  GLN  24          HE22      GLN  24   4.277  11.607  -9.167
  206    H    ASN  25           H        ASN  25   1.625  11.485  -3.438
  207    HA   ASN  25           HA       ASN  25  -0.161  13.242  -1.808
  208   1HB   ASN  25          HB2       ASN  25  -0.807  11.618  -4.254
  209   2HB   ASN  25          HB3       ASN  25  -2.008  11.741  -2.961
  210   1HD2  ASN  25          HD21      ASN  25  -2.510  13.938  -2.117
  211   2HD2  ASN  25          HD22      ASN  25  -2.595  15.223  -3.323
  212    HA   PRO  26           HA       PRO  26   0.752   9.495   0.727
  213   1HB   PRO  26          HB2       PRO  26   0.833  10.780   3.147
  214   2HB   PRO  26          HB3       PRO  26   2.237  10.647   2.042
  215   1HG   PRO  26          HG2       PRO  26   0.292  12.955   2.296
  216   2HG   PRO  26          HG3       PRO  26   2.087  13.017   2.306
  217   1HD   PRO  26          HD2       PRO  26   0.650  13.522   0.092
  218   2HD   PRO  26          HD3       PRO  26   2.176  12.590  -0.029
  219    H    SER  27           H        SER  27  -1.680  12.018   0.774
  220    HA   SER  27           HA       SER  27  -3.720  10.852   2.366
  221   1HB   SER  27          HB2       SER  27  -5.220  12.223   0.889
  222   2HB   SER  27          HB3       SER  27  -3.889  13.117   1.633
  223    HG   SER  27           HG       SER  27  -4.243  13.509  -0.650
  224    H    LEU  28           H        LEU  28  -2.442   9.730  -0.670
  225    HA   LEU  28           HA       LEU  28  -4.821   8.009  -1.149
  226   1HB   LEU  28          HB2       LEU  28  -2.457   8.679  -2.934
  227   2HB   LEU  28          HB3       LEU  28  -3.798   7.620  -3.367
  228    HG   LEU  28           HG       LEU  28  -3.982  10.612  -2.832
  229   1HD1  LEU  28          HD11      LEU  28  -2.975   9.926  -4.998
  230   2HD1  LEU  28          HD12      LEU  28  -4.408   8.926  -5.332
  231   3HD1  LEU  28          HD13      LEU  28  -4.557  10.695  -5.221
  232   1HD2  LEU  28          HD21      LEU  28  -6.077   9.590  -2.073
  233   2HD2  LEU  28          HD22      LEU  28  -6.330  10.411  -3.611
  234   3HD2  LEU  28          HD23      LEU  28  -6.187   8.639  -3.576
  235    H    LEU  29           H        LEU  29  -2.142   7.641   0.724
  236    HA   LEU  29           HA       LEU  29  -1.303   4.993   0.063
  237   1HB   LEU  29          HB2       LEU  29  -0.141   6.399   1.663
  238   2HB   LEU  29          HB3       LEU  29  -1.489   6.416   2.753
  239    HG   LEU  29           HG       LEU  29  -1.273   4.007   3.192
  240   1HD1  LEU  29          HD11      LEU  29   0.768   2.794   2.366
  241   2HD1  LEU  29          HD12      LEU  29  -0.406   3.139   1.094
  242   3HD1  LEU  29          HD13      LEU  29   1.056   4.142   1.236
  243   1HD2  LEU  29          HD21      LEU  29   0.883   4.080   4.380
  244   2HD2  LEU  29          HD22      LEU  29   1.369   5.505   3.432
  245   3HD2  LEU  29          HD23      LEU  29   0.001   5.606   4.560
  246    HA   PRO  30           HA       PRO  30  -5.267   3.493   2.655
  247   1HB   PRO  30          HB2       PRO  30  -7.016   5.806   1.819
  248   2HB   PRO  30          HB3       PRO  30  -7.063   4.851   3.312
  249   1HG   PRO  30          HG2       PRO  30  -6.005   7.401   2.992
  250   2HG   PRO  30          HG3       PRO  30  -5.523   6.273   4.310
  251   1HD   PRO  30          HD2       PRO  30  -3.982   7.169   1.981
  252   2HD   PRO  30          HD3       PRO  30  -3.429   6.263   3.407
  253    H    ALA  31           H        ALA  31  -5.674   5.648  -0.114
  254    HA   ALA  31           HA       ALA  31  -7.434   3.983  -1.613
  255   1HB   ALA  31          HB1       ALA  31  -7.197   6.479  -1.683
  256   2HB   ALA  31          HB2       ALA  31  -5.687   6.270  -2.592
  257   3HB   ALA  31          HB3       ALA  31  -7.215   5.696  -3.284
  258    H    LEU  32           H        LEU  32  -4.051   3.515  -1.145
  259    HA   LEU  32           HA       LEU  32  -3.768   1.995  -3.698
  260   1HB   LEU  32          HB2       LEU  32  -1.979   3.543  -3.201
  261   2HB   LEU  32          HB3       LEU  32  -1.841   2.895  -1.554
  262    HG   LEU  32           HG       LEU  32  -0.969   0.800  -2.365
  263   1HD1  LEU  32          HD11      LEU  32  -2.172   0.565  -4.505
  264   2HD1  LEU  32          HD12      LEU  32  -1.276   1.945  -5.174
  265   3HD1  LEU  32          HD13      LEU  32  -0.440   0.425  -4.747
  266   1HD2  LEU  32          HD21      LEU  32   0.443   3.144  -3.708
  267   2HD2  LEU  32          HD22      LEU  32   0.524   2.749  -1.979
  268   3HD2  LEU  32          HD23      LEU  32   1.191   1.624  -3.173
  269    H    LEU  33           H        LEU  33  -3.582   1.658  -0.130
  270    HA   LEU  33           HA       LEU  33  -3.402  -1.188   0.019
  271   1HB   LEU  33          HB2       LEU  33  -4.772   0.880   1.777
  272   2HB   LEU  33          HB3       LEU  33  -4.539  -0.805   2.246
  273    HG   LEU  33           HG       LEU  33  -2.114   0.826   1.426
  274   1HD1  LEU  33          HD11      LEU  33  -3.284   2.250   2.992
  275   2HD1  LEU  33          HD12      LEU  33  -3.446   0.906   4.154
  276   3HD1  LEU  33          HD13      LEU  33  -1.837   1.559   3.747
  277   1HD2  LEU  33          HD21      LEU  33  -2.541  -1.393   3.469
  278   2HD2  LEU  33          HD22      LEU  33  -1.875  -1.605   1.834
  279   3HD2  LEU  33          HD23      LEU  33  -0.993  -0.643   3.034
  280    H    GLN  34           H        GLN  34  -6.280   0.950  -0.282
  281    HA   GLN  34           HA       GLN  34  -8.231  -1.077  -0.552
  282   1HB   GLN  34          HB2       GLN  34  -8.712   1.302  -0.153
  283   2HB   GLN  34          HB3       GLN  34  -8.098   1.714  -1.753
  284   1HG   GLN  34          HG2       GLN  34 -10.527   1.743  -1.730
  285   2HG   GLN  34          HG3       GLN  34  -9.957   0.492  -2.816
  286   1HE2  GLN  34          HE21      GLN  34 -10.216  -1.782  -2.127
  287   2HE2  GLN  34          HE22      GLN  34 -11.421  -2.170  -0.898
  288    H    GLN  35           H        GLN  35  -5.860   0.042  -2.984
  289    HA   GLN  35           HA       GLN  35  -7.343  -1.275  -5.184
  290   1HB   GLN  35          HB2       GLN  35  -4.710   0.233  -5.032
  291   2HB   GLN  35          HB3       GLN  35  -5.132  -0.752  -6.436
  292   1HG   GLN  35          HG2       GLN  35  -7.168   0.503  -6.819
  293   2HG   GLN  35          HG3       GLN  35  -6.923   1.449  -5.350
  294   1HE2  GLN  35          HE21      GLN  35  -5.436   3.185  -5.384
  295   2HE2  GLN  35          HE22      GLN  35  -4.641   3.718  -6.871
  296    H    ILE  36           H        ILE  36  -4.492  -1.940  -3.141
  297    HA   ILE  36           HA       ILE  36  -3.916  -4.527  -4.234
  298    HB   ILE  36           HB       ILE  36  -3.597  -3.526  -1.405
  299   1HG1  ILE  36          HG12      ILE  36  -1.518  -3.680  -3.647
  300   2HG1  ILE  36          HG13      ILE  36  -2.377  -2.208  -3.218
  301   1HG2  ILE  36          HG21      ILE  36  -3.525  -6.040  -1.564
  302   2HG2  ILE  36          HG22      ILE  36  -2.365  -5.930  -2.886
  303   3HG2  ILE  36          HG23      ILE  36  -1.916  -5.418  -1.243
  304   1HD1  ILE  36          HD11      ILE  36  -1.490  -2.402  -0.877
  305   2HD1  ILE  36          HD12      ILE  36  -0.441  -3.724  -1.463
  306   3HD1  ILE  36          HD13      ILE  36  -0.280  -2.096  -2.141
  307    H    GLY  37           H        GLY  37  -6.299  -3.494  -1.683
  308   1HA   GLY  37          HA2       GLY  37  -7.572  -5.948  -1.268
  309   2HA   GLY  37          HA3       GLY  37  -8.320  -4.357  -1.131
  310    H    ARG  38           H        ARG  38  -7.550  -4.369  -4.318
  311    HA   ARG  38           HA       ARG  38  -9.918  -5.964  -5.265
  312   1HB   ARG  38          HB2       ARG  38  -8.600  -3.504  -6.452
  313   2HB   ARG  38          HB3       ARG  38  -9.919  -4.414  -7.181
  314   1HG   ARG  38          HG2       ARG  38 -10.101  -2.993  -4.486
  315   2HG   ARG  38          HG3       ARG  38 -10.585  -2.347  -6.049
  316   1HD   ARG  38          HD2       ARG  38 -12.582  -3.079  -5.096
  317   2HD   ARG  38          HD3       ARG  38 -12.177  -4.346  -6.261
  318    HE   ARG  38           HE       ARG  38 -11.057  -5.067  -3.749
  319   1HH1  ARG  38          HH22      ARG  38 -14.301  -4.797  -5.050
  320   2HH1  ARG  38          HH21      ARG  38 -14.907  -6.040  -3.978
  321   1HH2  ARG  38          HH12      ARG  38 -11.826  -6.587  -2.497
  322   2HH2  ARG  38          HH11      ARG  38 -13.519  -7.038  -2.529
  323    H    GLU  39           H        GLU  39  -6.493  -5.160  -6.043
  324    HA   GLU  39           HA       GLU  39  -6.372  -7.057  -8.228
  325   1HB   GLU  39          HB2       GLU  39  -4.342  -5.356  -6.719
  326   2HB   GLU  39          HB3       GLU  39  -3.964  -6.359  -8.127
  327   1HG   GLU  39          HG2       GLU  39  -5.711  -5.089  -9.420
  328   2HG   GLU  39          HG3       GLU  39  -5.864  -3.978  -8.056
  329    H    ASN  40           H        ASN  40  -5.437  -7.124  -4.809
  330    HA   ASN  40           HA       ASN  40  -5.105 -10.009  -4.858
  331   1HB   ASN  40          HB2       ASN  40  -2.798  -8.983  -5.482
  332   2HB   ASN  40          HB3       ASN  40  -2.737  -8.384  -3.846
  333   1HD2  ASN  40          HD21      ASN  40  -1.041 -10.429  -5.207
  334   2HD2  ASN  40          HD22      ASN  40  -1.244 -11.897  -4.251
  335    HA   PRO  41           HA       PRO  41  -7.000  -8.056  -1.047
  336   1HB   PRO  41          HB2       PRO  41  -9.065  -9.860  -0.709
  337   2HB   PRO  41          HB3       PRO  41  -9.135  -8.399  -1.749
  338   1HG   PRO  41          HG2       PRO  41  -8.468 -11.223  -2.588
  339   2HG   PRO  41          HG3       PRO  41  -9.668 -10.105  -3.325
  340   1HD   PRO  41          HD2       PRO  41  -7.215 -10.360  -4.384
  341   2HD   PRO  41          HD3       PRO  41  -7.934  -8.727  -4.225
  342    H    GLN  42           H        GLN  42  -5.695 -11.207  -1.757
  343    HA   GLN  42           HA       GLN  42  -5.535 -12.154   1.005
  344   1HB   GLN  42          HB2       GLN  42  -3.880 -12.989  -1.403
  345   2HB   GLN  42          HB3       GLN  42  -4.130 -13.889   0.103
  346   1HG   GLN  42          HG2       GLN  42  -6.595 -13.969  -0.448
  347   2HG   GLN  42          HG3       GLN  42  -6.226 -13.246  -2.015
  348   1HE2  GLN  42          HE21      GLN  42  -7.530 -15.707  -1.960
  349   2HE2  GLN  42          HE22      GLN  42  -6.409 -16.949  -2.506
  350    H    LEU  43           H        LEU  43  -3.232 -10.628  -1.328
  351    HA   LEU  43           HA       LEU  43  -1.085 -10.250   0.520
  352   1HB   LEU  43          HB2       LEU  43  -0.970  -9.946  -2.010
  353   2HB   LEU  43          HB3       LEU  43  -1.949  -8.488  -1.811
  354    HG   LEU  43           HG       LEU  43  -0.235  -7.375  -0.568
  355   1HD1  LEU  43          HD11      LEU  43   1.435  -9.909  -0.877
  356   2HD1  LEU  43          HD12      LEU  43   2.026  -8.341  -0.259
  357   3HD1  LEU  43          HD13      LEU  43   0.827  -9.233   0.655
  358   1HD2  LEU  43          HD21      LEU  43   0.958  -8.668  -3.047
  359   2HD2  LEU  43          HD22      LEU  43  -0.194  -7.313  -3.043
  360   3HD2  LEU  43          HD23      LEU  43   1.407  -7.103  -2.326
  361    H    LEU  44           H        LEU  44  -4.045  -8.424  -0.110
  362    HA   LEU  44           HA       LEU  44  -3.254  -6.060   1.317
  363   1HB   LEU  44          HB2       LEU  44  -5.229  -6.333  -0.263
  364   2HB   LEU  44          HB3       LEU  44  -6.099  -7.132   1.007
  365    HG   LEU  44           HG       LEU  44  -6.355  -4.554   0.471
  366   1HD1  LEU  44          HD11      LEU  44  -7.279  -4.138   2.615
  367   2HD1  LEU  44          HD12      LEU  44  -7.690  -5.760   2.058
  368   3HD1  LEU  44          HD13      LEU  44  -6.435  -5.550   3.317
  369   1HD2  LEU  44          HD21      LEU  44  -5.222  -3.051   1.969
  370   2HD2  LEU  44          HD22      LEU  44  -4.266  -4.353   2.679
  371   3HD2  LEU  44          HD23      LEU  44  -4.016  -3.883   0.976
  372    H    GLN  45           H        GLN  45  -5.353  -8.680   2.325
  373    HA   GLN  45           HA       GLN  45  -5.455  -8.244   5.121
  374   1HB   GLN  45          HB2       GLN  45  -5.581 -10.800   3.491
  375   2HB   GLN  45          HB3       GLN  45  -5.848 -10.769   5.236
  376   1HG   GLN  45          HG2       GLN  45  -7.751  -9.302   5.033
  377   2HG   GLN  45          HG3       GLN  45  -7.456  -9.045   3.308
  378   1HE2  GLN  45          HE21      GLN  45  -7.795 -10.839   1.832
  379   2HE2  GLN  45          HE22      GLN  45  -8.900 -12.146   2.282
  380    H    GLN  46           H        GLN  46  -2.728  -9.630   3.308
  381    HA   GLN  46           HA       GLN  46  -1.241 -10.383   5.732
  382   1HB   GLN  46          HB2       GLN  46  -0.647 -10.211   2.750
  383   2HB   GLN  46          HB3       GLN  46   0.616 -10.509   3.931
  384   1HG   GLN  46          HG2       GLN  46  -0.570 -12.531   4.730
  385   2HG   GLN  46          HG3       GLN  46  -1.922 -12.193   3.660
  386   1HE2  GLN  46          HE21      GLN  46  -1.768 -14.131   2.427
  387   2HE2  GLN  46          HE22      GLN  46  -0.384 -14.445   1.380
  388    H    ILE  47           H        ILE  47  -1.102  -7.634   3.402
  389    HA   ILE  47           HA       ILE  47   1.088  -6.281   4.662
  390    HB   ILE  47           HB       ILE  47  -1.131  -5.392   2.814
  391   1HG1  ILE  47          HG12      ILE  47   1.909  -5.587   2.535
  392   2HG1  ILE  47          HG13      ILE  47   0.777  -6.837   2.009
  393   1HG2  ILE  47          HG21      ILE  47  -0.683  -3.413   4.194
  394   2HG2  ILE  47          HG22      ILE  47   1.069  -3.640   3.997
  395   3HG2  ILE  47          HG23      ILE  47   0.045  -3.184   2.619
  396   1HD1  ILE  47          HD11      ILE  47   1.080  -4.044   0.864
  397   2HD1  ILE  47          HD12      ILE  47   1.382  -5.598   0.075
  398   3HD1  ILE  47          HD13      ILE  47  -0.284  -5.129   0.485
  399    H    SER  48           H        SER  48  -2.444  -6.179   5.279
  400    HA   SER  48           HA       SER  48  -2.291  -4.022   7.185
  401   1HB   SER  48          HB2       SER  48  -4.535  -4.610   7.837
  402   2HB   SER  48          HB3       SER  48  -4.384  -4.646   6.074
  403    HG   SER  48           HG       SER  48  -5.508  -6.465   6.985
  404    H    GLN  49           H        GLN  49  -1.874  -7.498   7.525
  405    HA   GLN  49           HA       GLN  49  -1.644  -7.560  10.413
  406   1HB   GLN  49          HB2       GLN  49  -1.045  -9.439   8.115
  407   2HB   GLN  49          HB3       GLN  49  -0.453  -9.829   9.727
  408   1HG   GLN  49          HG2       GLN  49  -2.748  -9.672  10.639
  409   2HG   GLN  49          HG3       GLN  49  -3.368  -9.263   9.038
  410   1HE2  GLN  49          HE21      GLN  49  -3.372 -10.926   7.389
  411   2HE2  GLN  49          HE22      GLN  49  -3.235 -12.633   7.837
  412    H    HIS  50           H        HIS  50   0.501  -6.273   8.082
  413    HA   HIS  50           HA       HIS  50   2.783  -6.311  10.002
  414   1HB   HIS  50          HB2       HIS  50   2.925  -6.991   7.037
  415   2HB   HIS  50          HB3       HIS  50   4.299  -6.887   8.140
  416    HD1  HIS  50           HD1      HIS  50   1.559  -9.257   7.091
  417    HD2  HIS  50           HD2      HIS  50   4.542  -8.900  10.019
  418    HE1  HIS  50           HE1      HIS  50   1.842 -11.583   8.107
  419    H    GLN  51           H        GLN  51   0.782  -4.191   9.010
  420    HA   GLN  51           HA       GLN  51   1.854  -2.735   6.949
  421   1HB   GLN  51          HB2       GLN  51  -0.486  -2.734   8.087
  422   2HB   GLN  51          HB3       GLN  51   0.153  -1.404   9.069
  423   1HG   GLN  51          HG2       GLN  51   0.656  -0.138   6.995
  424   2HG   GLN  51          HG3       GLN  51   0.119  -1.507   6.015
  425   1HE2  GLN  51          HE21      GLN  51  -0.911   1.474   7.149
  426   2HE2  GLN  51          HE22      GLN  51  -2.644   1.159   7.092
  427    H    GLU  52           H        GLU  52   2.752  -2.408  10.331
  428    HA   GLU  52           HA       GLU  52   4.160   0.059  10.260
  429   1HB   GLU  52          HB2       GLU  52   4.990  -2.439  11.797
  430   2HB   GLU  52          HB3       GLU  52   5.410  -0.769  12.137
  431   1HG   GLU  52          HG2       GLU  52   3.762  -0.925  13.654
  432   2HG   GLU  52          HG3       GLU  52   2.723  -0.519  12.302
  433    H    HIS  53           H        HIS  53   5.202  -3.222   9.292
  434    HA   HIS  53           HA       HIS  53   7.909  -2.427   8.531
  435   1HB   HIS  53          HB2       HIS  53   6.313  -4.957   7.949
  436   2HB   HIS  53          HB3       HIS  53   8.017  -4.724   7.610
  437    HD1  HIS  53           HD1      HIS  53   5.773  -5.844  10.376
  438    HD2  HIS  53           HD2      HIS  53   9.660  -4.326   9.866
  439    HE1  HIS  53           HE1      HIS  53   7.041  -6.388  12.516
  440    H    PHE  54           H        PHE  54   4.777  -2.839   6.863
  441    HA   PHE  54           HA       PHE  54   5.753  -2.675   4.168
  442   1HB   PHE  54          HB2       PHE  54   3.433  -3.344   4.728
  443   2HB   PHE  54          HB3       PHE  54   3.115  -1.731   5.359
  444    HD1  PHE  54           HD1      PHE  54   4.519  -3.196   2.154
  445    HD2  PHE  54           HD2      PHE  54   1.828  -0.364   3.987
  446    HE1  PHE  54           HE1      PHE  54   3.757  -2.463  -0.086
  447    HE2  PHE  54           HE2      PHE  54   1.068   0.358   1.740
  448    HZ   PHE  54           HZ       PHE  54   2.028  -0.687  -0.298
  449    H    ILE  55           H        ILE  55   4.669  -0.052   6.397
  450    HA   ILE  55           HA       ILE  55   5.166   2.092   4.623
  451    HB   ILE  55           HB       ILE  55   5.022   1.961   7.588
  452   1HG1  ILE  55          HG12      ILE  55   3.223   3.080   5.378
  453   2HG1  ILE  55          HG13      ILE  55   3.010   1.511   6.161
  454   1HG2  ILE  55          HG21      ILE  55   4.942   4.453   7.601
  455   2HG2  ILE  55          HG22      ILE  55   6.510   3.891   7.060
  456   3HG2  ILE  55          HG23      ILE  55   5.331   4.480   5.869
  457   1HD1  ILE  55          HD11      ILE  55   2.712   2.688   8.346
  458   2HD1  ILE  55          HD12      ILE  55   2.713   4.233   7.444
  459   3HD1  ILE  55          HD13      ILE  55   1.459   3.021   7.125
  460    H    GLN  56           H        GLN  56   7.535   0.329   6.662
  461    HA   GLN  56           HA       GLN  56   9.698   2.180   6.198
  462   1HB   GLN  56          HB2       GLN  56  10.031  -0.780   6.744
  463   2HB   GLN  56          HB3       GLN  56  11.174   0.519   7.056
  464   1HG   GLN  56          HG2       GLN  56   8.720  -0.267   8.582
  465   2HG   GLN  56          HG3       GLN  56  10.355  -0.063   9.167
  466   1HE2  GLN  56          HE21      GLN  56   7.379   1.277   9.406
  467   2HE2  GLN  56          HE22      GLN  56   7.834   2.953   9.720
  468    H    MET  57           H        MET  57   8.189   0.122   3.981
  469    HA   MET  57           HA       MET  57  10.549   0.071   2.130
  470   1HB   MET  57          HB2       MET  57   8.216  -1.829   2.559
  471   2HB   MET  57          HB3       MET  57   9.250  -1.899   1.131
  472   1HG   MET  57          HG2       MET  57  10.215  -2.126   4.009
  473   2HG   MET  57          HG3       MET  57   9.946  -3.467   2.899
  474   1HE   MET  57          HE1       MET  57  13.860  -3.411   3.259
  475   2HE   MET  57          HE2       MET  57  12.726  -2.919   4.531
  476   3HE   MET  57          HE3       MET  57  12.364  -4.336   3.516
  477    H    LEU  58           H        LEU  58   6.993   0.497   2.289
  478    HA   LEU  58           HA       LEU  58   6.361   1.579  -0.195
  479   1HB   LEU  58          HB2       LEU  58   4.858   0.771   1.378
  480   2HB   LEU  58          HB3       LEU  58   5.447   1.828   2.645
  481    HG   LEU  58           HG       LEU  58   3.197   2.165   1.643
  482   1HD1  LEU  58          HD11      LEU  58   4.293   3.687   3.254
  483   2HD1  LEU  58          HD12      LEU  58   4.972   4.624   1.901
  484   3HD1  LEU  58          HD13      LEU  58   3.220   4.537   2.142
  485   1HD2  LEU  58          HD21      LEU  58   3.855   2.192  -0.762
  486   2HD2  LEU  58          HD22      LEU  58   2.914   3.607  -0.271
  487   3HD2  LEU  58          HD23      LEU  58   4.662   3.756  -0.509
  488    H    ASN  59           H        ASN  59   7.636   3.264   2.747
  489    HA   ASN  59           HA       ASN  59   7.396   5.860   1.417
  490   1HB   ASN  59          HB2       ASN  59   6.621   5.233   3.786
  491   2HB   ASN  59          HB3       ASN  59   8.332   5.236   4.235
  492   1HD2  ASN  59          HD21      ASN  59   8.115   6.960   5.699
  493   2HD2  ASN  59          HD22      ASN  59   7.698   8.589   5.167
  494    H    GLU  60           H        GLU  60   9.773   3.692   1.162
  495    HA   GLU  60           HA       GLU  60  12.214   5.171   1.582
  496   1HB   GLU  60          HB2       GLU  60  11.361   2.765  -0.018
  497   2HB   GLU  60          HB3       GLU  60  12.993   3.409  -0.203
  498   1HG   GLU  60          HG2       GLU  60  11.805   2.700   2.503
  499   2HG   GLU  60          HG3       GLU  60  12.682   1.547   1.495
  500    HA   PRO  61           HA       PRO  61  12.534   7.802  -2.071
  501   1HB   PRO  61          HB2       PRO  61  15.114   6.383  -2.679
  502   2HB   PRO  61          HB3       PRO  61  14.768   8.145  -2.560
  503   1HG   PRO  61          HG2       PRO  61  16.067   6.819  -0.577
  504   2HG   PRO  61          HG3       PRO  61  14.915   8.155  -0.260
  505   1HD   PRO  61          HD2       PRO  61  14.496   5.207   0.061
  506   2HD   PRO  61          HD3       PRO  61  13.851   6.608   0.991
  507    H    VAL  62           H        VAL  62  12.382   7.748  -4.372
  508    HA   VAL  62           HA       VAL  62  11.921   5.090  -5.650
  509    HB   VAL  62           HB       VAL  62  10.297   6.388  -7.033
  510   1HG1  VAL  62          HG11      VAL  62   9.527   4.896  -5.263
  511   2HG1  VAL  62          HG12      VAL  62   9.702   6.184  -4.048
  512   3HG1  VAL  62          HG13      VAL  62   8.488   6.326  -5.334
  513   1HG2  VAL  62          HG21      VAL  62  11.052   8.705  -6.513
  514   2HG2  VAL  62          HG22      VAL  62   9.328   8.456  -6.224
  515   3HG2  VAL  62          HG23      VAL  62  10.439   8.513  -4.852
  516    H    GLN  63           H        GLN  63  13.743   7.991  -5.846
  517    HA   GLN  63           HA       GLN  63  15.111   7.088  -8.275
  518   1HB   GLN  63          HB2       GLN  63  13.884   9.877  -8.028
  519   2HB   GLN  63          HB3       GLN  63  15.083   9.402  -9.232
  520   1HG   GLN  63          HG2       GLN  63  13.482   7.665 -10.085
  521   2HG   GLN  63          HG3       GLN  63  12.244   8.323  -9.010
  522   1HE2  GLN  63          HE21      GLN  63  12.635   8.254 -12.114
  523   2HE2  GLN  63          HE22      GLN  63  12.309   9.926 -12.551
  524    H    GLU  64           H        GLU  64  17.205   8.227  -8.496
  525    HA   GLU  64           HA       GLU  64  18.235   9.605  -6.067
  526   1HB   GLU  64          HB2       GLU  64  19.458   7.092  -7.283
  527   2HB   GLU  64          HB3       GLU  64  20.207   8.106  -6.041
  528   1HG   GLU  64          HG2       GLU  64  18.304   7.608  -4.510
  529   2HG   GLU  64          HG3       GLU  64  17.637   6.508  -5.715
  530    H    ALA  65           H        ALA  65  20.205  10.761  -6.411
  531    HA   ALA  65           HA       ALA  65  20.427  12.008  -8.979
  532   1HB   ALA  65          HB1       ALA  65  20.816  13.148  -6.824
  533   2HB   ALA  65          HB2       ALA  65  22.248  12.131  -6.537
  534   3HB   ALA  65          HB3       ALA  65  22.226  13.284  -7.886
  535    H    GLY  66           H        GLY  66  21.926   9.142  -7.799
  536   1HA   GLY  66          HA2       GLY  66  23.028   8.079  -9.970
  537   2HA   GLY  66          HA3       GLY  66  24.283   9.267  -9.602
  538    H    GLY  67           H        GLY  67  23.710   8.843  -6.613
  539   1HA   GLY  67          HA2       GLY  67  24.304   6.148  -5.853
  540   2HA   GLY  67          HA3       GLY  67  25.801   7.075  -5.988
  541    H    GLN  68           H        GLN  68  25.743   6.364  -3.643
  542    HA   GLN  68           HA       GLN  68  24.377   8.385  -1.901
  543   1HB   GLN  68          HB2       GLN  68  24.947   5.453  -1.331
  544   2HB   GLN  68          HB3       GLN  68  24.270   6.614  -0.181
  545   1HG   GLN  68          HG2       GLN  68  22.338   6.991  -1.721
  546   2HG   GLN  68          HG3       GLN  68  22.969   5.740  -2.791
  547   1HE2  GLN  68          HE21      GLN  68  20.594   5.087  -2.203
  548   2HE2  GLN  68          HE22      GLN  68  20.458   3.945  -0.864
  549    H    GLY  69           H        GLY  69  27.260   8.025  -3.126
  550   1HA   GLY  69          HA2       GLY  69  28.685   9.034  -0.696
  551   2HA   GLY  69          HA3       GLY  69  29.418   7.786  -1.709
  552    H    GLY  70           H        GLY  70  27.522  10.166  -3.370
  553   1HA   GLY  70          HA2       GLY  70  29.246  12.326  -3.776
  554   2HA   GLY  70          HA3       GLY  70  29.680  11.125  -4.998
  555    H    GLY  71           H        GLY  71  28.834  13.413  -5.985
  556   1HA   GLY  71          HA2       GLY  71  26.960  12.967  -7.861
  557   2HA   GLY  71          HA3       GLY  71  25.925  13.442  -6.512
  558    H    GLY  72           H        GLY  72  28.008  15.388  -5.519
  559   1HA   GLY  72          HA2       GLY  72  28.759  17.357  -7.391
  560   2HA   GLY  72          HA3       GLY  72  27.139  17.783  -6.834
  Start of MODEL    5
    1   1H    GLY   1           H1       GLY   1  11.232 -16.606   0.476
    2   2H    GLY   1           H2       GLY   1  11.774 -15.150   1.015
    3   3H    GLY   1           H3       GLY   1  10.188 -15.551   1.170
    4   1HA   GLY   1          HA2       GLY   1  10.691 -17.298   2.720
    5   2HA   GLY   1          HA3       GLY   1  12.414 -16.912   2.537
    6    H    SER   2           H        SER   2  11.836 -16.847   5.008
    7    HA   SER   2           HA       SER   2  10.364 -14.869   6.235
    8   1HB   SER   2          HB2       SER   2  12.954 -16.058   7.279
    9   2HB   SER   2          HB3       SER   2  11.640 -15.359   8.241
   10    HG   SER   2           HG       SER   2  11.504 -17.641   8.129
   11    H    HIS   3           H        HIS   3  13.415 -14.304   4.680
   12    HA   HIS   3           HA       HIS   3  14.250 -11.887   5.927
   13   1HB   HIS   3          HB2       HIS   3  15.322 -11.507   3.633
   14   2HB   HIS   3          HB3       HIS   3  15.777 -12.940   4.534
   15    HD1  HIS   3           HD1      HIS   3  15.922 -15.016   3.040
   16    HD2  HIS   3           HD2      HIS   3  13.076 -12.209   1.743
   17    HE1  HIS   3           HE1      HIS   3  14.892 -15.973   0.923
   18    H    MET   4           H        MET   4  11.436 -12.412   3.916
   19    HA   MET   4           HA       MET   4  10.738  -9.575   4.257
   20   1HB   MET   4          HB2       MET   4  11.894  -9.636   2.086
   21   2HB   MET   4          HB3       MET   4  10.762 -10.855   1.495
   22   1HG   MET   4          HG2       MET   4   8.902  -9.274   1.723
   23   2HG   MET   4          HG3       MET   4   9.976  -8.078   2.472
   24   1HE   MET   4          HE1       MET   4   7.979  -7.585  -0.089
   25   2HE   MET   4          HE2       MET   4   8.907  -6.343   0.773
   26   3HE   MET   4          HE3       MET   4   9.030  -6.476  -0.996
   27    HA   PRO   5           HA       PRO   5   7.166 -12.252   5.169
   28   1HB   PRO   5          HB2       PRO   5   5.640 -10.492   6.600
   29   2HB   PRO   5          HB3       PRO   5   7.110 -11.279   7.252
   30   1HG   PRO   5          HG2       PRO   5   6.864  -8.526   6.009
   31   2HG   PRO   5          HG3       PRO   5   7.641  -8.967   7.566
   32   1HD   PRO   5          HD2       PRO   5   9.074  -8.645   5.282
   33   2HD   PRO   5          HD3       PRO   5   9.501  -9.924   6.461
   34    H    LEU   6           H        LEU   6   7.259  -9.604   3.095
   35    HA   LEU   6           HA       LEU   6   4.493 -10.022   2.034
   36   1HB   LEU   6          HB2       LEU   6   6.087  -7.440   2.294
   37   2HB   LEU   6          HB3       LEU   6   4.495  -7.587   1.544
   38    HG   LEU   6           HG       LEU   6   5.048  -8.140   4.493
   39   1HD1  LEU   6          HD11      LEU   6   3.866  -5.717   3.096
   40   2HD1  LEU   6          HD12      LEU   6   3.903  -5.985   4.858
   41   3HD1  LEU   6          HD13      LEU   6   5.415  -5.792   3.959
   42   1HD2  LEU   6          HD21      LEU   6   3.078  -9.358   3.690
   43   2HD2  LEU   6          HD22      LEU   6   2.574  -7.985   4.681
   44   3HD2  LEU   6          HD23      LEU   6   2.454  -7.889   2.907
   45    H    GLU   7           H        GLU   7   6.933 -11.359   1.221
   46    HA   GLU   7           HA       GLU   7   8.439 -10.253  -0.780
   47   1HB   GLU   7          HB2       GLU   7   9.075 -12.492  -1.408
   48   2HB   GLU   7          HB3       GLU   7   8.946 -12.350   0.340
   49   1HG   GLU   7          HG2       GLU   7   6.713 -13.464   0.264
   50   2HG   GLU   7          HG3       GLU   7   6.846 -13.607  -1.487
   51    H    PHE   8           H        PHE   8   5.142 -11.224  -1.307
   52    HA   PHE   8           HA       PHE   8   5.111 -11.528  -4.133
   53   1HB   PHE   8          HB2       PHE   8   3.019 -10.273  -2.334
   54   2HB   PHE   8          HB3       PHE   8   2.746 -10.964  -3.933
   55    HD1  PHE   8           HD1      PHE   8   3.007 -13.455  -4.289
   56    HD2  PHE   8           HD2      PHE   8   3.073 -11.680  -0.359
   57    HE1  PHE   8           HE1      PHE   8   2.593 -15.681  -3.269
   58    HE2  PHE   8           HE2      PHE   8   2.677 -13.907   0.651
   59    HZ   PHE   8           HZ       PHE   8   2.431 -15.910  -0.799
   60    H    LEU   9           H        LEU   9   5.677  -8.632  -2.249
   61    HA   LEU   9           HA       LEU   9   5.009  -6.697  -4.353
   62   1HB   LEU   9          HB2       LEU   9   6.607  -6.517  -1.768
   63   2HB   LEU   9          HB3       LEU   9   6.235  -5.139  -2.793
   64    HG   LEU   9           HG       LEU   9   4.097  -6.866  -1.468
   65   1HD1  LEU   9          HD11      LEU   9   5.225  -4.180  -0.590
   66   2HD1  LEU   9          HD12      LEU   9   3.872  -5.065   0.161
   67   3HD1  LEU   9          HD13      LEU   9   5.509  -5.739   0.213
   68   1HD2  LEU   9          HD21      LEU   9   3.288  -5.592  -3.444
   69   2HD2  LEU   9          HD22      LEU   9   2.625  -4.943  -1.938
   70   3HD2  LEU   9          HD23      LEU   9   3.959  -4.099  -2.751
   71    H    ARG  10           H        ARG  10   7.706  -8.735  -3.565
   72    HA   ARG  10           HA       ARG  10   9.808  -7.092  -4.689
   73   1HB   ARG  10          HB2       ARG  10   9.681  -9.103  -2.824
   74   2HB   ARG  10          HB3       ARG  10  10.232 -10.022  -4.224
   75   1HG   ARG  10          HG2       ARG  10  12.088  -8.283  -4.466
   76   2HG   ARG  10          HG3       ARG  10  11.486  -7.563  -2.954
   77   1HD   ARG  10          HD2       ARG  10  11.865  -9.732  -1.790
   78   2HD   ARG  10          HD3       ARG  10  12.504 -10.426  -3.281
   79    HE   ARG  10           HE       ARG  10  13.809  -8.498  -1.466
   80   1HH1  ARG  10          HH22      ARG  10  14.046 -10.013  -4.628
   81   2HH1  ARG  10          HH21      ARG  10  15.754  -9.660  -4.761
   82   1HH2  ARG  10          HH12      ARG  10  15.971  -8.085  -1.708
   83   2HH2  ARG  10          HH11      ARG  10  16.805  -8.596  -3.154
   84    H    ASN  11           H        ASN  11   7.490  -8.886  -6.241
   85    HA   ASN  11           HA       ASN  11   9.190  -9.385  -8.643
   86   1HB   ASN  11          HB2       ASN  11   8.158 -11.560  -8.917
   87   2HB   ASN  11          HB3       ASN  11   8.915 -11.447  -7.331
   88   1HD2  ASN  11          HD21      ASN  11   5.720 -11.093  -8.944
   89   2HD2  ASN  11          HD22      ASN  11   4.811 -11.732  -7.568
   90    H    GLN  12           H        GLN  12   7.230  -7.166  -8.035
   91    HA   GLN  12           HA       GLN  12   5.591  -7.490 -10.498
   92   1HB   GLN  12          HB2       GLN  12   3.717  -6.333  -9.437
   93   2HB   GLN  12          HB3       GLN  12   4.057  -7.924  -8.771
   94   1HG   GLN  12          HG2       GLN  12   5.131  -6.901  -6.793
   95   2HG   GLN  12          HG3       GLN  12   4.811  -5.283  -7.447
   96   1HE2  GLN  12          HE21      GLN  12   3.382  -8.046  -5.804
   97   2HE2  GLN  12          HE22      GLN  12   1.807  -7.288  -5.575
   98    HA   PRO  13           HA       PRO  13   7.771  -3.684 -11.543
   99   1HB   PRO  13          HB2       PRO  13   5.442  -3.495 -13.464
  100   2HB   PRO  13          HB3       PRO  13   7.176  -3.166 -13.764
  101   1HG   PRO  13          HG2       PRO  13   6.106  -5.512 -14.551
  102   2HG   PRO  13          HG3       PRO  13   7.699  -5.500 -13.722
  103   1HD   PRO  13          HD2       PRO  13   4.978  -6.112 -12.561
  104   2HD   PRO  13          HD3       PRO  13   6.533  -6.976 -12.329
  105    H    GLN  14           H        GLN  14   4.276  -3.756 -10.849
  106    HA   GLN  14           HA       GLN  14   3.847  -0.958 -10.614
  107   1HB   GLN  14          HB2       GLN  14   2.455  -3.292  -9.246
  108   2HB   GLN  14          HB3       GLN  14   1.882  -1.619  -9.217
  109   1HG   GLN  14          HG2       GLN  14   1.796  -1.619 -11.714
  110   2HG   GLN  14          HG3       GLN  14   2.214  -3.331 -11.722
  111   1HE2  GLN  14          HE21      GLN  14  -0.356  -1.636 -12.427
  112   2HE2  GLN  14          HE22      GLN  14  -1.614  -2.578 -11.635
  113    H    PHE  15           H        PHE  15   5.650  -3.003  -8.403
  114    HA   PHE  15           HA       PHE  15   5.123  -1.330  -6.049
  115   1HB   PHE  15          HB2       PHE  15   5.597  -3.737  -5.850
  116   2HB   PHE  15          HB3       PHE  15   7.213  -3.477  -6.517
  117    HD1  PHE  15           HD1      PHE  15   4.991  -2.093  -3.785
  118    HD2  PHE  15           HD2      PHE  15   8.957  -3.337  -4.933
  119    HE1  PHE  15           HE1      PHE  15   5.806  -1.616  -1.492
  120    HE2  PHE  15           HE2      PHE  15   9.768  -2.849  -2.638
  121    HZ   PHE  15           HZ       PHE  15   8.196  -1.987  -0.917
  122    H    GLN  16           H        GLN  16   7.264  -1.210  -8.754
  123    HA   GLN  16           HA       GLN  16   9.105   0.785  -7.613
  124   1HB   GLN  16          HB2       GLN  16   8.589  -0.315 -10.398
  125   2HB   GLN  16          HB3       GLN  16   9.821   0.907 -10.037
  126   1HG   GLN  16          HG2       GLN  16  10.980  -0.674  -8.535
  127   2HG   GLN  16          HG3       GLN  16   9.727  -1.884  -8.808
  128   1HE2  GLN  16          HE21      GLN  16  10.722  -3.512 -10.007
  129   2HE2  GLN  16          HE22      GLN  16  11.648  -3.200 -11.470
  130    H    GLN  17           H        GLN  17   5.867   0.881  -8.622
  131    HA   GLN  17           HA       GLN  17   6.042   3.680  -9.682
  132   1HB   GLN  17          HB2       GLN  17   4.065   1.453 -10.291
  133   2HB   GLN  17          HB3       GLN  17   4.006   3.097 -10.941
  134   1HG   GLN  17          HG2       GLN  17   6.196   2.755 -12.037
  135   2HG   GLN  17          HG3       GLN  17   6.279   1.107 -11.417
  136   1HE2  GLN  17          HE21      GLN  17   6.029   2.325 -14.278
  137   2HE2  GLN  17          HE22      GLN  17   4.712   1.369 -14.956
  138    H    MET  18           H        MET  18   3.831   1.517  -7.759
  139    HA   MET  18           HA       MET  18   1.953   3.474  -7.100
  140   1HB   MET  18          HB2       MET  18   1.241   1.970  -5.393
  141   2HB   MET  18          HB3       MET  18   1.646   1.084  -6.862
  142   1HG   MET  18          HG2       MET  18   3.847   0.439  -5.825
  143   2HG   MET  18          HG3       MET  18   3.391   1.317  -4.366
  144   1HE   MET  18          HE1       MET  18   1.170  -1.175  -6.595
  145   2HE   MET  18          HE2       MET  18   2.770  -1.955  -6.520
  146   3HE   MET  18          HE3       MET  18   1.392  -2.668  -5.663
  147    H    ARG  19           H        ARG  19   5.004   2.802  -5.451
  148    HA   ARG  19           HA       ARG  19   4.617   4.538  -3.185
  149   1HB   ARG  19          HB2       ARG  19   7.197   3.614  -4.542
  150   2HB   ARG  19          HB3       ARG  19   7.038   4.255  -2.897
  151   1HG   ARG  19          HG2       ARG  19   5.399   2.355  -2.456
  152   2HG   ARG  19          HG3       ARG  19   5.893   1.637  -3.978
  153   1HD   ARG  19          HD2       ARG  19   7.910   2.326  -1.811
  154   2HD   ARG  19          HD3       ARG  19   7.128   0.747  -1.956
  155    HE   ARG  19           HE       ARG  19   8.054   0.577  -4.252
  156   1HH1  ARG  19          HH22      ARG  19   9.811   2.735  -2.074
  157   2HH1  ARG  19          HH21      ARG  19  11.260   2.603  -3.027
  158   1HH2  ARG  19          HH12      ARG  19   9.960   0.357  -5.272
  159   2HH2  ARG  19          HH11      ARG  19  11.370   1.244  -4.729
  160    H    GLN  20           H        GLN  20   5.699   5.180  -6.444
  161    HA   GLN  20           HA       GLN  20   6.742   7.863  -6.015
  162   1HB   GLN  20          HB2       GLN  20   5.351   6.818  -8.519
  163   2HB   GLN  20          HB3       GLN  20   6.336   8.256  -8.372
  164   1HG   GLN  20          HG2       GLN  20   8.331   6.872  -7.847
  165   2HG   GLN  20          HG3       GLN  20   7.357   5.406  -8.020
  166   1HE2  GLN  20          HE21      GLN  20   8.352   4.501  -9.872
  167   2HE2  GLN  20          HE22      GLN  20   8.431   5.355 -11.412
  168    H    ILE  21           H        ILE  21   3.493   6.556  -6.544
  169    HA   ILE  21           HA       ILE  21   2.133   9.032  -6.889
  170    HB   ILE  21           HB       ILE  21   0.898   6.505  -5.712
  171   1HG1  ILE  21          HG12      ILE  21   1.589   7.079  -8.611
  172   2HG1  ILE  21          HG13      ILE  21   2.215   5.766  -7.614
  173   1HG2  ILE  21          HG21      ILE  21  -0.217   8.666  -7.546
  174   2HG2  ILE  21          HG22      ILE  21  -1.123   7.323  -6.810
  175   3HG2  ILE  21          HG23      ILE  21  -0.469   8.596  -5.789
  176   1HD1  ILE  21          HD11      ILE  21   0.629   4.804  -9.073
  177   2HD1  ILE  21          HD12      ILE  21  -0.049   4.774  -7.438
  178   3HD1  ILE  21          HD13      ILE  21  -0.624   5.979  -8.626
  179    H    ILE  22           H        ILE  22   2.827   6.998  -4.073
  180    HA   ILE  22           HA       ILE  22   1.419   8.680  -2.168
  181    HB   ILE  22           HB       ILE  22   3.487   6.529  -1.605
  182   1HG1  ILE  22          HG12      ILE  22   1.888   5.279  -2.743
  183   2HG1  ILE  22          HG13      ILE  22   1.343   5.149  -1.085
  184   1HG2  ILE  22          HG21      ILE  22   2.408   6.368   0.577
  185   2HG2  ILE  22          HG22      ILE  22   3.002   8.009   0.318
  186   3HG2  ILE  22          HG23      ILE  22   1.265   7.659   0.147
  187   1HD1  ILE  22          HD11      ILE  22  -0.282   7.073  -1.597
  188   2HD1  ILE  22          HD12      ILE  22   0.100   6.788  -3.309
  189   3HD1  ILE  22          HD13      ILE  22  -0.607   5.487  -2.343
  190    H    GLN  23           H        GLN  23   4.897   8.399  -3.045
  191    HA   GLN  23           HA       GLN  23   5.922  10.250  -1.221
  192   1HB   GLN  23          HB2       GLN  23   6.727   9.042  -3.843
  193   2HB   GLN  23          HB3       GLN  23   7.570  10.499  -3.374
  194   1HG   GLN  23          HG2       GLN  23   8.801   8.578  -2.676
  195   2HG   GLN  23          HG3       GLN  23   8.304   9.536  -1.277
  196   1HE2  GLN  23          HE21      GLN  23   8.963   6.459  -1.992
  197   2HE2  GLN  23          HE22      GLN  23   7.739   5.673  -1.006
  198    H    GLN  24           H        GLN  24   3.760  11.058  -3.772
  199    HA   GLN  24           HA       GLN  24   4.432  13.948  -3.470
  200   1HB   GLN  24          HB2       GLN  24   3.709  14.260  -5.693
  201   2HB   GLN  24          HB3       GLN  24   4.949  12.988  -5.673
  202   1HG   GLN  24          HG2       GLN  24   3.070  11.308  -5.840
  203   2HG   GLN  24          HG3       GLN  24   1.941  12.653  -6.073
  204   1HE2  GLN  24          HE21      GLN  24   4.455  10.698  -7.526
  205   2HE2  GLN  24          HE22      GLN  24   4.333  11.397  -9.143
  206    H    ASN  25           H        ASN  25   1.893  11.531  -3.493
  207    HA   ASN  25           HA       ASN  25   0.053  13.459  -2.162
  208   1HB   ASN  25          HB2       ASN  25  -0.498  11.674  -4.528
  209   2HB   ASN  25          HB3       ASN  25  -1.776  11.999  -3.350
  210   1HD2  ASN  25          HD21      ASN  25  -2.052  14.374  -2.704
  211   2HD2  ASN  25          HD22      ASN  25  -2.088  15.460  -4.090
  212    HA   PRO  26           HA       PRO  26   1.003   9.801   0.498
  213   1HB   PRO  26          HB2       PRO  26   0.921  11.137   2.913
  214   2HB   PRO  26          HB3       PRO  26   2.364  11.037   1.855
  215   1HG   PRO  26          HG2       PRO  26   0.304  13.261   1.970
  216   2HG   PRO  26          HG3       PRO  26   2.097  13.405   2.046
  217   1HD   PRO  26          HD2       PRO  26   0.751  13.794  -0.227
  218   2HD   PRO  26          HD3       PRO  26   2.282  12.857  -0.271
  219    H    SER  27           H        SER  27  -1.618  12.177   0.710
  220    HA   SER  27           HA       SER  27  -3.476  10.819   2.319
  221   1HB   SER  27          HB2       SER  27  -4.087  12.462  -0.162
  222   2HB   SER  27          HB3       SER  27  -5.152  12.176   1.224
  223    HG   SER  27           HG       SER  27  -4.103  14.201   1.367
  224    H    LEU  28           H        LEU  28  -2.331   9.800  -0.796
  225    HA   LEU  28           HA       LEU  28  -4.702   8.091  -1.292
  226   1HB   LEU  28          HB2       LEU  28  -2.222   8.559  -2.980
  227   2HB   LEU  28          HB3       LEU  28  -3.641   7.619  -3.440
  228    HG   LEU  28           HG       LEU  28  -3.499  10.625  -3.023
  229   1HD1  LEU  28          HD11      LEU  28  -2.625   9.715  -5.159
  230   2HD1  LEU  28          HD12      LEU  28  -4.170   8.871  -5.420
  231   3HD1  LEU  28          HD13      LEU  28  -4.111  10.650  -5.414
  232   1HD2  LEU  28          HD21      LEU  28  -5.690   9.930  -2.190
  233   2HD2  LEU  28          HD22      LEU  28  -5.853  10.708  -3.762
  234   3HD2  LEU  28          HD23      LEU  28  -5.955   8.934  -3.644
  235    H    LEU  29           H        LEU  29  -2.019   7.692   0.643
  236    HA   LEU  29           HA       LEU  29  -1.248   5.014   0.097
  237   1HB   LEU  29          HB2       LEU  29  -0.085   6.408   1.669
  238   2HB   LEU  29          HB3       LEU  29  -1.468   6.567   2.705
  239    HG   LEU  29           HG       LEU  29  -1.384   4.172   3.295
  240   1HD1  LEU  29          HD11      LEU  29   0.648   2.838   2.626
  241   2HD1  LEU  29          HD12      LEU  29  -0.470   3.145   1.292
  242   3HD1  LEU  29          HD13      LEU  29   1.019   4.103   1.426
  243   1HD2  LEU  29          HD21      LEU  29   1.311   5.564   3.564
  244   2HD2  LEU  29          HD22      LEU  29  -0.100   5.810   4.613
  245   3HD2  LEU  29          HD23      LEU  29   0.705   4.235   4.580
  246    HA   PRO  30           HA       PRO  30  -5.292   3.620   2.623
  247   1HB   PRO  30          HB2       PRO  30  -6.984   5.948   1.714
  248   2HB   PRO  30          HB3       PRO  30  -7.082   5.017   3.219
  249   1HG   PRO  30          HG2       PRO  30  -5.962   7.539   2.868
  250   2HG   PRO  30          HG3       PRO  30  -5.546   6.437   4.231
  251   1HD   PRO  30          HD2       PRO  30  -3.903   7.253   1.951
  252   2HD   PRO  30          HD3       PRO  30  -3.425   6.327   3.389
  253    H    ALA  31           H        ALA  31  -5.633   5.715  -0.202
  254    HA   ALA  31           HA       ALA  31  -7.414   4.061  -1.678
  255   1HB   ALA  31          HB1       ALA  31  -5.566   6.254  -2.703
  256   2HB   ALA  31          HB2       ALA  31  -7.110   5.720  -3.393
  257   3HB   ALA  31          HB3       ALA  31  -7.073   6.545  -1.814
  258    H    LEU  32           H        LEU  32  -4.012   3.613  -1.182
  259    HA   LEU  32           HA       LEU  32  -3.675   1.985  -3.656
  260   1HB   LEU  32          HB2       LEU  32  -1.918   3.577  -3.152
  261   2HB   LEU  32          HB3       LEU  32  -1.807   2.969  -1.490
  262    HG   LEU  32           HG       LEU  32  -0.886   0.866  -2.240
  263   1HD1  LEU  32          HD11      LEU  32  -0.304   0.460  -4.605
  264   2HD1  LEU  32          HD12      LEU  32  -2.042   0.591  -4.402
  265   3HD1  LEU  32          HD13      LEU  32  -1.142   1.968  -5.072
  266   1HD2  LEU  32          HD21      LEU  32   0.516   3.220  -3.579
  267   2HD2  LEU  32          HD22      LEU  32   0.593   2.820  -1.851
  268   3HD2  LEU  32          HD23      LEU  32   1.284   1.714  -3.046
  269    H    LEU  33           H        LEU  33  -3.629   1.754  -0.076
  270    HA   LEU  33           HA       LEU  33  -3.403  -1.095   0.138
  271   1HB   LEU  33          HB2       LEU  33  -4.849   0.986   1.819
  272   2HB   LEU  33          HB3       LEU  33  -4.606  -0.691   2.316
  273    HG   LEU  33           HG       LEU  33  -2.170   0.939   1.534
  274   1HD1  LEU  33          HD11      LEU  33  -1.970   1.747   3.840
  275   2HD1  LEU  33          HD12      LEU  33  -3.382   2.415   3.008
  276   3HD1  LEU  33          HD13      LEU  33  -3.601   1.116   4.208
  277   1HD2  LEU  33          HD21      LEU  33  -2.677  -1.219   3.625
  278   2HD2  LEU  33          HD22      LEU  33  -1.939  -1.467   2.027
  279   3HD2  LEU  33          HD23      LEU  33  -1.110  -0.472   3.237
  280    H    GLN  34           H        GLN  34  -6.298   1.012  -0.245
  281    HA   GLN  34           HA       GLN  34  -8.239  -1.027  -0.540
  282   1HB   GLN  34          HB2       GLN  34  -8.680   1.390  -0.212
  283   2HB   GLN  34          HB3       GLN  34  -8.090   1.721  -1.845
  284   1HG   GLN  34          HG2       GLN  34  -9.948   0.370  -2.791
  285   2HG   GLN  34          HG3       GLN  34 -10.497  -0.026  -1.158
  286   1HE2  GLN  34          HE21      GLN  34 -10.125   2.658  -3.522
  287   2HE2  GLN  34          HE22      GLN  34 -11.300   3.695  -2.724
  288    H    GLN  35           H        GLN  35  -5.857   0.188  -2.933
  289    HA   GLN  35           HA       GLN  35  -7.223  -1.054  -5.197
  290   1HB   GLN  35          HB2       GLN  35  -6.051   1.017  -5.530
  291   2HB   GLN  35          HB3       GLN  35  -4.564   0.379  -4.812
  292   1HG   GLN  35          HG2       GLN  35  -4.172  -1.077  -6.649
  293   2HG   GLN  35          HG3       GLN  35  -5.774  -0.743  -7.343
  294   1HE2  GLN  35          HE21      GLN  35  -5.248   0.287  -9.308
  295   2HE2  GLN  35          HE22      GLN  35  -4.217   1.715  -9.386
  296    H    ILE  36           H        ILE  36  -4.407  -1.808  -3.142
  297    HA   ILE  36           HA       ILE  36  -3.756  -4.355  -4.290
  298    HB   ILE  36           HB       ILE  36  -3.533  -3.352  -1.450
  299   1HG1  ILE  36          HG12      ILE  36  -1.325  -3.622  -3.547
  300   2HG1  ILE  36          HG13      ILE  36  -2.232  -2.129  -3.340
  301   1HG2  ILE  36          HG21      ILE  36  -2.120  -5.753  -2.762
  302   2HG2  ILE  36          HG22      ILE  36  -1.919  -5.210  -1.089
  303   3HG2  ILE  36          HG23      ILE  36  -3.445  -5.905  -1.609
  304   1HD1  ILE  36          HD11      ILE  36  -1.548  -2.075  -0.927
  305   2HD1  ILE  36          HD12      ILE  36  -0.464  -3.451  -1.271
  306   3HD1  ILE  36          HD13      ILE  36  -0.222  -1.901  -2.098
  307    H    GLY  37           H        GLY  37  -6.214  -3.413  -1.762
  308   1HA   GLY  37          HA2       GLY  37  -7.338  -5.932  -1.333
  309   2HA   GLY  37          HA3       GLY  37  -8.194  -4.392  -1.222
  310    H    ARG  38           H        ARG  38  -7.919  -3.821  -4.168
  311    HA   ARG  38           HA       ARG  38 -10.161  -5.419  -5.187
  312   1HB   ARG  38          HB2       ARG  38  -8.375  -3.420  -6.624
  313   2HB   ARG  38          HB3       ARG  38  -9.822  -4.173  -7.279
  314   1HG   ARG  38          HG2       ARG  38  -9.676  -2.196  -4.982
  315   2HG   ARG  38          HG3       ARG  38 -10.381  -1.985  -6.593
  316   1HD   ARG  38          HD2       ARG  38 -12.084  -3.734  -6.033
  317   2HD   ARG  38          HD3       ARG  38 -11.433  -3.781  -4.381
  318    HE   ARG  38           HE       ARG  38 -12.056  -1.078  -5.086
  319   1HH1  ARG  38          HH22      ARG  38 -13.747  -4.037  -4.250
  320   2HH1  ARG  38          HH21      ARG  38 -15.139  -3.173  -3.634
  321   1HH2  ARG  38          HH12      ARG  38 -13.861  -0.043  -4.297
  322   2HH2  ARG  38          HH11      ARG  38 -15.193  -0.975  -3.663
  323    H    GLU  39           H        GLU  39  -6.671  -5.257  -6.043
  324    HA   GLU  39           HA       GLU  39  -7.003  -7.343  -8.059
  325   1HB   GLU  39          HB2       GLU  39  -4.710  -5.595  -7.095
  326   2HB   GLU  39          HB3       GLU  39  -4.606  -6.727  -8.444
  327   1HG   GLU  39          HG2       GLU  39  -6.436  -4.295  -8.274
  328   2HG   GLU  39          HG3       GLU  39  -4.967  -4.447  -9.233
  329    H    ASN  40           H        ASN  40  -5.677  -7.124  -4.838
  330    HA   ASN  40           HA       ASN  40  -4.811  -9.953  -4.750
  331   1HB   ASN  40          HB2       ASN  40  -3.082  -7.496  -4.183
  332   2HB   ASN  40          HB3       ASN  40  -2.710  -9.136  -3.632
  333   1HD2  ASN  40          HD21      ASN  40  -1.581 -10.475  -4.831
  334   2HD2  ASN  40          HD22      ASN  40  -0.992 -10.022  -6.424
  335    HA   PRO  41           HA       PRO  41  -7.061  -8.129  -0.961
  336   1HB   PRO  41          HB2       PRO  41  -8.867 -10.191  -0.583
  337   2HB   PRO  41          HB3       PRO  41  -9.153  -8.744  -1.600
  338   1HG   PRO  41          HG2       PRO  41  -8.164 -11.451  -2.489
  339   2HG   PRO  41          HG3       PRO  41  -9.505 -10.479  -3.188
  340   1HD   PRO  41          HD2       PRO  41  -7.064 -10.431  -4.305
  341   2HD   PRO  41          HD3       PRO  41  -7.969  -8.898  -4.111
  342    H    GLN  42           H        GLN  42  -5.634 -11.255  -1.697
  343    HA   GLN  42           HA       GLN  42  -5.194 -12.139   1.024
  344   1HB   GLN  42          HB2       GLN  42  -3.688 -12.857  -1.521
  345   2HB   GLN  42          HB3       GLN  42  -3.730 -13.786  -0.010
  346   1HG   GLN  42          HG2       GLN  42  -6.230 -13.989  -0.306
  347   2HG   GLN  42          HG3       GLN  42  -6.060 -13.258  -1.903
  348   1HE2  GLN  42          HE21      GLN  42  -7.021 -16.024  -1.169
  349   2HE2  GLN  42          HE22      GLN  42  -5.948 -17.098  -2.056
  350    H    LEU  43           H        LEU  43  -3.146 -10.345  -1.345
  351    HA   LEU  43           HA       LEU  43  -0.884 -10.078   0.463
  352   1HB   LEU  43          HB2       LEU  43  -0.781  -9.846  -2.039
  353   2HB   LEU  43          HB3       LEU  43  -1.701  -8.357  -1.936
  354    HG   LEU  43           HG       LEU  43   0.062  -7.217  -0.777
  355   1HD1  LEU  43          HD11      LEU  43   1.026  -8.872   0.686
  356   2HD1  LEU  43          HD12      LEU  43   1.470  -9.914  -0.682
  357   3HD1  LEU  43          HD13      LEU  43   2.304  -8.360  -0.416
  358   1HD2  LEU  43          HD21      LEU  43   0.203  -7.353  -3.217
  359   2HD2  LEU  43          HD22      LEU  43   1.827  -7.342  -2.509
  360   3HD2  LEU  43          HD23      LEU  43   1.134  -8.865  -3.107
  361    H    LEU  44           H        LEU  44  -3.874  -8.345  -0.102
  362    HA   LEU  44           HA       LEU  44  -3.133  -5.971   1.363
  363   1HB   LEU  44          HB2       LEU  44  -5.081  -6.292  -0.272
  364   2HB   LEU  44          HB3       LEU  44  -5.961  -7.073   0.999
  365    HG   LEU  44           HG       LEU  44  -6.194  -4.499   0.411
  366   1HD1  LEU  44          HD11      LEU  44  -6.384  -5.484   3.256
  367   2HD1  LEU  44          HD12      LEU  44  -7.195  -4.068   2.526
  368   3HD1  LEU  44          HD13      LEU  44  -7.595  -5.687   1.952
  369   1HD2  LEU  44          HD21      LEU  44  -3.882  -3.815   1.001
  370   2HD2  LEU  44          HD22      LEU  44  -5.115  -2.993   1.968
  371   3HD2  LEU  44          HD23      LEU  44  -4.180  -4.303   2.693
  372    H    GLN  45           H        GLN  45  -5.228  -8.650   2.274
  373    HA   GLN  45           HA       GLN  45  -5.392  -8.297   5.065
  374   1HB   GLN  45          HB2       GLN  45  -5.323 -10.822   3.381
  375   2HB   GLN  45          HB3       GLN  45  -5.596 -10.856   5.126
  376   1HG   GLN  45          HG2       GLN  45  -7.605  -9.538   4.950
  377   2HG   GLN  45          HG3       GLN  45  -7.312  -9.188   3.246
  378   1HE2  GLN  45          HE21      GLN  45  -8.592 -10.391   1.893
  379   2HE2  GLN  45          HE22      GLN  45  -9.181 -12.014   2.256
  380    H    GLN  46           H        GLN  46  -2.618  -9.693   3.280
  381    HA   GLN  46           HA       GLN  46  -1.118 -10.359   5.696
  382   1HB   GLN  46          HB2       GLN  46  -0.529 -10.171   2.726
  383   2HB   GLN  46          HB3       GLN  46   0.769 -10.385   3.892
  384   1HG   GLN  46          HG2       GLN  46  -0.282 -12.426   4.770
  385   2HG   GLN  46          HG3       GLN  46  -1.685 -12.206   3.732
  386   1HE2  GLN  46          HE21      GLN  46  -1.388 -12.375   1.398
  387   2HE2  GLN  46          HE22      GLN  46  -0.067 -13.371   0.759
  388    H    ILE  47           H        ILE  47  -1.035  -7.519   3.455
  389    HA   ILE  47           HA       ILE  47   0.999  -6.078   4.846
  390    HB   ILE  47           HB       ILE  47  -1.315  -5.243   3.093
  391   1HG1  ILE  47          HG12      ILE  47   1.712  -5.045   2.752
  392   2HG1  ILE  47          HG13      ILE  47   0.774  -6.450   2.229
  393   1HG2  ILE  47          HG21      ILE  47  -0.263  -2.936   3.090
  394   2HG2  ILE  47          HG22      ILE  47  -1.063  -3.353   4.599
  395   3HG2  ILE  47          HG23      ILE  47   0.709  -3.436   4.488
  396   1HD1  ILE  47          HD11      ILE  47  -0.580  -4.995   0.753
  397   2HD1  ILE  47          HD12      ILE  47   0.501  -3.632   1.147
  398   3HD1  ILE  47          HD13      ILE  47   1.146  -5.066   0.326
  399    H    SER  48           H        SER  48  -2.522  -6.316   5.448
  400    HA   SER  48           HA       SER  48  -2.609  -4.492   7.648
  401   1HB   SER  48          HB2       SER  48  -4.364  -6.903   7.056
  402   2HB   SER  48          HB3       SER  48  -4.708  -5.670   8.279
  403    HG   SER  48           HG       SER  48  -5.753  -5.196   6.316
  404    H    GLN  49           H        GLN  49  -1.287  -7.690   7.521
  405    HA   GLN  49           HA       GLN  49  -1.242  -8.037  10.467
  406   1HB   GLN  49          HB2       GLN  49  -0.641  -9.790   8.062
  407   2HB   GLN  49          HB3       GLN  49  -0.150 -10.268   9.682
  408   1HG   GLN  49          HG2       GLN  49  -2.450 -10.212  10.479
  409   2HG   GLN  49          HG3       GLN  49  -3.020  -9.540   8.953
  410   1HE2  GLN  49          HE21      GLN  49  -3.245 -10.910   7.138
  411   2HE2  GLN  49          HE22      GLN  49  -3.128 -12.671   7.281
  412    H    HIS  50           H        HIS  50   0.711  -6.544   8.136
  413    HA   HIS  50           HA       HIS  50   3.127  -6.638   9.880
  414   1HB   HIS  50          HB2       HIS  50   3.098  -7.086   6.870
  415   2HB   HIS  50          HB3       HIS  50   4.532  -7.039   7.900
  416    HD1  HIS  50           HD1      HIS  50   1.742  -9.363   6.848
  417    HD2  HIS  50           HD2      HIS  50   4.951  -9.205   9.546
  418    HE1  HIS  50           HE1      HIS  50   2.130 -11.764   7.635
  419    H    GLN  51           H        GLN  51   1.014  -4.556   9.291
  420    HA   GLN  51           HA       GLN  51   1.667  -2.952   7.190
  421   1HB   GLN  51          HB2       GLN  51  -0.431  -3.068   8.731
  422   2HB   GLN  51          HB3       GLN  51   0.365  -1.783   9.658
  423   1HG   GLN  51          HG2       GLN  51   0.486  -0.420   7.546
  424   2HG   GLN  51          HG3       GLN  51  -0.294  -1.749   6.681
  425   1HE2  GLN  51          HE21      GLN  51  -1.925  -0.068   6.074
  426   2HE2  GLN  51          HE22      GLN  51  -3.201   0.280   7.241
  427    H    GLU  52           H        GLU  52   3.029  -2.595  10.450
  428    HA   GLU  52           HA       GLU  52   4.317  -0.053  10.033
  429   1HB   GLU  52          HB2       GLU  52   5.022  -2.370  11.878
  430   2HB   GLU  52          HB3       GLU  52   5.774  -0.771  11.927
  431   1HG   GLU  52          HG2       GLU  52   3.540   0.257  12.345
  432   2HG   GLU  52          HG3       GLU  52   2.819  -1.347  12.392
  433    H    HIS  53           H        HIS  53   5.231  -3.318   9.018
  434    HA   HIS  53           HA       HIS  53   7.950  -2.510   8.203
  435   1HB   HIS  53          HB2       HIS  53   6.390  -5.045   7.560
  436   2HB   HIS  53          HB3       HIS  53   8.102  -4.761   7.290
  437    HD1  HIS  53           HD1      HIS  53   9.632  -4.541   9.630
  438    HD2  HIS  53           HD2      HIS  53   5.679  -5.936   9.944
  439    HE1  HIS  53           HE1      HIS  53   9.437  -5.624  11.924
  440    H    PHE  54           H        PHE  54   4.747  -3.099   6.683
  441    HA   PHE  54           HA       PHE  54   5.570  -2.725   3.959
  442   1HB   PHE  54          HB2       PHE  54   3.378  -3.672   4.501
  443   2HB   PHE  54          HB3       PHE  54   2.901  -2.183   5.317
  444    HD1  PHE  54           HD1      PHE  54   4.105  -3.401   1.959
  445    HD2  PHE  54           HD2      PHE  54   1.717  -0.529   4.110
  446    HE1  PHE  54           HE1      PHE  54   3.292  -2.459  -0.193
  447    HE2  PHE  54           HE2      PHE  54   0.916   0.412   1.956
  448    HZ   PHE  54           HZ       PHE  54   1.701  -0.552  -0.194
  449    H    ILE  55           H        ILE  55   4.193  -0.340   6.280
  450    HA   ILE  55           HA       ILE  55   4.270   1.855   4.522
  451    HB   ILE  55           HB       ILE  55   4.169   1.663   7.492
  452   1HG1  ILE  55          HG12      ILE  55   2.197   2.427   5.275
  453   2HG1  ILE  55          HG13      ILE  55   2.265   0.859   6.084
  454   1HG2  ILE  55          HG21      ILE  55   5.251   3.848   7.005
  455   2HG2  ILE  55          HG22      ILE  55   3.943   4.230   5.854
  456   3HG2  ILE  55          HG23      ILE  55   3.617   4.068   7.593
  457   1HD1  ILE  55          HD11      ILE  55   1.460   3.501   7.321
  458   2HD1  ILE  55          HD12      ILE  55   0.448   2.081   7.004
  459   3HD1  ILE  55          HD13      ILE  55   1.724   1.992   8.245
  460    H    GLN  56           H        GLN  56   6.923   0.566   6.561
  461    HA   GLN  56           HA       GLN  56   8.704   2.805   6.037
  462   1HB   GLN  56          HB2       GLN  56   9.154  -0.040   7.010
  463   2HB   GLN  56          HB3       GLN  56  10.474   1.106   6.760
  464   1HG   GLN  56          HG2       GLN  56   9.510   2.677   8.365
  465   2HG   GLN  56          HG3       GLN  56   8.103   1.642   8.596
  466   1HE2  GLN  56          HE21      GLN  56   8.325  -0.281   9.859
  467   2HE2  GLN  56          HE22      GLN  56   9.763  -0.576  10.841
  468    H    MET  57           H        MET  57   8.169  -0.331   4.346
  469    HA   MET  57           HA       MET  57  10.327   0.108   2.420
  470   1HB   MET  57          HB2       MET  57   7.942  -1.791   2.440
  471   2HB   MET  57          HB3       MET  57   9.218  -1.776   1.209
  472   1HG   MET  57          HG2       MET  57  10.907  -2.111   3.060
  473   2HG   MET  57          HG3       MET  57   9.565  -2.315   4.179
  474   1HE   MET  57          HE1       MET  57  11.013  -5.275   0.947
  475   2HE   MET  57          HE2       MET  57  10.330  -3.711   0.453
  476   3HE   MET  57          HE3       MET  57  11.799  -3.769   1.454
  477    H    LEU  58           H        LEU  58   6.811   0.647   2.420
  478    HA   LEU  58           HA       LEU  58   6.347   1.831  -0.075
  479   1HB   LEU  58          HB2       LEU  58   4.762   0.974   1.443
  480   2HB   LEU  58          HB3       LEU  58   5.302   2.023   2.734
  481    HG   LEU  58           HG       LEU  58   3.091   2.373   1.631
  482   1HD1  LEU  58          HD11      LEU  58   4.050   3.835   3.332
  483   2HD1  LEU  58          HD12      LEU  58   4.921   4.762   2.085
  484   3HD1  LEU  58          HD13      LEU  58   3.149   4.776   2.142
  485   1HD2  LEU  58          HD21      LEU  58   3.833   2.441  -0.724
  486   2HD2  LEU  58          HD22      LEU  58   2.922   3.878  -0.244
  487   3HD2  LEU  58          HD23      LEU  58   4.685   3.978  -0.411
  488    H    ASN  59           H        ASN  59   7.514   3.363   2.991
  489    HA   ASN  59           HA       ASN  59   7.872   5.978   1.771
  490   1HB   ASN  59          HB2       ASN  59   8.409   4.725   4.467
  491   2HB   ASN  59          HB3       ASN  59   9.249   6.208   4.057
  492   1HD2  ASN  59          HD21      ASN  59   6.098   4.844   4.719
  493   2HD2  ASN  59          HD22      ASN  59   5.275   6.405   4.856
  494    H    GLU  60           H        GLU  60   9.965   3.169   1.829
  495    HA   GLU  60           HA       GLU  60  12.452   4.555   1.665
  496   1HB   GLU  60          HB2       GLU  60  13.364   2.550   1.643
  497   2HB   GLU  60          HB3       GLU  60  11.759   1.942   1.950
  498   1HG   GLU  60          HG2       GLU  60  11.484   1.526  -0.519
  499   2HG   GLU  60          HG3       GLU  60  13.137   2.087  -0.763
  500    HA   PRO  61           HA       PRO  61  12.640   6.487  -2.109
  501   1HB   PRO  61          HB2       PRO  61  15.090   5.890  -3.282
  502   2HB   PRO  61          HB3       PRO  61  14.827   7.004  -1.904
  503   1HG   PRO  61          HG2       PRO  61  15.629   4.091  -1.842
  504   2HG   PRO  61          HG3       PRO  61  16.339   5.460  -0.922
  505   1HD   PRO  61          HD2       PRO  61  14.561   3.779   0.188
  506   2HD   PRO  61          HD3       PRO  61  14.471   5.534   0.544
  507    H    VAL  62           H        VAL  62  12.147   6.478  -4.242
  508    HA   VAL  62           HA       VAL  62  11.117   3.999  -5.349
  509    HB   VAL  62           HB       VAL  62  10.057   5.498  -6.956
  510   1HG1  VAL  62          HG11      VAL  62   9.032   5.082  -4.733
  511   2HG1  VAL  62          HG12      VAL  62   9.806   6.554  -4.104
  512   3HG1  VAL  62          HG13      VAL  62   8.598   6.671  -5.392
  513   1HG2  VAL  62          HG21      VAL  62  10.226   7.941  -6.782
  514   2HG2  VAL  62          HG22      VAL  62  11.479   7.807  -5.543
  515   3HG2  VAL  62          HG23      VAL  62  11.795   7.251  -7.202
  516    H    GLN  63           H        GLN  63  14.108   5.329  -5.627
  517    HA   GLN  63           HA       GLN  63  14.614   4.254  -8.363
  518   1HB   GLN  63          HB2       GLN  63  14.326   6.810  -8.139
  519   2HB   GLN  63          HB3       GLN  63  15.861   6.805  -7.277
  520   1HG   GLN  63          HG2       GLN  63  16.956   5.816  -9.310
  521   2HG   GLN  63          HG3       GLN  63  15.389   5.771 -10.116
  522   1HE2  GLN  63          HE21      GLN  63  14.467   7.792 -10.897
  523   2HE2  GLN  63          HE22      GLN  63  15.450   9.250 -10.946
  524    H    GLU  64           H        GLU  64  14.955   2.863  -5.937
  525    HA   GLU  64           HA       GLU  64  16.372   1.661  -4.656
  526   1HB   GLU  64          HB2       GLU  64  17.253   1.255  -7.120
  527   2HB   GLU  64          HB3       GLU  64  18.697   2.074  -6.513
  528   1HG   GLU  64          HG2       GLU  64  18.845   0.357  -4.695
  529   2HG   GLU  64          HG3       GLU  64  17.373  -0.392  -5.295
  530    H    ALA  65           H        ALA  65  19.122   1.886  -3.973
  531    HA   ALA  65           HA       ALA  65  18.919   3.742  -1.869
  532   1HB   ALA  65          HB1       ALA  65  20.235   1.658  -1.829
  533   2HB   ALA  65          HB2       ALA  65  21.376   2.346  -3.007
  534   3HB   ALA  65          HB3       ALA  65  21.232   3.052  -1.386
  535    H    GLY  66           H        GLY  66  19.887   4.483  -5.104
  536   1HA   GLY  66          HA2       GLY  66  19.943   7.226  -4.611
  537   2HA   GLY  66          HA3       GLY  66  21.635   6.722  -4.640
  538    H    GLY  67           H        GLY  67  20.731   8.559  -6.371
  539   1HA   GLY  67          HA2       GLY  67  21.457   7.544  -8.980
  540   2HA   GLY  67          HA3       GLY  67  19.737   7.933  -8.873
  541    H    GLN  68           H        GLN  68  20.488   9.481 -10.611
  542    HA   GLN  68           HA       GLN  68  22.291  11.574 -10.183
  543   1HB   GLN  68          HB2       GLN  68  21.378  12.591 -12.168
  544   2HB   GLN  68          HB3       GLN  68  21.512  10.850 -12.375
  545   1HG   GLN  68          HG2       GLN  68  19.059  10.613 -11.957
  546   2HG   GLN  68          HG3       GLN  68  18.927  12.361 -11.756
  547   1HE2  GLN  68          HE21      GLN  68  18.877   9.797 -14.083
  548   2HE2  GLN  68          HE22      GLN  68  18.890  10.838 -15.501
  549    H    GLY  69           H        GLY  69  19.092  11.444  -8.854
  550   1HA   GLY  69          HA2       GLY  69  18.962  14.377  -8.362
  551   2HA   GLY  69          HA3       GLY  69  17.690  13.194  -8.095
  552    H    GLY  70           H        GLY  70  20.120  11.612  -6.659
  553   1HA   GLY  70          HA2       GLY  70  21.101  12.688  -4.406
  554   2HA   GLY  70          HA3       GLY  70  19.405  12.539  -3.947
  555    H    GLY  71           H        GLY  71  21.096  11.210  -2.385
  556   1HA   GLY  71          HA2       GLY  71  20.210   8.537  -2.370
  557   2HA   GLY  71          HA3       GLY  71  21.788   8.537  -3.159
  558    H    GLY  72           H        GLY  72  21.876   7.054  -1.119
  559   1HA   GLY  72          HA2       GLY  72  23.782   8.243   0.695
  560   2HA   GLY  72          HA3       GLY  72  22.245   7.964   1.513
  Start of MODEL    6
    1   1H    GLY   1           H1       GLY   1  11.486 -22.157   0.896
    2   2H    GLY   1           H2       GLY   1  11.784 -21.227   2.217
    3   3H    GLY   1           H3       GLY   1  12.684 -21.035   0.859
    4   1HA   GLY   1          HA2       GLY   1  10.770 -20.254  -0.380
    5   2HA   GLY   1          HA3       GLY   1   9.804 -20.445   1.094
    6    H    SER   2           H        SER   2   9.316 -18.408   1.743
    7    HA   SER   2           HA       SER   2  11.034 -16.101   1.504
    8   1HB   SER   2          HB2       SER   2   9.306 -15.036   2.947
    9   2HB   SER   2          HB3       SER   2   8.645 -15.843   1.522
   10    HG   SER   2           HG       SER   2   7.476 -16.326   3.445
   11    H    HIS   3           H        HIS   3  11.633 -14.765   3.343
   12    HA   HIS   3           HA       HIS   3  12.578 -16.196   5.791
   13   1HB   HIS   3          HB2       HIS   3  14.356 -16.138   4.065
   14   2HB   HIS   3          HB3       HIS   3  14.189 -14.391   3.943
   15    HD1  HIS   3           HD1      HIS   3  15.369 -17.039   6.518
   16    HD2  HIS   3           HD2      HIS   3  15.600 -12.938   5.627
   17    HE1  HIS   3           HE1      HIS   3  17.080 -16.055   8.124
   18    H    MET   4           H        MET   4  11.280 -13.303   4.343
   19    HA   MET   4           HA       MET   4  10.975 -11.965   6.960
   20   1HB   MET   4          HB2       MET   4  11.866  -9.823   5.852
   21   2HB   MET   4          HB3       MET   4  13.048 -11.043   6.308
   22   1HG   MET   4          HG2       MET   4  13.256 -11.792   4.004
   23   2HG   MET   4          HG3       MET   4  11.954 -10.700   3.501
   24   1HE   MET   4          HE1       MET   4  14.887 -11.025   2.198
   25   2HE   MET   4          HE2       MET   4  13.632  -9.956   1.533
   26   3HE   MET   4          HE3       MET   4  15.269  -9.331   1.834
   27    HA   PRO   5           HA       PRO   5   7.052 -11.007   5.316
   28   1HB   PRO   5          HB2       PRO   5   6.350  -8.528   6.247
   29   2HB   PRO   5          HB3       PRO   5   6.534  -9.963   7.300
   30   1HG   PRO   5          HG2       PRO   5   8.576  -7.803   6.728
   31   2HG   PRO   5          HG3       PRO   5   8.046  -8.417   8.330
   32   1HD   PRO   5          HD2       PRO   5  10.296  -9.353   7.179
   33   2HD   PRO   5          HD3       PRO   5   9.190 -10.477   8.022
   34    H    LEU   6           H        LEU   6   5.812  -9.860   3.766
   35    HA   LEU   6           HA       LEU   6   5.395  -8.810   1.806
   36   1HB   LEU   6          HB2       LEU   6   7.151  -6.687   3.068
   37   2HB   LEU   6          HB3       LEU   6   5.992  -6.411   1.770
   38    HG   LEU   6           HG       LEU   6   5.254  -7.369   4.575
   39   1HD1  LEU   6          HD11      LEU   6   6.147  -5.097   4.574
   40   2HD1  LEU   6          HD12      LEU   6   5.007  -4.627   3.292
   41   3HD1  LEU   6          HD13      LEU   6   4.407  -5.102   4.902
   42   1HD2  LEU   6          HD21      LEU   6   2.950  -6.769   3.893
   43   2HD2  LEU   6          HD22      LEU   6   3.523  -6.453   2.239
   44   3HD2  LEU   6          HD23      LEU   6   3.589  -8.095   2.921
   45    H    GLU   7           H        GLU   7   8.035 -10.443   1.782
   46    HA   GLU   7           HA       GLU   7   9.583  -9.443  -0.427
   47   1HB   GLU   7          HB2       GLU   7   8.891 -12.275   0.444
   48   2HB   GLU   7          HB3       GLU   7   9.992 -11.894  -0.887
   49   1HG   GLU   7          HG2       GLU   7  11.425 -10.590   0.662
   50   2HG   GLU   7          HG3       GLU   7  10.353 -10.998   1.995
   51    H    PHE   8           H        PHE   8   6.368 -10.819  -0.286
   52    HA   PHE   8           HA       PHE   8   5.894 -11.409  -3.011
   53   1HB   PHE   8          HB2       PHE   8   3.936 -10.373  -0.938
   54   2HB   PHE   8          HB3       PHE   8   3.546 -11.298  -2.388
   55    HD1  PHE   8           HD1      PHE   8   4.097 -11.531   1.104
   56    HD2  PHE   8           HD2      PHE   8   4.788 -13.667  -2.579
   57    HE1  PHE   8           HE1      PHE   8   4.379 -13.640   2.377
   58    HE2  PHE   8           HE2      PHE   8   5.063 -15.776  -1.298
   59    HZ   PHE   8           HZ       PHE   8   4.865 -15.765   1.180
   60    H    LEU   9           H        LEU   9   5.929  -8.258  -1.382
   61    HA   LEU   9           HA       LEU   9   4.851  -6.798  -3.724
   62   1HB   LEU   9          HB2       LEU   9   6.102  -6.001  -1.059
   63   2HB   LEU   9          HB3       LEU   9   5.833  -4.829  -2.329
   64    HG   LEU   9           HG       LEU   9   3.595  -6.467  -1.085
   65   1HD1  LEU   9          HD11      LEU   9   4.665  -4.974   0.562
   66   2HD1  LEU   9          HD12      LEU   9   4.552  -3.615  -0.573
   67   3HD1  LEU   9          HD13      LEU   9   3.077  -4.338   0.104
   68   1HD2  LEU   9          HD21      LEU   9   2.148  -4.736  -2.119
   69   2HD2  LEU   9          HD22      LEU   9   3.568  -3.961  -2.846
   70   3HD2  LEU   9          HD23      LEU   9   3.069  -5.581  -3.369
   71    H    ARG  10           H        ARG  10   7.968  -7.288  -2.113
   72    HA   ARG  10           HA       ARG  10   9.470  -5.471  -3.693
   73   1HB   ARG  10          HB2       ARG  10  10.294  -7.637  -1.717
   74   2HB   ARG  10          HB3       ARG  10  11.408  -6.445  -2.398
   75   1HG   ARG  10          HG2       ARG  10  10.002  -4.605  -1.544
   76   2HG   ARG  10          HG3       ARG  10   8.944  -5.761  -0.727
   77   1HD   ARG  10          HD2       ARG  10  11.940  -5.562  -0.257
   78   2HD   ARG  10          HD3       ARG  10  10.750  -4.634   0.666
   79    HE   ARG  10           HE       ARG  10   9.752  -7.047   1.119
   80   1HH1  ARG  10          HH22      ARG  10  13.138  -6.124   1.208
   81   2HH1  ARG  10          HH21      ARG  10  13.493  -7.195   2.543
   82   1HH2  ARG  10          HH12      ARG  10  10.276  -8.313   2.922
   83   2HH2  ARG  10          HH11      ARG  10  11.942  -8.416   3.422
   84    H    ASN  11           H        ASN  11   8.265  -7.517  -5.352
   85    HA   ASN  11           HA       ASN  11  10.617  -8.071  -7.078
   86   1HB   ASN  11          HB2       ASN  11   9.907 -10.341  -7.520
   87   2HB   ASN  11          HB3       ASN  11  10.072 -10.157  -5.771
   88   1HD2  ASN  11          HD21      ASN  11   8.144 -10.366  -4.458
   89   2HD2  ASN  11          HD22      ASN  11   6.586 -10.710  -5.197
   90    H    GLN  12           H        GLN  12   7.422  -6.831  -6.810
   91    HA   GLN  12           HA       GLN  12   6.427  -7.753  -9.353
   92   1HB   GLN  12          HB2       GLN  12   5.411  -5.747  -7.310
   93   2HB   GLN  12          HB3       GLN  12   4.517  -6.160  -8.770
   94   1HG   GLN  12          HG2       GLN  12   5.381  -8.229  -6.696
   95   2HG   GLN  12          HG3       GLN  12   3.816  -7.416  -6.699
   96   1HE2  GLN  12          HE21      GLN  12   5.638 -10.052  -8.125
   97   2HE2  GLN  12          HE22      GLN  12   4.360 -10.545  -9.227
   98    HA   PRO  13           HA       PRO  13   7.952  -4.701 -12.187
   99   1HB   PRO  13          HB2       PRO  13   5.133  -4.714 -13.285
  100   2HB   PRO  13          HB3       PRO  13   6.686  -4.787 -14.174
  101   1HG   PRO  13          HG2       PRO  13   5.281  -7.046 -13.751
  102   2HG   PRO  13          HG3       PRO  13   7.056  -7.046 -13.482
  103   1HD   PRO  13          HD2       PRO  13   4.842  -6.814 -11.442
  104   2HD   PRO  13          HD3       PRO  13   6.337  -7.805 -11.399
  105    H    GLN  14           H        GLN  14   4.953  -3.879 -10.485
  106    HA   GLN  14           HA       GLN  14   5.523  -0.963 -10.856
  107   1HB   GLN  14          HB2       GLN  14   2.836  -2.344 -10.548
  108   2HB   GLN  14          HB3       GLN  14   3.106  -0.600 -10.639
  109   1HG   GLN  14          HG2       GLN  14   4.277  -1.019 -12.887
  110   2HG   GLN  14          HG3       GLN  14   3.608  -2.650 -12.825
  111   1HE2  GLN  14          HE21      GLN  14   2.925   0.699 -13.499
  112   2HE2  GLN  14          HE22      GLN  14   1.224   0.473 -13.894
  113    H    PHE  15           H        PHE  15   6.109  -3.110  -8.549
  114    HA   PHE  15           HA       PHE  15   5.282  -1.676  -6.136
  115   1HB   PHE  15          HB2       PHE  15   6.038  -3.923  -5.899
  116   2HB   PHE  15          HB3       PHE  15   7.508  -3.620  -6.829
  117    HD1  PHE  15           HD1      PHE  15   5.800  -2.788  -3.604
  118    HD2  PHE  15           HD2      PHE  15   9.519  -2.921  -5.777
  119    HE1  PHE  15           HE1      PHE  15   7.049  -2.328  -1.504
  120    HE2  PHE  15           HE2      PHE  15  10.757  -2.404  -3.689
  121    HZ   PHE  15           HZ       PHE  15   9.523  -2.101  -1.553
  122    H    GLN  16           H        GLN  16   7.829  -1.356  -8.556
  123    HA   GLN  16           HA       GLN  16   9.234   0.838  -7.295
  124   1HB   GLN  16          HB2       GLN  16   9.050  -0.253 -10.125
  125   2HB   GLN  16          HB3       GLN  16  10.105   1.095  -9.704
  126   1HG   GLN  16          HG2       GLN  16  10.279  -1.704  -8.494
  127   2HG   GLN  16          HG3       GLN  16  11.278  -1.092  -9.802
  128   1HE2  GLN  16          HE21      GLN  16  12.855  -1.960  -7.960
  129   2HE2  GLN  16          HE22      GLN  16  13.425  -0.692  -6.881
  130    H    GLN  17           H        GLN  17   6.073   0.845  -8.506
  131    HA   GLN  17           HA       GLN  17   6.258   3.728  -9.309
  132   1HB   GLN  17          HB2       GLN  17   4.434   1.567 -10.418
  133   2HB   GLN  17          HB3       GLN  17   4.338   3.298 -10.776
  134   1HG   GLN  17          HG2       GLN  17   6.811   3.122 -11.502
  135   2HG   GLN  17          HG3       GLN  17   6.595   1.373 -11.480
  136   1HE2  GLN  17          HE21      GLN  17   6.792   3.782 -13.608
  137   2HE2  GLN  17          HE22      GLN  17   5.616   3.250 -14.809
  138    H    MET  18           H        MET  18   3.940   1.352  -7.766
  139    HA   MET  18           HA       MET  18   2.034   3.297  -7.057
  140   1HB   MET  18          HB2       MET  18   1.217   1.654  -5.497
  141   2HB   MET  18          HB3       MET  18   1.649   0.912  -7.035
  142   1HG   MET  18          HG2       MET  18   3.809   0.121  -6.017
  143   2HG   MET  18          HG3       MET  18   3.331   0.853  -4.486
  144   1HE   MET  18          HE1       MET  18   2.853  -2.102  -6.988
  145   2HE   MET  18          HE2       MET  18   1.448  -2.960  -6.322
  146   3HE   MET  18          HE3       MET  18   1.232  -1.378  -7.096
  147    H    ARG  19           H        ARG  19   5.045   2.522  -5.413
  148    HA   ARG  19           HA       ARG  19   4.540   4.103  -3.019
  149   1HB   ARG  19          HB2       ARG  19   7.182   3.198  -4.250
  150   2HB   ARG  19          HB3       ARG  19   6.898   3.693  -2.572
  151   1HG   ARG  19          HG2       ARG  19   5.217   1.765  -2.442
  152   2HG   ARG  19          HG3       ARG  19   5.812   1.204  -3.985
  153   1HD   ARG  19          HD2       ARG  19   7.657   1.654  -1.617
  154   2HD   ARG  19          HD3       ARG  19   6.919   0.092  -2.010
  155    HE   ARG  19           HE       ARG  19   8.038   0.292  -4.259
  156   1HH1  ARG  19          HH22      ARG  19   9.640   1.799  -1.488
  157   2HH1  ARG  19          HH21      ARG  19  11.048   2.169  -2.464
  158   1HH2  ARG  19          HH12      ARG  19  10.064   0.464  -5.221
  159   2HH2  ARG  19          HH11      ARG  19  11.323   1.327  -4.355
  160    H    GLN  20           H        GLN  20   5.815   4.875  -6.183
  161    HA   GLN  20           HA       GLN  20   6.948   7.482  -5.583
  162   1HB   GLN  20          HB2       GLN  20   5.519   6.662  -8.152
  163   2HB   GLN  20          HB3       GLN  20   6.521   8.073  -7.912
  164   1HG   GLN  20          HG2       GLN  20   8.524   6.692  -7.624
  165   2HG   GLN  20          HG3       GLN  20   7.551   5.220  -7.766
  166   1HE2  GLN  20          HE21      GLN  20   8.487   4.419  -9.701
  167   2HE2  GLN  20          HE22      GLN  20   8.305   5.248 -11.239
  168    H    ILE  21           H        ILE  21   3.661   6.334  -6.241
  169    HA   ILE  21           HA       ILE  21   2.371   8.856  -6.444
  170    HB   ILE  21           HB       ILE  21   1.089   6.278  -5.428
  171   1HG1  ILE  21          HG12      ILE  21   1.806   7.064  -8.267
  172   2HG1  ILE  21          HG13      ILE  21   2.386   5.665  -7.366
  173   1HG2  ILE  21          HG21      ILE  21  -0.265   8.374  -5.334
  174   2HG2  ILE  21          HG22      ILE  21  -0.007   8.592  -7.079
  175   3HG2  ILE  21          HG23      ILE  21  -0.925   7.198  -6.465
  176   1HD1  ILE  21          HD11      ILE  21   0.834   4.850  -8.925
  177   2HD1  ILE  21          HD12      ILE  21   0.111   4.699  -7.317
  178   3HD1  ILE  21          HD13      ILE  21  -0.421   6.001  -8.419
  179    H    ILE  22           H        ILE  22   2.957   6.674  -3.721
  180    HA   ILE  22           HA       ILE  22   1.515   8.271  -1.765
  181    HB   ILE  22           HB       ILE  22   3.527   6.057  -1.249
  182   1HG1  ILE  22          HG12      ILE  22   1.977   4.926  -2.582
  183   2HG1  ILE  22          HG13      ILE  22   1.418   4.614  -0.958
  184   1HG2  ILE  22          HG21      ILE  22   1.239   7.141   0.450
  185   2HG2  ILE  22          HG22      ILE  22   2.239   5.737   0.852
  186   3HG2  ILE  22          HG23      ILE  22   2.981   7.332   0.772
  187   1HD1  ILE  22          HD11      ILE  22  -0.534   5.070  -2.204
  188   2HD1  ILE  22          HD12      ILE  22  -0.229   6.578  -1.305
  189   3HD1  ILE  22          HD13      ILE  22   0.180   6.463  -3.027
  190    H    GLN  23           H        GLN  23   4.930   8.002  -2.669
  191    HA   GLN  23           HA       GLN  23   6.020   9.723  -0.669
  192   1HB   GLN  23          HB2       GLN  23   6.887   8.747  -3.398
  193   2HB   GLN  23          HB3       GLN  23   7.870   9.918  -2.503
  194   1HG   GLN  23          HG2       GLN  23   7.966   8.366  -0.560
  195   2HG   GLN  23          HG3       GLN  23   7.035   7.174  -1.470
  196   1HE2  GLN  23          HE21      GLN  23   8.752   5.618  -1.334
  197   2HE2  GLN  23          HE22      GLN  23  10.267   5.824  -2.183
  198    H    GLN  24           H        GLN  24   3.834  10.646  -3.024
  199    HA   GLN  24           HA       GLN  24   4.675  13.533  -2.858
  200   1HB   GLN  24          HB2       GLN  24   3.241  12.165  -5.171
  201   2HB   GLN  24          HB3       GLN  24   3.715  13.868  -5.081
  202   1HG   GLN  24          HG2       GLN  24   6.088  13.209  -5.066
  203   2HG   GLN  24          HG3       GLN  24   5.606  11.500  -5.039
  204   1HE2  GLN  24          HE21      GLN  24   5.069  10.476  -6.955
  205   2HE2  GLN  24          HE22      GLN  24   5.097  11.280  -8.529
  206    H    ASN  25           H        ASN  25   2.051  11.216  -3.098
  207    HA   ASN  25           HA       ASN  25   0.236  13.035  -1.574
  208   1HB   ASN  25          HB2       ASN  25  -0.271  11.541  -4.126
  209   2HB   ASN  25          HB3       ASN  25  -1.574  11.635  -2.935
  210   1HD2  ASN  25          HD21      ASN  25  -2.094  13.793  -2.022
  211   2HD2  ASN  25          HD22      ASN  25  -2.039  15.143  -3.156
  212    HA   PRO  26           HA       PRO  26   0.724   9.180   0.915
  213   1HB   PRO  26          HB2       PRO  26   0.709  10.402   3.371
  214   2HB   PRO  26          HB3       PRO  26   2.181  10.202   2.368
  215   1HG   PRO  26          HG2       PRO  26   0.372  12.626   2.542
  216   2HG   PRO  26          HG3       PRO  26   2.163  12.570   2.687
  217   1HD   PRO  26          HD2       PRO  26   0.933  13.219   0.385
  218   2HD   PRO  26          HD3       PRO  26   2.402  12.191   0.354
  219    H    SER  27           H        SER  27  -1.552  11.839   0.800
  220    HA   SER  27           HA       SER  27  -3.770  10.770   2.215
  221   1HB   SER  27          HB2       SER  27  -5.081  12.214   0.638
  222   2HB   SER  27          HB3       SER  27  -3.776  13.043   1.495
  223    HG   SER  27           HG       SER  27  -3.950  13.447  -0.817
  224    H    LEU  28           H        LEU  28  -2.311   9.617  -0.735
  225    HA   LEU  28           HA       LEU  28  -4.710   7.985  -1.395
  226   1HB   LEU  28          HB2       LEU  28  -2.176   8.523  -2.981
  227   2HB   LEU  28          HB3       LEU  28  -3.531   7.525  -3.510
  228    HG   LEU  28           HG       LEU  28  -3.581  10.531  -3.045
  229   1HD1  LEU  28          HD11      LEU  28  -4.023  10.573  -5.468
  230   2HD1  LEU  28          HD12      LEU  28  -2.502   9.728  -5.130
  231   3HD1  LEU  28          HD13      LEU  28  -3.967   8.795  -5.517
  232   1HD2  LEU  28          HD21      LEU  28  -5.775   9.673  -2.382
  233   2HD2  LEU  28          HD22      LEU  28  -5.891  10.448  -3.961
  234   3HD2  LEU  28          HD23      LEU  28  -5.860   8.673  -3.855
  235    H    LEU  29           H        LEU  29  -2.198   7.535   0.683
  236    HA   LEU  29           HA       LEU  29  -1.428   4.837   0.157
  237   1HB   LEU  29          HB2       LEU  29  -0.330   6.189   1.814
  238   2HB   LEU  29          HB3       LEU  29  -1.772   6.390   2.756
  239    HG   LEU  29           HG       LEU  29  -1.812   4.026   3.375
  240   1HD1  LEU  29          HD11      LEU  29   0.660   3.800   1.615
  241   2HD1  LEU  29          HD12      LEU  29   0.149   2.569   2.800
  242   3HD1  LEU  29          HD13      LEU  29  -0.876   2.931   1.409
  243   1HD2  LEU  29          HD21      LEU  29   0.228   3.978   4.738
  244   2HD2  LEU  29          HD22      LEU  29   0.959   5.242   3.725
  245   3HD2  LEU  29          HD23      LEU  29  -0.468   5.607   4.720
  246    HA   PRO  30           HA       PRO  30  -5.649   3.582   2.435
  247   1HB   PRO  30          HB2       PRO  30  -7.213   5.961   1.421
  248   2HB   PRO  30          HB3       PRO  30  -7.434   5.040   2.920
  249   1HG   PRO  30          HG2       PRO  30  -6.217   7.525   2.632
  250   2HG   PRO  30          HG3       PRO  30  -5.914   6.415   4.019
  251   1HD   PRO  30          HD2       PRO  30  -4.122   7.174   1.837
  252   2HD   PRO  30          HD3       PRO  30  -3.757   6.235   3.303
  253    H    ALA  31           H        ALA  31  -5.677   5.630  -0.423
  254    HA   ALA  31           HA       ALA  31  -7.500   4.046  -1.960
  255   1HB   ALA  31          HB1       ALA  31  -7.073   6.510  -2.097
  256   2HB   ALA  31          HB2       ALA  31  -5.528   6.165  -2.900
  257   3HB   ALA  31          HB3       ALA  31  -7.050   5.675  -3.671
  258    H    LEU  32           H        LEU  32  -4.142   3.453  -1.313
  259    HA   LEU  32           HA       LEU  32  -3.808   1.789  -3.768
  260   1HB   LEU  32          HB2       LEU  32  -1.996   3.322  -3.174
  261   2HB   LEU  32          HB3       LEU  32  -1.947   2.634  -1.539
  262    HG   LEU  32           HG       LEU  32  -1.085   0.541  -2.357
  263   1HD1  LEU  32          HD11      LEU  32  -1.303   1.729  -5.156
  264   2HD1  LEU  32          HD12      LEU  32  -0.485   0.200  -4.736
  265   3HD1  LEU  32          HD13      LEU  32  -2.227   0.345  -4.525
  266   1HD2  LEU  32          HD21      LEU  32   0.470   2.425  -1.929
  267   2HD2  LEU  32          HD22      LEU  32   1.112   1.329  -3.169
  268   3HD2  LEU  32          HD23      LEU  32   0.396   2.877  -3.644
  269    H    LEU  33           H        LEU  33  -3.886   1.611  -0.191
  270    HA   LEU  33           HA       LEU  33  -3.807  -1.232   0.092
  271   1HB   LEU  33          HB2       LEU  33  -5.224   0.947   1.670
  272   2HB   LEU  33          HB3       LEU  33  -5.066  -0.729   2.208
  273    HG   LEU  33           HG       LEU  33  -2.545   0.796   1.501
  274   1HD1  LEU  33          HD11      LEU  33  -4.058   1.041   4.124
  275   2HD1  LEU  33          HD12      LEU  33  -2.402   1.626   3.800
  276   3HD1  LEU  33          HD13      LEU  33  -3.770   2.327   2.923
  277   1HD2  LEU  33          HD21      LEU  33  -3.215  -1.317   3.593
  278   2HD2  LEU  33          HD22      LEU  33  -2.425  -1.614   2.030
  279   3HD2  LEU  33          HD23      LEU  33  -1.610  -0.636   3.267
  280    H    GLN  34           H        GLN  34  -6.634   0.975  -0.359
  281    HA   GLN  34           HA       GLN  34  -8.539  -1.171  -0.649
  282   1HB   GLN  34          HB2       GLN  34  -8.601   1.771  -1.392
  283   2HB   GLN  34          HB3       GLN  34  -9.972   0.689  -1.646
  284   1HG   GLN  34          HG2       GLN  34 -10.166   0.188   0.707
  285   2HG   GLN  34          HG3       GLN  34  -8.673   1.047   1.086
  286   1HE2  GLN  34          HE21      GLN  34  -8.625   3.399   0.646
  287   2HE2  GLN  34          HE22      GLN  34 -10.129   4.317   0.844
  288    H    GLN  35           H        GLN  35  -6.138   0.001  -2.899
  289    HA   GLN  35           HA       GLN  35  -7.612  -1.087  -5.226
  290   1HB   GLN  35          HB2       GLN  35  -6.278   0.756  -5.842
  291   2HB   GLN  35          HB3       GLN  35  -4.898   0.234  -4.864
  292   1HG   GLN  35          HG2       GLN  35  -4.427  -1.606  -6.310
  293   2HG   GLN  35          HG3       GLN  35  -5.888  -1.318  -7.278
  294   1HE2  GLN  35          HE21      GLN  35  -3.584  -1.629  -8.559
  295   2HE2  GLN  35          HE22      GLN  35  -2.978  -0.091  -9.192
  296    H    ILE  36           H        ILE  36  -4.794  -1.975  -3.186
  297    HA   ILE  36           HA       ILE  36  -4.278  -4.486  -4.395
  298    HB   ILE  36           HB       ILE  36  -3.873  -3.612  -1.541
  299   1HG1  ILE  36          HG12      ILE  36  -1.709  -3.807  -3.670
  300   2HG1  ILE  36          HG13      ILE  36  -2.703  -2.361  -3.595
  301   1HG2  ILE  36          HG21      ILE  36  -2.129  -5.457  -1.508
  302   2HG2  ILE  36          HG22      ILE  36  -3.752  -6.103  -1.731
  303   3HG2  ILE  36          HG23      ILE  36  -2.674  -5.968  -3.118
  304   1HD1  ILE  36          HD11      ILE  36  -0.715  -1.977  -2.307
  305   2HD1  ILE  36          HD12      ILE  36  -2.100  -2.063  -1.194
  306   3HD1  ILE  36          HD13      ILE  36  -0.988  -3.446  -1.348
  307    H    GLY  37           H        GLY  37  -6.645  -3.605  -1.821
  308   1HA   GLY  37          HA2       GLY  37  -7.706  -6.199  -1.380
  309   2HA   GLY  37          HA3       GLY  37  -8.531  -4.665  -1.086
  310    H    ARG  38           H        ARG  38  -7.903  -4.506  -4.309
  311    HA   ARG  38           HA       ARG  38 -10.280  -6.068  -5.234
  312   1HB   ARG  38          HB2       ARG  38  -9.213  -3.381  -6.146
  313   2HB   ARG  38          HB3       ARG  38 -10.545  -4.248  -6.907
  314   1HG   ARG  38          HG2       ARG  38 -10.558  -3.357  -3.995
  315   2HG   ARG  38          HG3       ARG  38 -11.210  -2.441  -5.349
  316   1HD   ARG  38          HD2       ARG  38 -12.145  -5.209  -4.462
  317   2HD   ARG  38          HD3       ARG  38 -12.942  -3.690  -4.096
  318    HE   ARG  38           HE       ARG  38 -12.981  -5.152  -6.641
  319   1HH1  ARG  38          HH22      ARG  38 -13.694  -2.041  -5.175
  320   2HH1  ARG  38          HH21      ARG  38 -14.764  -1.577  -6.480
  321   1HH2  ARG  38          HH12      ARG  38 -14.339  -4.492  -8.261
  322   2HH2  ARG  38          HH11      ARG  38 -15.112  -2.931  -8.174
  323    H    GLU  39           H        GLU  39  -6.976  -6.184  -5.395
  324    HA   GLU  39           HA       GLU  39  -7.117  -7.725  -7.949
  325   1HB   GLU  39          HB2       GLU  39  -5.158  -6.810  -8.866
  326   2HB   GLU  39          HB3       GLU  39  -6.259  -5.481  -8.465
  327   1HG   GLU  39          HG2       GLU  39  -4.944  -4.946  -6.484
  328   2HG   GLU  39          HG3       GLU  39  -3.870  -6.319  -6.788
  329    H    ASN  40           H        ASN  40  -5.589  -7.335  -4.830
  330    HA   ASN  40           HA       ASN  40  -5.181 -10.219  -4.780
  331   1HB   ASN  40          HB2       ASN  40  -2.951  -9.158  -5.542
  332   2HB   ASN  40          HB3       ASN  40  -2.831  -8.485  -3.931
  333   1HD2  ASN  40          HD21      ASN  40  -1.127 -10.526  -5.279
  334   2HD2  ASN  40          HD22      ASN  40  -1.234 -11.957  -4.255
  335    HA   PRO  41           HA       PRO  41  -7.284  -8.408  -0.996
  336   1HB   PRO  41          HB2       PRO  41  -8.383 -11.206  -1.276
  337   2HB   PRO  41          HB3       PRO  41  -9.194  -9.728  -0.664
  338   1HG   PRO  41          HG2       PRO  41  -9.654 -10.513  -3.179
  339   2HG   PRO  41          HG3       PRO  41  -9.286  -8.782  -2.868
  340   1HD   PRO  41          HD2       PRO  41  -7.421 -10.961  -3.818
  341   2HD   PRO  41          HD3       PRO  41  -7.635  -9.303  -4.478
  342    H    GLN  42           H        GLN  42  -5.566 -11.475  -1.563
  343    HA   GLN  42           HA       GLN  42  -5.124 -12.152   1.216
  344   1HB   GLN  42          HB2       GLN  42  -3.478 -13.002  -1.195
  345   2HB   GLN  42          HB3       GLN  42  -3.610 -13.820   0.367
  346   1HG   GLN  42          HG2       GLN  42  -6.073 -14.152  -0.099
  347   2HG   GLN  42          HG3       GLN  42  -5.805 -13.490  -1.716
  348   1HE2  GLN  42          HE21      GLN  42  -4.303 -14.709  -3.193
  349   2HE2  GLN  42          HE22      GLN  42  -4.126 -16.440  -2.936
  350    H    LEU  43           H        LEU  43  -3.068 -10.582  -1.299
  351    HA   LEU  43           HA       LEU  43  -0.871 -10.003   0.425
  352   1HB   LEU  43          HB2       LEU  43  -0.949  -9.874  -2.128
  353   2HB   LEU  43          HB3       LEU  43  -1.843  -8.363  -1.947
  354    HG   LEU  43           HG       LEU  43   0.016  -7.251  -0.953
  355   1HD1  LEU  43          HD11      LEU  43   1.438  -9.947  -0.944
  356   2HD1  LEU  43          HD12      LEU  43   2.251  -8.384  -0.683
  357   3HD1  LEU  43          HD13      LEU  43   1.035  -8.938   0.465
  358   1HD2  LEU  43          HD21      LEU  43   1.664  -7.403  -2.781
  359   2HD2  LEU  43          HD22      LEU  43   0.960  -8.947  -3.302
  360   3HD2  LEU  43          HD23      LEU  43   0.007  -7.448  -3.406
  361    H    LEU  44           H        LEU  44  -3.962  -8.418  -0.091
  362    HA   LEU  44           HA       LEU  44  -3.270  -5.927   1.194
  363   1HB   LEU  44          HB2       LEU  44  -5.301  -6.440  -0.289
  364   2HB   LEU  44          HB3       LEU  44  -6.051  -7.190   1.080
  365    HG   LEU  44           HG       LEU  44  -6.442  -4.656   0.370
  366   1HD1  LEU  44          HD11      LEU  44  -7.379  -4.190   2.512
  367   2HD1  LEU  44          HD12      LEU  44  -7.725  -5.845   2.011
  368   3HD1  LEU  44          HD13      LEU  44  -6.474  -5.541   3.255
  369   1HD2  LEU  44          HD21      LEU  44  -4.361  -4.267   2.563
  370   2HD2  LEU  44          HD22      LEU  44  -4.147  -3.836   0.843
  371   3HD2  LEU  44          HD23      LEU  44  -5.389  -3.038   1.821
  372    H    GLN  45           H        GLN  45  -5.167  -8.655   2.384
  373    HA   GLN  45           HA       GLN  45  -5.137  -8.073   5.156
  374   1HB   GLN  45          HB2       GLN  45  -5.124 -10.769   3.746
  375   2HB   GLN  45          HB3       GLN  45  -5.366 -10.579   5.479
  376   1HG   GLN  45          HG2       GLN  45  -7.148  -9.386   3.313
  377   2HG   GLN  45          HG3       GLN  45  -7.509 -10.820   4.273
  378   1HE2  GLN  45          HE21      GLN  45  -8.753  -7.944   4.012
  379   2HE2  GLN  45          HE22      GLN  45  -8.956  -7.495   5.701
  380    H    GLN  46           H        GLN  46  -2.502  -9.598   3.267
  381    HA   GLN  46           HA       GLN  46  -0.804 -10.150   5.548
  382   1HB   GLN  46          HB2       GLN  46  -0.330  -9.801   2.572
  383   2HB   GLN  46          HB3       GLN  46   0.993 -10.049   3.707
  384   1HG   GLN  46          HG2       GLN  46   0.108 -12.202   4.402
  385   2HG   GLN  46          HG3       GLN  46  -1.386 -11.951   3.514
  386   1HE2  GLN  46          HE21      GLN  46  -0.754 -14.142   2.583
  387   2HE2  GLN  46          HE22      GLN  46   0.322 -14.112   1.184
  388    H    ILE  47           H        ILE  47  -0.962  -7.347   3.281
  389    HA   ILE  47           HA       ILE  47   1.046  -5.764   4.547
  390    HB   ILE  47           HB       ILE  47  -1.334  -5.123   2.807
  391   1HG1  ILE  47          HG12      ILE  47   1.668  -4.835   2.331
  392   2HG1  ILE  47          HG13      ILE  47   0.799  -6.330   1.981
  393   1HG2  ILE  47          HG21      ILE  47   0.692  -3.176   3.988
  394   2HG2  ILE  47          HG22      ILE  47  -0.358  -2.805   2.602
  395   3HG2  ILE  47          HG23      ILE  47  -1.075  -3.127   4.176
  396   1HD1  ILE  47          HD11      ILE  47   0.380  -3.640   0.664
  397   2HD1  ILE  47          HD12      ILE  47   0.927  -5.163  -0.065
  398   3HD1  ILE  47          HD13      ILE  47  -0.751  -5.013   0.493
  399    H    SER  48           H        SER  48  -2.442  -6.132   5.308
  400    HA   SER  48           HA       SER  48  -2.501  -4.128   7.357
  401   1HB   SER  48          HB2       SER  48  -4.177  -6.652   7.083
  402   2HB   SER  48          HB3       SER  48  -4.493  -5.332   8.219
  403    HG   SER  48           HG       SER  48  -5.688  -5.065   6.307
  404    H    GLN  49           H        GLN  49  -1.501  -7.598   7.533
  405    HA   GLN  49           HA       GLN  49  -1.093  -7.643  10.372
  406   1HB   GLN  49          HB2       GLN  49  -1.849  -9.511   9.084
  407   2HB   GLN  49          HB3       GLN  49  -0.526  -9.346   7.930
  408   1HG   GLN  49          HG2       GLN  49  -0.154 -11.210   9.235
  409   2HG   GLN  49          HG3       GLN  49   1.079  -9.998   9.603
  410   1HE2  GLN  49          HE21      GLN  49   0.929  -8.924  11.762
  411   2HE2  GLN  49          HE22      GLN  49   0.031  -9.705  13.068
  412    H    HIS  50           H        HIS  50   0.747  -6.325   7.748
  413    HA   HIS  50           HA       HIS  50   3.250  -6.236   9.383
  414   1HB   HIS  50          HB2       HIS  50   2.987  -6.714   6.392
  415   2HB   HIS  50          HB3       HIS  50   4.504  -6.587   7.285
  416    HD1  HIS  50           HD1      HIS  50   4.030  -8.625   9.641
  417    HD2  HIS  50           HD2      HIS  50   2.940  -9.186   5.622
  418    HE1  HIS  50           HE1      HIS  50   3.953 -11.138   9.266
  419    H    GLN  51           H        GLN  51   1.068  -4.177   8.963
  420    HA   GLN  51           HA       GLN  51   1.632  -2.469   6.908
  421   1HB   GLN  51          HB2       GLN  51  -0.388  -2.655   8.534
  422   2HB   GLN  51          HB3       GLN  51   0.464  -1.434   9.500
  423   1HG   GLN  51          HG2       GLN  51   0.503   0.052   7.471
  424   2HG   GLN  51          HG3       GLN  51  -0.336  -1.213   6.565
  425   1HE2  GLN  51          HE21      GLN  51  -1.768   0.864   6.273
  426   2HE2  GLN  51          HE22      GLN  51  -3.072   1.009   7.451
  427    H    GLU  52           H        GLU  52   3.192  -2.332  10.094
  428    HA   GLU  52           HA       GLU  52   4.504   0.219   9.711
  429   1HB   GLU  52          HB2       GLU  52   5.235  -2.173  11.447
  430   2HB   GLU  52          HB3       GLU  52   6.033  -0.597  11.507
  431   1HG   GLU  52          HG2       GLU  52   3.850   0.475  12.064
  432   2HG   GLU  52          HG3       GLU  52   3.089  -1.112  12.099
  433    H    HIS  53           H        HIS  53   5.320  -3.059   8.603
  434    HA   HIS  53           HA       HIS  53   7.999  -2.292   7.662
  435   1HB   HIS  53          HB2       HIS  53   6.287  -4.744   7.082
  436   2HB   HIS  53          HB3       HIS  53   7.938  -4.494   6.535
  437    HD1  HIS  53           HD1      HIS  53   6.102  -5.899   9.445
  438    HD2  HIS  53           HD2      HIS  53   9.840  -4.162   8.623
  439    HE1  HIS  53           HE1      HIS  53   7.627  -6.536  11.381
  440    H    PHE  54           H        PHE  54   4.722  -2.700   6.231
  441    HA   PHE  54           HA       PHE  54   5.448  -1.954   3.547
  442   1HB   PHE  54          HB2       PHE  54   3.272  -2.995   4.216
  443   2HB   PHE  54          HB3       PHE  54   2.832  -1.501   5.040
  444    HD1  PHE  54           HD1      PHE  54   1.116  -0.417   3.872
  445    HD2  PHE  54           HD2      PHE  54   4.286  -2.289   1.626
  446    HE1  PHE  54           HE1      PHE  54   0.056   0.315   1.750
  447    HE2  PHE  54           HE2      PHE  54   3.240  -1.515  -0.485
  448    HZ   PHE  54           HZ       PHE  54   1.117  -0.227  -0.428
  449    H    ILE  55           H        ILE  55   4.386   0.173   6.234
  450    HA   ILE  55           HA       ILE  55   4.646   2.609   4.801
  451    HB   ILE  55           HB       ILE  55   4.650   1.870   7.687
  452   1HG1  ILE  55          HG12      ILE  55   2.785   3.509   5.899
  453   2HG1  ILE  55          HG13      ILE  55   2.608   1.775   6.182
  454   1HG2  ILE  55          HG21      ILE  55   4.929   4.705   6.580
  455   2HG2  ILE  55          HG22      ILE  55   4.556   4.293   8.268
  456   3HG2  ILE  55          HG23      ILE  55   6.117   3.861   7.597
  457   1HD1  ILE  55          HD11      ILE  55   2.354   2.220   8.618
  458   2HD1  ILE  55          HD12      ILE  55   2.336   3.970   8.247
  459   3HD1  ILE  55          HD13      ILE  55   1.072   2.909   7.593
  460    H    GLN  56           H        GLN  56   7.217   0.716   6.446
  461    HA   GLN  56           HA       GLN  56   9.276   2.727   5.943
  462   1HB   GLN  56          HB2       GLN  56   9.356  -0.226   6.668
  463   2HB   GLN  56          HB3       GLN  56  10.813   0.735   6.402
  464   1HG   GLN  56          HG2       GLN  56  10.300   2.221   8.226
  465   2HG   GLN  56          HG3       GLN  56   8.684   1.548   8.424
  466   1HE2  GLN  56          HE21      GLN  56   8.429  -0.502   9.440
  467   2HE2  GLN  56          HE22      GLN  56   9.748  -1.244  10.354
  468    H    MET  57           H        MET  57   8.347  -0.314   4.213
  469    HA   MET  57           HA       MET  57  10.269  -0.047   2.107
  470   1HB   MET  57          HB2       MET  57   7.560  -1.434   2.220
  471   2HB   MET  57          HB3       MET  57   8.706  -1.608   0.879
  472   1HG   MET  57          HG2       MET  57  10.365  -2.604   2.304
  473   2HG   MET  57          HG3       MET  57   9.443  -2.233   3.757
  474   1HE   MET  57          HE1       MET  57  10.620  -4.994   3.544
  475   2HE   MET  57          HE2       MET  57   9.508  -4.482   4.827
  476   3HE   MET  57          HE3       MET  57   9.238  -6.023   3.985
  477    H    LEU  58           H        LEU  58   7.005   1.243   2.446
  478    HA   LEU  58           HA       LEU  58   6.620   2.548  -0.031
  479   1HB   LEU  58          HB2       LEU  58   5.699   2.721   2.812
  480   2HB   LEU  58          HB3       LEU  58   5.398   4.160   1.829
  481    HG   LEU  58           HG       LEU  58   4.542   1.353   0.999
  482   1HD1  LEU  58          HD11      LEU  58   3.435   1.893   3.118
  483   2HD1  LEU  58          HD12      LEU  58   3.023   3.519   2.534
  484   3HD1  LEU  58          HD13      LEU  58   2.289   2.078   1.785
  485   1HD2  LEU  58          HD21      LEU  58   3.043   2.605  -0.499
  486   2HD2  LEU  58          HD22      LEU  58   3.645   4.146   0.184
  487   3HD2  LEU  58          HD23      LEU  58   4.723   3.132  -0.774
  488    H    ASN  59           H        ASN  59   8.460   3.511   2.779
  489    HA   ASN  59           HA       ASN  59   9.173   6.168   1.713
  490   1HB   ASN  59          HB2       ASN  59   9.418   4.700   4.342
  491   2HB   ASN  59          HB3       ASN  59  10.547   6.002   4.021
  492   1HD2  ASN  59          HD21      ASN  59   7.216   5.242   4.733
  493   2HD2  ASN  59          HD22      ASN  59   6.690   6.922   4.874
  494    H    GLU  60           H        GLU  60  10.611   2.997   1.600
  495    HA   GLU  60           HA       GLU  60  13.348   3.802   1.205
  496   1HB   GLU  60          HB2       GLU  60  11.761   1.335   0.397
  497   2HB   GLU  60          HB3       GLU  60  13.442   1.550  -0.064
  498   1HG   GLU  60          HG2       GLU  60  14.021   1.883   2.368
  499   2HG   GLU  60          HG3       GLU  60  12.365   1.429   2.773
  500    HA   PRO  61           HA       PRO  61  13.684   5.541  -2.805
  501   1HB   PRO  61          HB2       PRO  61  15.538   3.290  -3.575
  502   2HB   PRO  61          HB3       PRO  61  15.742   5.069  -3.773
  503   1HG   PRO  61          HG2       PRO  61  16.993   3.733  -1.775
  504   2HG   PRO  61          HG3       PRO  61  16.327   5.381  -1.557
  505   1HD   PRO  61          HD2       PRO  61  15.233   2.777  -0.585
  506   2HD   PRO  61          HD3       PRO  61  15.138   4.439   0.101
  507    H    VAL  62           H        VAL  62  13.018   5.481  -4.921
  508    HA   VAL  62           HA       VAL  62  11.712   3.059  -6.064
  509    HB   VAL  62           HB       VAL  62  10.255   4.927  -7.145
  510   1HG1  VAL  62          HG11      VAL  62   9.891   4.137  -4.229
  511   2HG1  VAL  62          HG12      VAL  62   8.626   4.796  -5.287
  512   3HG1  VAL  62          HG13      VAL  62   9.351   3.227  -5.663
  513   1HG2  VAL  62          HG21      VAL  62  11.431   6.921  -6.255
  514   2HG2  VAL  62          HG22      VAL  62   9.744   6.866  -5.731
  515   3HG2  VAL  62          HG23      VAL  62  11.015   6.425  -4.597
  516    H    GLN  63           H        GLN  63  12.410   2.520  -8.043
  517    HA   GLN  63           HA       GLN  63  13.625   4.527  -9.866
  518   1HB   GLN  63          HB2       GLN  63  15.026   1.980  -8.936
  519   2HB   GLN  63          HB3       GLN  63  15.537   2.982 -10.294
  520   1HG   GLN  63          HG2       GLN  63  15.842   4.912  -8.720
  521   2HG   GLN  63          HG3       GLN  63  15.475   3.829  -7.370
  522   1HE2  GLN  63          HE21      GLN  63  17.032   2.116  -6.834
  523   2HE2  GLN  63          HE22      GLN  63  18.674   2.222  -7.455
  524    H    GLU  64           H        GLU  64  13.090   4.192 -11.929
  525    HA   GLU  64           HA       GLU  64  12.316   1.464 -12.881
  526   1HB   GLU  64          HB2       GLU  64  10.424   2.370 -14.088
  527   2HB   GLU  64          HB3       GLU  64  10.264   2.675 -12.356
  528   1HG   GLU  64          HG2       GLU  64  10.880   5.014 -12.647
  529   2HG   GLU  64          HG3       GLU  64  11.284   4.753 -14.340
  530    H    ALA  65           H        ALA  65  14.397   4.009 -13.372
  531    HA   ALA  65           HA       ALA  65  15.256   3.049 -15.982
  532   1HB   ALA  65          HB1       ALA  65  13.468   4.663 -16.618
  533   2HB   ALA  65          HB2       ALA  65  14.256   5.921 -15.644
  534   3HB   ALA  65          HB3       ALA  65  15.063   5.266 -17.083
  535    H    GLY  66           H        GLY  66  17.293   4.202 -16.661
  536   1HA   GLY  66          HA2       GLY  66  19.152   4.563 -14.466
  537   2HA   GLY  66          HA3       GLY  66  19.482   4.763 -16.187
  538    H    GLY  67           H        GLY  67  17.120   6.801 -16.190
  539   1HA   GLY  67          HA2       GLY  67  17.635   9.014 -14.527
  540   2HA   GLY  67          HA3       GLY  67  18.597   9.233 -15.991
  541    H    GLN  68           H        GLN  68  16.826  11.140 -15.601
  542    HA   GLN  68           HA       GLN  68  14.169  10.712 -16.579
  543   1HB   GLN  68          HB2       GLN  68  14.974  12.586 -15.129
  544   2HB   GLN  68          HB3       GLN  68  15.804  13.279 -16.526
  545   1HG   GLN  68          HG2       GLN  68  13.637  13.602 -17.673
  546   2HG   GLN  68          HG3       GLN  68  12.807  12.745 -16.371
  547   1HE2  GLN  68          HE21      GLN  68  11.483  14.426 -15.572
  548   2HE2  GLN  68          HE22      GLN  68  12.151  15.926 -14.937
  549    H    GLY  69           H        GLY  69  17.195  11.271 -18.284
  550   1HA   GLY  69          HA2       GLY  69  16.251  10.425 -20.812
  551   2HA   GLY  69          HA3       GLY  69  16.236  12.190 -20.803
  552    H    GLY  70           H        GLY  70  17.790  11.332 -22.638
  553   1HA   GLY  70          HA2       GLY  70  20.221  12.462 -22.437
  554   2HA   GLY  70          HA3       GLY  70  20.580  10.865 -21.776
  555    H    GLY  71           H        GLY  71  18.655   9.517 -23.643
  556   1HA   GLY  71          HA2       GLY  71  18.439   8.797 -25.832
  557   2HA   GLY  71          HA3       GLY  71  19.526  10.072 -26.371
  558    H    GLY  72           H        GLY  72  20.957   8.204 -23.898
  559   1HA   GLY  72          HA2       GLY  72  21.905   5.863 -25.184
  560   2HA   GLY  72          HA3       GLY  72  23.068   7.147 -25.515
  Start of MODEL    7
    1   1H    GLY   1           H1       GLY   1  16.250  -5.365  -0.562
    2   2H    GLY   1           H2       GLY   1  17.425  -5.685  -1.664
    3   3H    GLY   1           H3       GLY   1  17.637  -4.486  -0.562
    4   1HA   GLY   1          HA2       GLY   1  18.935  -6.421   0.057
    5   2HA   GLY   1          HA3       GLY   1  17.684  -6.046   1.256
    6    H    SER   2           H        SER   2  19.094  -8.619   0.179
    7    HA   SER   2           HA       SER   2  17.342 -10.231  -1.241
    8   1HB   SER   2          HB2       SER   2  19.359 -11.143   0.835
    9   2HB   SER   2          HB3       SER   2  18.719 -12.099  -0.513
   10    HG   SER   2           HG       SER   2  20.749 -11.159  -1.008
   11    H    HIS   3           H        HIS   3  16.992  -9.467   2.136
   12    HA   HIS   3           HA       HIS   3  15.124 -11.742   2.569
   13   1HB   HIS   3          HB2       HIS   3  17.226 -11.167   4.019
   14   2HB   HIS   3          HB3       HIS   3  16.193  -9.942   4.738
   15    HD1  HIS   3           HD1      HIS   3  13.599 -11.365   5.399
   16    HD2  HIS   3           HD2      HIS   3  17.316 -13.303   5.431
   17    HE1  HIS   3           HE1      HIS   3  13.316 -13.421   6.894
   18    H    MET   4           H        MET   4  14.634  -8.869   1.255
   19    HA   MET   4           HA       MET   4  12.785  -7.457   2.796
   20   1HB   MET   4          HB2       MET   4  13.778  -6.674   0.692
   21   2HB   MET   4          HB3       MET   4  12.805  -7.837  -0.220
   22   1HG   MET   4          HG2       MET   4  10.740  -6.698   0.564
   23   2HG   MET   4          HG3       MET   4  11.725  -5.601   1.541
   24   1HE   MET   4          HE1       MET   4  12.092  -6.898  -2.236
   25   2HE   MET   4          HE2       MET   4  10.367  -6.529  -1.975
   26   3HE   MET   4          HE3       MET   4  11.340  -5.527  -3.074
   27    HA   PRO   5           HA       PRO   5   9.373 -10.453   2.902
   28   1HB   PRO   5          HB2       PRO   5   7.616  -9.093   4.466
   29   2HB   PRO   5          HB3       PRO   5   9.185  -9.669   5.095
   30   1HG   PRO   5          HG2       PRO   5   8.530  -6.905   4.021
   31   2HG   PRO   5          HG3       PRO   5   9.265  -7.322   5.605
   32   1HD   PRO   5          HD2       PRO   5  10.775  -6.647   3.441
   33   2HD   PRO   5          HD3       PRO   5  11.319  -7.895   4.603
   34    H    LEU   6           H        LEU   6   6.782 -10.109   2.717
   35    HA   LEU   6           HA       LEU   6   5.040  -9.879   1.302
   36   1HB   LEU   6          HB2       LEU   6   6.124  -7.080   0.878
   37   2HB   LEU   6          HB3       LEU   6   4.492  -7.630   0.498
   38    HG   LEU   6           HG       LEU   6   5.682  -7.573   3.312
   39   1HD1  LEU   6          HD11      LEU   6   3.745  -5.670   1.952
   40   2HD1  LEU   6          HD12      LEU   6   4.203  -5.638   3.673
   41   3HD1  LEU   6          HD13      LEU   6   5.418  -5.309   2.428
   42   1HD2  LEU   6          HD21      LEU   6   2.822  -8.017   2.346
   43   2HD2  LEU   6          HD22      LEU   6   3.869  -9.235   3.115
   44   3HD2  LEU   6          HD23      LEU   6   3.324  -7.831   4.039
   45    H    GLU   7           H        GLU   7   6.284 -11.540   0.161
   46    HA   GLU   7           HA       GLU   7   7.818 -11.154  -2.142
   47   1HB   GLU   7          HB2       GLU   7   7.212 -13.470  -2.732
   48   2HB   GLU   7          HB3       GLU   7   7.838 -13.270  -1.110
   49   1HG   GLU   7          HG2       GLU   7   4.839 -13.301  -1.480
   50   2HG   GLU   7          HG3       GLU   7   5.726 -14.799  -1.669
   51    H    PHE   8           H        PHE   8   4.303 -11.023  -1.902
   52    HA   PHE   8           HA       PHE   8   3.841 -11.070  -4.770
   53   1HB   PHE   8          HB2       PHE   8   1.992 -10.177  -2.549
   54   2HB   PHE   8          HB3       PHE   8   1.537 -10.626  -4.192
   55    HD1  PHE   8           HD1      PHE   8   2.068 -11.819  -0.825
   56    HD2  PHE   8           HD2      PHE   8   1.982 -13.057  -4.955
   57    HE1  PHE   8           HE1      PHE   8   1.808 -14.181  -0.114
   58    HE2  PHE   8           HE2      PHE   8   1.700 -15.417  -4.236
   59    HZ   PHE   8           HZ       PHE   8   1.615 -15.981  -1.817
   60    H    LEU   9           H        LEU   9   5.174  -8.634  -2.879
   61    HA   LEU   9           HA       LEU   9   4.391  -6.477  -4.824
   62   1HB   LEU   9          HB2       LEU   9   5.852  -6.372  -2.145
   63   2HB   LEU   9          HB3       LEU   9   5.708  -5.015  -3.244
   64    HG   LEU   9           HG       LEU   9   3.357  -6.420  -1.930
   65   1HD1  LEU   9          HD11      LEU   9   4.635  -3.731  -1.305
   66   2HD1  LEU   9          HD12      LEU   9   3.224  -4.460  -0.498
   67   3HD1  LEU   9          HD13      LEU   9   4.823  -5.206  -0.335
   68   1HD2  LEU   9          HD21      LEU   9   2.116  -4.342  -2.661
   69   2HD2  LEU   9          HD22      LEU   9   3.543  -3.856  -3.593
   70   3HD2  LEU   9          HD23      LEU   9   2.653  -5.335  -4.021
   71    H    ARG  10           H        ARG  10   7.093  -8.154  -3.279
   72    HA   ARG  10           HA       ARG  10   9.302  -7.174  -4.678
   73   1HB   ARG  10          HB2       ARG  10   9.204  -8.576  -2.612
   74   2HB   ARG  10          HB3       ARG  10   8.780  -9.972  -3.609
   75   1HG   ARG  10          HG2       ARG  10  10.920 -10.017  -4.648
   76   2HG   ARG  10          HG3       ARG  10  11.371  -8.438  -3.965
   77   1HD   ARG  10          HD2       ARG  10  11.365  -9.354  -1.708
   78   2HD   ARG  10          HD3       ARG  10  10.722 -10.903  -2.292
   79    HE   ARG  10           HE       ARG  10  13.066 -10.544  -3.728
   80   1HH1  ARG  10          HH22      ARG  10  12.411 -10.762  -0.249
   81   2HH1  ARG  10          HH21      ARG  10  13.946 -11.572   0.010
   82   1HH2  ARG  10          HH12      ARG  10  14.972 -11.573  -3.217
   83   2HH2  ARG  10          HH11      ARG  10  15.308 -11.955  -1.540
   84    H    ASN  11           H        ASN  11   6.840  -9.190  -6.003
   85    HA   ASN  11           HA       ASN  11   8.530  -9.938  -8.332
   86   1HB   ASN  11          HB2       ASN  11   7.167 -11.846  -8.588
   87   2HB   ASN  11          HB3       ASN  11   7.560 -11.747  -6.871
   88   1HD2  ASN  11          HD21      ASN  11   5.489 -13.350  -7.618
   89   2HD2  ASN  11          HD22      ASN  11   3.953 -12.592  -7.193
   90    H    GLN  12           H        GLN  12   6.628  -7.370  -7.834
   91    HA   GLN  12           HA       GLN  12   5.556  -7.458 -10.620
   92   1HB   GLN  12          HB2       GLN  12   3.685  -6.039  -9.935
   93   2HB   GLN  12          HB3       GLN  12   3.641  -7.672  -9.292
   94   1HG   GLN  12          HG2       GLN  12   4.274  -6.916  -7.085
   95   2HG   GLN  12          HG3       GLN  12   4.534  -5.258  -7.655
   96   1HE2  GLN  12          HE21      GLN  12   2.217  -7.342  -6.238
   97   2HE2  GLN  12          HE22      GLN  12   0.822  -6.306  -6.525
   98    HA   PRO  13           HA       PRO  13   8.236  -3.849 -11.164
   99   1HB   PRO  13          HB2       PRO  13   6.338  -3.473 -13.486
  100   2HB   PRO  13          HB3       PRO  13   8.119  -3.293 -13.448
  101   1HG   PRO  13          HG2       PRO  13   7.022  -5.536 -14.467
  102   2HG   PRO  13          HG3       PRO  13   8.428  -5.662 -13.358
  103   1HD   PRO  13          HD2       PRO  13   5.497  -6.042 -12.729
  104   2HD   PRO  13          HD3       PRO  13   6.903  -7.043 -12.237
  105    H    GLN  14           H        GLN  14   4.694  -3.702 -11.157
  106    HA   GLN  14           HA       GLN  14   4.291  -0.924 -10.836
  107   1HB   GLN  14          HB2       GLN  14   2.582  -2.560 -11.424
  108   2HB   GLN  14          HB3       GLN  14   2.730  -3.329  -9.847
  109   1HG   GLN  14          HG2       GLN  14   1.848  -1.264  -8.769
  110   2HG   GLN  14          HG3       GLN  14   1.761  -0.480 -10.351
  111   1HE2  GLN  14          HE21      GLN  14   0.652  -3.618  -8.827
  112   2HE2  GLN  14          HE22      GLN  14  -0.979  -3.466  -9.461
  113    H    PHE  15           H        PHE  15   5.757  -3.087  -8.508
  114    HA   PHE  15           HA       PHE  15   5.026  -1.565  -6.114
  115   1HB   PHE  15          HB2       PHE  15   5.580  -3.902  -5.918
  116   2HB   PHE  15          HB3       PHE  15   7.143  -3.649  -6.703
  117    HD1  PHE  15           HD1      PHE  15   5.288  -2.089  -3.784
  118    HD2  PHE  15           HD2      PHE  15   8.946  -3.840  -5.260
  119    HE1  PHE  15           HE1      PHE  15   6.342  -1.778  -1.560
  120    HE2  PHE  15           HE2      PHE  15   9.998  -3.497  -3.039
  121    HZ   PHE  15           HZ       PHE  15   8.699  -2.483  -1.188
  122    H    GLN  16           H        GLN  16   7.397  -1.269  -8.650
  123    HA   GLN  16           HA       GLN  16   8.933   0.836  -7.256
  124   1HB   GLN  16          HB2       GLN  16   9.100  -0.516  -9.968
  125   2HB   GLN  16          HB3       GLN  16  10.113   0.873  -9.527
  126   1HG   GLN  16          HG2       GLN  16  10.972  -0.421  -7.560
  127   2HG   GLN  16          HG3       GLN  16  10.051  -1.825  -8.109
  128   1HE2  GLN  16          HE21      GLN  16  12.944   0.094  -8.630
  129   2HE2  GLN  16          HE22      GLN  16  13.595  -0.910  -9.921
  130    H    GLN  17           H        GLN  17   5.900   0.832  -8.474
  131    HA   GLN  17           HA       GLN  17   6.102   3.607  -9.598
  132   1HB   GLN  17          HB2       GLN  17   4.107   1.422 -10.293
  133   2HB   GLN  17          HB3       GLN  17   4.117   3.075 -10.919
  134   1HG   GLN  17          HG2       GLN  17   6.374   2.667 -11.904
  135   2HG   GLN  17          HG3       GLN  17   6.306   0.988 -11.367
  136   1HE2  GLN  17          HE21      GLN  17   6.295   2.362 -14.169
  137   2HE2  GLN  17          HE22      GLN  17   4.952   1.540 -14.962
  138    H    MET  18           H        MET  18   3.834   1.412  -7.771
  139    HA   MET  18           HA       MET  18   1.974   3.371  -7.083
  140   1HB   MET  18          HB2       MET  18   1.222   1.821  -5.415
  141   2HB   MET  18          HB3       MET  18   1.629   0.978  -6.908
  142   1HG   MET  18          HG2       MET  18   3.797   0.251  -5.895
  143   2HG   MET  18          HG3       MET  18   3.395   1.133  -4.419
  144   1HE   MET  18          HE1       MET  18   1.031  -1.336  -6.566
  145   2HE   MET  18          HE2       MET  18   2.667  -2.047  -6.598
  146   3HE   MET  18          HE3       MET  18   1.369  -2.836  -5.680
  147    H    ARG  19           H        ARG  19   4.979   2.619  -5.341
  148    HA   ARG  19           HA       ARG  19   4.493   4.340  -3.078
  149   1HB   ARG  19          HB2       ARG  19   7.158   3.448  -4.297
  150   2HB   ARG  19          HB3       ARG  19   6.880   4.034  -2.649
  151   1HG   ARG  19          HG2       ARG  19   5.272   2.107  -2.349
  152   2HG   ARG  19          HG3       ARG  19   5.830   1.432  -3.867
  153   1HD   ARG  19          HD2       ARG  19   7.870   2.158  -1.756
  154   2HD   ARG  19          HD3       ARG  19   6.968   0.635  -1.641
  155    HE   ARG  19           HE       ARG  19   7.786   0.312  -4.091
  156   1HH1  ARG  19          HH12      ARG  19   9.824   1.615  -1.522
  157   2HH1  ARG  19          HH11      ARG  19  11.275   1.262  -2.425
  158   1HH2  ARG  19          HH22      ARG  19   9.623  -0.513  -4.875
  159   2HH2  ARG  19          HH21      ARG  19  11.160  -0.171  -4.110
  160    H    GLN  20           H        GLN  20   5.763   4.996  -6.271
  161    HA   GLN  20           HA       GLN  20   6.853   7.633  -5.741
  162   1HB   GLN  20          HB2       GLN  20   5.548   6.729  -8.340
  163   2HB   GLN  20          HB3       GLN  20   6.607   8.100  -8.088
  164   1HG   GLN  20          HG2       GLN  20   8.462   6.484  -7.456
  165   2HG   GLN  20          HG3       GLN  20   7.379   5.167  -7.928
  166   1HE2  GLN  20          HE21      GLN  20   8.401   4.400  -9.832
  167   2HE2  GLN  20          HE22      GLN  20   8.713   5.445 -11.215
  168    H    ILE  21           H        ILE  21   3.592   6.433  -6.424
  169    HA   ILE  21           HA       ILE  21   2.319   8.944  -6.824
  170    HB   ILE  21           HB       ILE  21   0.999   6.445  -5.665
  171   1HG1  ILE  21          HG12      ILE  21   1.749   7.019  -8.548
  172   2HG1  ILE  21          HG13      ILE  21   2.322   5.690  -7.543
  173   1HG2  ILE  21          HG21      ILE  21  -0.048   8.646  -7.493
  174   2HG2  ILE  21          HG22      ILE  21  -0.992   7.315  -6.782
  175   3HG2  ILE  21          HG23      ILE  21  -0.325   8.566  -5.739
  176   1HD1  ILE  21          HD11      ILE  21   0.742   4.772  -9.036
  177   2HD1  ILE  21          HD12      ILE  21   0.039   4.745  -7.414
  178   3HD1  ILE  21          HD13      ILE  21  -0.494   5.970  -8.602
  179    H    ILE  22           H        ILE  22   2.824   6.901  -3.980
  180    HA   ILE  22           HA       ILE  22   1.347   8.588  -2.133
  181    HB   ILE  22           HB       ILE  22   3.318   6.363  -1.503
  182   1HG1  ILE  22          HG12      ILE  22   1.765   5.207  -2.804
  183   2HG1  ILE  22          HG13      ILE  22   1.144   4.993  -1.184
  184   1HG2  ILE  22          HG21      ILE  22   2.048   6.144   0.589
  185   2HG2  ILE  22          HG22      ILE  22   2.760   7.745   0.462
  186   3HG2  ILE  22          HG23      ILE  22   1.022   7.518   0.131
  187   1HD1  ILE  22          HD11      ILE  22  -0.432   6.963  -1.656
  188   2HD1  ILE  22          HD12      ILE  22   0.029   6.772  -3.363
  189   3HD1  ILE  22          HD13      ILE  22  -0.739   5.428  -2.505
  190    H    GLN  23           H        GLN  23   4.774   8.240  -2.923
  191    HA   GLN  23           HA       GLN  23   5.819  10.038  -0.956
  192   1HB   GLN  23          HB2       GLN  23   6.795   8.867  -3.569
  193   2HB   GLN  23          HB3       GLN  23   7.799   9.993  -2.638
  194   1HG   GLN  23          HG2       GLN  23   7.760   8.544  -0.684
  195   2HG   GLN  23          HG3       GLN  23   6.609   7.451  -1.446
  196   1HE2  GLN  23          HE21      GLN  23   8.053   5.663  -1.104
  197   2HE2  GLN  23          HE22      GLN  23   9.541   5.503  -1.999
  198    H    GLN  24           H        GLN  24   3.697  10.883  -3.301
  199    HA   GLN  24           HA       GLN  24   4.580  13.752  -3.281
  200   1HB   GLN  24          HB2       GLN  24   3.128  12.338  -5.556
  201   2HB   GLN  24          HB3       GLN  24   3.617  14.037  -5.508
  202   1HG   GLN  24          HG2       GLN  24   5.986  13.354  -5.482
  203   2HG   GLN  24          HG3       GLN  24   5.482  11.652  -5.428
  204   1HE2  GLN  24          HE21      GLN  24   4.967  10.601  -7.331
  205   2HE2  GLN  24          HE22      GLN  24   4.985  11.386  -8.915
  206    H    ASN  25           H        ASN  25   1.930  11.440  -3.476
  207    HA   ASN  25           HA       ASN  25   0.141  13.315  -1.985
  208   1HB   ASN  25          HB2       ASN  25  -0.404  11.701  -4.453
  209   2HB   ASN  25          HB3       ASN  25  -1.686  11.842  -3.246
  210   1HD2  ASN  25          HD21      ASN  25  -2.198  14.042  -2.413
  211   2HD2  ASN  25          HD22      ASN  25  -2.183  15.333  -3.615
  212    HA   PRO  26           HA       PRO  26   0.767   9.588   0.659
  213   1HB   PRO  26          HB2       PRO  26   0.783  10.898   3.068
  214   2HB   PRO  26          HB3       PRO  26   2.227  10.713   2.023
  215   1HG   PRO  26          HG2       PRO  26   0.335  13.076   2.165
  216   2HG   PRO  26          HG3       PRO  26   2.131  13.091   2.258
  217   1HD   PRO  26          HD2       PRO  26   0.816  13.607  -0.027
  218   2HD   PRO  26          HD3       PRO  26   2.314  12.619  -0.064
  219    H    SER  27           H        SER  27  -1.611  12.148   0.540
  220    HA   SER  27           HA       SER  27  -3.729  11.095   2.101
  221   1HB   SER  27          HB2       SER  27  -5.146  12.408   0.490
  222   2HB   SER  27          HB3       SER  27  -3.838  13.320   1.251
  223    HG   SER  27           HG       SER  27  -4.079  13.599  -1.067
  224    H    LEU  28           H        LEU  28  -2.386   9.847  -0.876
  225    HA   LEU  28           HA       LEU  28  -4.776   8.149  -1.364
  226   1HB   LEU  28          HB2       LEU  28  -2.280   8.595  -3.036
  227   2HB   LEU  28          HB3       LEU  28  -3.662   7.595  -3.483
  228    HG   LEU  28           HG       LEU  28  -3.629  10.619  -3.182
  229   1HD1  LEU  28          HD11      LEU  28  -2.680   9.653  -5.261
  230   2HD1  LEU  28          HD12      LEU  28  -4.191   8.751  -5.519
  231   3HD1  LEU  28          HD13      LEU  28  -4.189  10.529  -5.579
  232   1HD2  LEU  28          HD21      LEU  28  -5.998   8.785  -3.761
  233   2HD2  LEU  28          HD22      LEU  28  -5.812   9.875  -2.363
  234   3HD2  LEU  28          HD23      LEU  28  -5.987  10.551  -3.981
  235    H    LEU  29           H        LEU  29  -2.181   7.795   0.654
  236    HA   LEU  29           HA       LEU  29  -1.327   5.136   0.160
  237   1HB   LEU  29          HB2       LEU  29  -0.283   6.603   1.785
  238   2HB   LEU  29          HB3       LEU  29  -1.701   6.651   2.779
  239    HG   LEU  29           HG       LEU  29  -1.500   4.275   3.340
  240   1HD1  LEU  29          HD11      LEU  29   0.947   4.324   1.525
  241   2HD1  LEU  29          HD12      LEU  29   0.588   3.035   2.701
  242   3HD1  LEU  29          HD13      LEU  29  -0.505   3.316   1.339
  243   1HD2  LEU  29          HD21      LEU  29   1.138   5.763   3.664
  244   2HD2  LEU  29          HD22      LEU  29  -0.301   5.964   4.688
  245   3HD2  LEU  29          HD23      LEU  29   0.553   4.415   4.667
  246    HA   PRO  30           HA       PRO  30  -5.393   3.641   2.567
  247   1HB   PRO  30          HB2       PRO  30  -7.156   5.898   1.614
  248   2HB   PRO  30          HB3       PRO  30  -7.240   4.980   3.128
  249   1HG   PRO  30          HG2       PRO  30  -6.218   7.544   2.771
  250   2HG   PRO  30          HG3       PRO  30  -5.779   6.469   4.146
  251   1HD   PRO  30          HD2       PRO  30  -4.139   7.324   1.873
  252   2HD   PRO  30          HD3       PRO  30  -3.651   6.453   3.346
  253    H    ALA  31           H        ALA  31  -5.756   5.724  -0.271
  254    HA   ALA  31           HA       ALA  31  -7.483   4.020  -1.741
  255   1HB   ALA  31          HB1       ALA  31  -7.166   5.648  -3.489
  256   2HB   ALA  31          HB2       ALA  31  -7.199   6.493  -1.919
  257   3HB   ALA  31          HB3       ALA  31  -5.656   6.230  -2.761
  258    H    LEU  32           H        LEU  32  -4.074   3.612  -1.234
  259    HA   LEU  32           HA       LEU  32  -3.757   1.941  -3.685
  260   1HB   LEU  32          HB2       LEU  32  -1.958   3.504  -3.158
  261   2HB   LEU  32          HB3       LEU  32  -1.879   2.862  -1.503
  262    HG   LEU  32           HG       LEU  32  -1.001   0.753  -2.279
  263   1HD1  LEU  32          HD11      LEU  32  -0.417   0.363  -4.645
  264   2HD1  LEU  32          HD12      LEU  32  -2.155   0.519  -4.443
  265   3HD1  LEU  32          HD13      LEU  32  -1.226   1.889  -5.101
  266   1HD2  LEU  32          HD21      LEU  32   0.525   2.665  -1.878
  267   2HD2  LEU  32          HD22      LEU  32   1.184   1.553  -3.090
  268   3HD2  LEU  32          HD23      LEU  32   0.452   3.084  -3.603
  269    H    LEU  33           H        LEU  33  -3.740   1.767  -0.097
  270    HA   LEU  33           HA       LEU  33  -3.483  -1.075   0.135
  271   1HB   LEU  33          HB2       LEU  33  -4.896   1.001   1.849
  272   2HB   LEU  33          HB3       LEU  33  -4.607  -0.667   2.351
  273    HG   LEU  33           HG       LEU  33  -2.232   1.000   1.465
  274   1HD1  LEU  33          HD11      LEU  33  -1.956   1.832   3.750
  275   2HD1  LEU  33          HD12      LEU  33  -3.422   2.459   2.978
  276   3HD1  LEU  33          HD13      LEU  33  -3.550   1.162   4.195
  277   1HD2  LEU  33          HD21      LEU  33  -1.072  -0.380   3.115
  278   2HD2  LEU  33          HD22      LEU  33  -2.602  -1.147   3.593
  279   3HD2  LEU  33          HD23      LEU  33  -1.943  -1.403   1.960
  280    H    GLN  34           H        GLN  34  -6.417   0.993  -0.186
  281    HA   GLN  34           HA       GLN  34  -8.289  -1.174  -0.358
  282   1HB   GLN  34          HB2       GLN  34  -8.363   1.701  -1.351
  283   2HB   GLN  34          HB3       GLN  34  -9.734   0.608  -1.479
  284   1HG   GLN  34          HG2       GLN  34  -8.416   1.340   1.174
  285   2HG   GLN  34          HG3       GLN  34  -9.826   2.147   0.498
  286   1HE2  GLN  34          HE21      GLN  34 -11.880   0.947   0.380
  287   2HE2  GLN  34          HE22      GLN  34 -12.083  -0.496   1.364
  288    H    GLN  35           H        GLN  35  -5.985   0.008  -2.756
  289    HA   GLN  35           HA       GLN  35  -7.463  -1.323  -4.949
  290   1HB   GLN  35          HB2       GLN  35  -6.577   0.819  -5.463
  291   2HB   GLN  35          HB3       GLN  35  -4.961   0.396  -4.871
  292   1HG   GLN  35          HG2       GLN  35  -4.504  -0.994  -6.657
  293   2HG   GLN  35          HG3       GLN  35  -6.219  -1.252  -7.053
  294   1HE2  GLN  35          HE21      GLN  35  -3.626   1.276  -7.184
  295   2HE2  GLN  35          HE22      GLN  35  -4.376   2.118  -8.541
  296    H    ILE  36           H        ILE  36  -4.560  -1.862  -2.912
  297    HA   ILE  36           HA       ILE  36  -3.867  -4.390  -4.119
  298    HB   ILE  36           HB       ILE  36  -3.563  -3.436  -1.269
  299   1HG1  ILE  36          HG12      ILE  36  -1.447  -3.675  -3.463
  300   2HG1  ILE  36          HG13      ILE  36  -2.330  -2.179  -3.177
  301   1HG2  ILE  36          HG21      ILE  36  -3.515  -5.924  -1.371
  302   2HG2  ILE  36          HG22      ILE  36  -2.417  -5.873  -2.752
  303   3HG2  ILE  36          HG23      ILE  36  -1.874  -5.332  -1.145
  304   1HD1  ILE  36          HD11      ILE  36  -1.532  -2.200  -0.793
  305   2HD1  ILE  36          HD12      ILE  36  -0.460  -3.557  -1.244
  306   3HD1  ILE  36          HD13      ILE  36  -0.272  -1.980  -2.028
  307    H    GLY  37           H        GLY  37  -6.269  -3.513  -1.527
  308   1HA   GLY  37          HA2       GLY  37  -7.597  -5.982  -1.399
  309   2HA   GLY  37          HA3       GLY  37  -8.303  -4.401  -1.076
  310    H    ARG  38           H        ARG  38  -7.304  -4.465  -4.352
  311    HA   ARG  38           HA       ARG  38  -9.727  -5.907  -5.310
  312   1HB   ARG  38          HB2       ARG  38 -10.467  -4.276  -6.652
  313   2HB   ARG  38          HB3       ARG  38  -9.715  -3.245  -5.438
  314   1HG   ARG  38          HG2       ARG  38  -7.718  -3.007  -6.899
  315   2HG   ARG  38          HG3       ARG  38  -8.511  -4.012  -8.127
  316   1HD   ARG  38          HD2       ARG  38 -10.321  -2.350  -8.339
  317   2HD   ARG  38          HD3       ARG  38  -9.635  -1.407  -7.021
  318    HE   ARG  38           HE       ARG  38  -8.001  -0.538  -8.422
  319   1HH1  ARG  38          HH22      ARG  38  -9.627  -3.062 -10.252
  320   2HH1  ARG  38          HH21      ARG  38  -8.804  -2.605 -11.727
  321   1HH2  ARG  38          HH12      ARG  38  -6.994  -0.080 -10.227
  322   2HH2  ARG  38          HH11      ARG  38  -7.343  -0.922 -11.726
  323    H    GLU  39           H        GLU  39  -6.308  -5.206  -5.845
  324    HA   GLU  39           HA       GLU  39  -6.163  -6.973  -8.195
  325   1HB   GLU  39          HB2       GLU  39  -4.295  -5.109  -6.682
  326   2HB   GLU  39          HB3       GLU  39  -3.714  -6.233  -7.911
  327   1HG   GLU  39          HG2       GLU  39  -5.246  -5.219  -9.572
  328   2HG   GLU  39          HG3       GLU  39  -5.830  -4.085  -8.349
  329    H    ASN  40           H        ASN  40  -5.247  -7.019  -4.765
  330    HA   ASN  40           HA       ASN  40  -4.912  -9.901  -4.830
  331   1HB   ASN  40          HB2       ASN  40  -2.598  -8.877  -5.396
  332   2HB   ASN  40          HB3       ASN  40  -2.577  -8.261  -3.766
  333   1HD2  ASN  40          HD21      ASN  40  -0.826 -10.296  -5.060
  334   2HD2  ASN  40          HD22      ASN  40  -1.032 -11.756  -4.088
  335    HA   PRO  41           HA       PRO  41  -7.163  -8.183  -1.058
  336   1HB   PRO  41          HB2       PRO  41  -8.407 -10.868  -1.683
  337   2HB   PRO  41          HB3       PRO  41  -9.165  -9.425  -0.935
  338   1HG   PRO  41          HG2       PRO  41  -9.538  -9.870  -3.544
  339   2HG   PRO  41          HG3       PRO  41  -9.078  -8.218  -3.008
  340   1HD   PRO  41          HD2       PRO  41  -7.320 -10.383  -4.164
  341   2HD   PRO  41          HD3       PRO  41  -7.376  -8.636  -4.578
  342    H    GLN  42           H        GLN  42  -5.413 -11.186  -1.744
  343    HA   GLN  42           HA       GLN  42  -5.290 -12.092   1.040
  344   1HB   GLN  42          HB2       GLN  42  -3.661 -12.948  -1.376
  345   2HB   GLN  42          HB3       GLN  42  -3.826 -13.820   0.158
  346   1HG   GLN  42          HG2       GLN  42  -6.308 -13.963  -0.276
  347   2HG   GLN  42          HG3       GLN  42  -6.029 -13.291  -1.882
  348   1HE2  GLN  42          HE21      GLN  42  -7.034 -16.052  -0.963
  349   2HE2  GLN  42          HE22      GLN  42  -5.971 -17.162  -1.818
  350    H    LEU  43           H        LEU  43  -3.038 -10.476  -1.255
  351    HA   LEU  43           HA       LEU  43  -0.868 -10.049   0.592
  352   1HB   LEU  43          HB2       LEU  43  -0.746  -9.684  -1.900
  353   2HB   LEU  43          HB3       LEU  43  -1.906  -8.368  -1.718
  354    HG   LEU  43           HG       LEU  43  -0.395  -7.013  -0.503
  355   1HD1  LEU  43          HD11      LEU  43   1.610  -9.306  -0.624
  356   2HD1  LEU  43          HD12      LEU  43   2.009  -7.621  -0.201
  357   3HD1  LEU  43          HD13      LEU  43   0.913  -8.555   0.820
  358   1HD2  LEU  43          HD21      LEU  43   1.056  -8.144  -2.920
  359   2HD2  LEU  43          HD22      LEU  43  -0.353  -7.066  -2.996
  360   3HD2  LEU  43          HD23      LEU  43   1.136  -6.494  -2.245
  361    H    LEU  44           H        LEU  44  -3.943  -8.395   0.008
  362    HA   LEU  44           HA       LEU  44  -3.277  -6.020   1.486
  363   1HB   LEU  44          HB2       LEU  44  -5.218  -6.387  -0.141
  364   2HB   LEU  44          HB3       LEU  44  -6.076  -7.198   1.125
  365    HG   LEU  44           HG       LEU  44  -6.424  -4.650   0.559
  366   1HD1  LEU  44          HD11      LEU  44  -6.471  -5.588   3.426
  367   2HD1  LEU  44          HD12      LEU  44  -7.367  -4.228   2.694
  368   3HD1  LEU  44          HD13      LEU  44  -7.714  -5.878   2.170
  369   1HD2  LEU  44          HD21      LEU  44  -5.345  -3.076   2.040
  370   2HD2  LEU  44          HD22      LEU  44  -4.345  -4.336   2.768
  371   3HD2  LEU  44          HD23      LEU  44  -4.110  -3.880   1.059
  372    H    GLN  45           H        GLN  45  -5.249  -8.756   2.414
  373    HA   GLN  45           HA       GLN  45  -5.422  -8.392   5.217
  374   1HB   GLN  45          HB2       GLN  45  -5.306 -10.916   3.537
  375   2HB   GLN  45          HB3       GLN  45  -5.605 -10.944   5.277
  376   1HG   GLN  45          HG2       GLN  45  -7.625  -9.659   5.070
  377   2HG   GLN  45          HG3       GLN  45  -7.312  -9.296   3.369
  378   1HE2  GLN  45          HE21      GLN  45  -7.573 -10.969   1.788
  379   2HE2  GLN  45          HE22      GLN  45  -8.534 -12.407   2.156
  380    H    GLN  46           H        GLN  46  -2.619  -9.691   3.410
  381    HA   GLN  46           HA       GLN  46  -1.090 -10.333   5.826
  382   1HB   GLN  46          HB2       GLN  46  -0.507 -10.160   2.849
  383   2HB   GLN  46          HB3       GLN  46   0.780 -10.410   4.019
  384   1HG   GLN  46          HG2       GLN  46  -0.284 -12.446   4.856
  385   2HG   GLN  46          HG3       GLN  46  -1.709 -12.177   3.862
  386   1HE2  GLN  46          HE21      GLN  46  -1.541 -12.396   1.556
  387   2HE2  GLN  46          HE22      GLN  46  -0.252 -13.382   0.843
  388    H    ILE  47           H        ILE  47  -1.075  -7.533   3.548
  389    HA   ILE  47           HA       ILE  47   0.970  -6.045   4.886
  390    HB   ILE  47           HB       ILE  47  -1.353  -5.270   3.116
  391   1HG1  ILE  47          HG12      ILE  47   1.679  -5.099   2.790
  392   2HG1  ILE  47          HG13      ILE  47   0.721  -6.489   2.263
  393   1HG2  ILE  47          HG21      ILE  47   0.674  -3.405   4.432
  394   2HG2  ILE  47          HG22      ILE  47  -0.333  -2.958   3.039
  395   3HG2  ILE  47          HG23      ILE  47  -1.098  -3.339   4.572
  396   1HD1  ILE  47          HD11      ILE  47  -0.612  -4.947   0.797
  397   2HD1  ILE  47          HD12      ILE  47   0.575  -3.668   1.160
  398   3HD1  ILE  47          HD13      ILE  47   1.097  -5.151   0.342
  399    H    SER  48           H        SER  48  -2.510  -6.374   5.528
  400    HA   SER  48           HA       SER  48  -2.649  -4.508   7.716
  401   1HB   SER  48          HB2       SER  48  -4.320  -7.013   7.251
  402   2HB   SER  48          HB3       SER  48  -4.723  -5.667   8.323
  403    HG   SER  48           HG       SER  48  -4.450  -5.570   5.498
  404    H    GLN  49           H        GLN  49  -0.999  -7.486   7.572
  405    HA   GLN  49           HA       GLN  49  -0.855  -7.800  10.530
  406   1HB   GLN  49          HB2       GLN  49  -0.593  -9.713   8.176
  407   2HB   GLN  49          HB3       GLN  49  -0.053 -10.140   9.794
  408   1HG   GLN  49          HG2       GLN  49  -2.319  -9.776  10.687
  409   2HG   GLN  49          HG3       GLN  49  -2.895  -9.265   9.102
  410   1HE2  GLN  49          HE21      GLN  49  -3.247 -10.838   7.468
  411   2HE2  GLN  49          HE22      GLN  49  -3.235 -12.569   7.834
  412    H    HIS  50           H        HIS  50   0.876  -6.483   7.989
  413    HA   HIS  50           HA       HIS  50   3.442  -6.540   9.488
  414   1HB   HIS  50          HB2       HIS  50   3.121  -6.996   6.490
  415   2HB   HIS  50          HB3       HIS  50   4.656  -6.834   7.349
  416    HD1  HIS  50           HD1      HIS  50   4.770  -8.890   9.495
  417    HD2  HIS  50           HD2      HIS  50   2.605  -9.471   5.939
  418    HE1  HIS  50           HE1      HIS  50   4.496 -11.404   9.229
  419    H    GLN  51           H        GLN  51   1.312  -4.559   9.389
  420    HA   GLN  51           HA       GLN  51   1.371  -2.907   7.201
  421   1HB   GLN  51          HB2       GLN  51  -0.428  -3.332   8.893
  422   2HB   GLN  51          HB3       GLN  51   0.467  -2.365  10.063
  423   1HG   GLN  51          HG2       GLN  51  -1.423  -1.207   9.087
  424   2HG   GLN  51          HG3       GLN  51   0.107  -0.364   8.759
  425   1HE2  GLN  51          HE21      GLN  51   0.970  -0.526   6.516
  426   2HE2  GLN  51          HE22      GLN  51  -0.177  -0.843   5.199
  427    H    GLU  52           H        GLU  52   3.353  -2.586  10.089
  428    HA   GLU  52           HA       GLU  52   4.291   0.122   9.426
  429   1HB   GLU  52          HB2       GLU  52   5.736  -0.062  11.298
  430   2HB   GLU  52          HB3       GLU  52   4.118  -0.539  11.774
  431   1HG   GLU  52          HG2       GLU  52   6.356  -2.521  11.154
  432   2HG   GLU  52          HG3       GLU  52   6.047  -1.859  12.743
  433    H    HIS  53           H        HIS  53   5.338  -3.217   8.827
  434    HA   HIS  53           HA       HIS  53   7.963  -2.464   7.792
  435   1HB   HIS  53          HB2       HIS  53   6.338  -5.009   7.414
  436   2HB   HIS  53          HB3       HIS  53   8.016  -4.775   6.943
  437    HD1  HIS  53           HD1      HIS  53   9.805  -4.444   9.046
  438    HD2  HIS  53           HD2      HIS  53   5.886  -5.661   9.955
  439    HE1  HIS  53           HE1      HIS  53   9.867  -5.327  11.432
  440    H    PHE  54           H        PHE  54   4.728  -3.063   6.369
  441    HA   PHE  54           HA       PHE  54   5.462  -2.573   3.635
  442   1HB   PHE  54          HB2       PHE  54   3.292  -3.532   4.187
  443   2HB   PHE  54          HB3       PHE  54   2.849  -2.108   5.114
  444    HD1  PHE  54           HD1      PHE  54   1.766  -0.261   4.048
  445    HD2  PHE  54           HD2      PHE  54   3.827  -3.177   1.636
  446    HE1  PHE  54           HE1      PHE  54   0.885   0.813   1.993
  447    HE2  PHE  54           HE2      PHE  54   2.954  -2.077  -0.418
  448    HZ   PHE  54           HZ       PHE  54   1.479  -0.093  -0.240
  449    H    ILE  55           H        ILE  55   4.172  -0.279   6.131
  450    HA   ILE  55           HA       ILE  55   4.335   2.014   4.502
  451    HB   ILE  55           HB       ILE  55   4.199   1.641   7.445
  452   1HG1  ILE  55          HG12      ILE  55   2.329   2.821   5.324
  453   2HG1  ILE  55          HG13      ILE  55   2.285   1.142   5.862
  454   1HG2  ILE  55          HG21      ILE  55   4.237   4.338   6.013
  455   2HG2  ILE  55          HG22      ILE  55   3.822   4.073   7.719
  456   3HG2  ILE  55          HG23      ILE  55   5.457   3.759   7.176
  457   1HD1  ILE  55          HD11      ILE  55   0.543   2.305   6.977
  458   2HD1  ILE  55          HD12      ILE  55   1.799   1.931   8.182
  459   3HD1  ILE  55          HD13      ILE  55   1.639   3.586   7.525
  460    H    GLN  56           H        GLN  56   6.951   0.552   6.495
  461    HA   GLN  56           HA       GLN  56   8.839   2.686   6.006
  462   1HB   GLN  56          HB2       GLN  56   9.115  -0.231   6.790
  463   2HB   GLN  56          HB3       GLN  56  10.525   0.799   6.520
  464   1HG   GLN  56          HG2       GLN  56   9.913   2.315   8.272
  465   2HG   GLN  56          HG3       GLN  56   8.314   1.598   8.450
  466   1HE2  GLN  56          HE21      GLN  56   8.131  -0.526   9.398
  467   2HE2  GLN  56          HE22      GLN  56   9.415  -1.141  10.451
  468    H    MET  57           H        MET  57   8.189  -0.362   4.158
  469    HA   MET  57           HA       MET  57  10.287   0.131   2.215
  470   1HB   MET  57          HB2       MET  57   7.821  -1.637   2.149
  471   2HB   MET  57          HB3       MET  57   9.058  -1.591   0.878
  472   1HG   MET  57          HG2       MET  57   9.581  -2.272   3.795
  473   2HG   MET  57          HG3       MET  57   9.400  -3.434   2.483
  474   1HE   MET  57          HE1       MET  57  11.874  -3.071   4.663
  475   2HE   MET  57          HE2       MET  57  11.652  -4.448   3.564
  476   3HE   MET  57          HE3       MET  57  13.202  -3.579   3.599
  477    H    LEU  58           H        LEU  58   6.851   0.921   2.355
  478    HA   LEU  58           HA       LEU  58   6.378   2.258  -0.085
  479   1HB   LEU  58          HB2       LEU  58   4.812   1.289   1.384
  480   2HB   LEU  58          HB3       LEU  58   5.352   2.264   2.736
  481    HG   LEU  58           HG       LEU  58   3.135   2.662   1.690
  482   1HD1  LEU  58          HD11      LEU  58   4.953   5.050   2.187
  483   2HD1  LEU  58          HD12      LEU  58   3.179   5.034   2.292
  484   3HD1  LEU  58          HD13      LEU  58   4.128   4.067   3.420
  485   1HD2  LEU  58          HD21      LEU  58   3.871   2.778  -0.672
  486   2HD2  LEU  58          HD22      LEU  58   2.911   4.163  -0.155
  487   3HD2  LEU  58          HD23      LEU  58   4.670   4.337  -0.333
  488    H    ASN  59           H        ASN  59   7.767   3.472   3.010
  489    HA   ASN  59           HA       ASN  59   8.096   6.204   2.020
  490   1HB   ASN  59          HB2       ASN  59   8.764   4.673   4.532
  491   2HB   ASN  59          HB3       ASN  59   9.692   6.125   4.187
  492   1HD2  ASN  59          HD21      ASN  59   6.447   4.923   4.866
  493   2HD2  ASN  59          HD22      ASN  59   5.775   6.513   5.254
  494    H    GLU  60           H        GLU  60  10.224   3.342   2.184
  495    HA   GLU  60           HA       GLU  60  12.648   4.623   1.398
  496   1HB   GLU  60          HB2       GLU  60  11.614   1.794   1.225
  497   2HB   GLU  60          HB3       GLU  60  13.169   2.221   0.527
  498   1HG   GLU  60          HG2       GLU  60  12.446   2.826   3.425
  499   2HG   GLU  60          HG3       GLU  60  13.218   1.335   2.887
  500    HA   PRO  61           HA       PRO  61  12.057   5.575  -2.841
  501   1HB   PRO  61          HB2       PRO  61  14.544   5.291  -3.962
  502   2HB   PRO  61          HB3       PRO  61  14.108   6.588  -2.805
  503   1HG   PRO  61          HG2       PRO  61  15.472   3.947  -2.244
  504   2HG   PRO  61          HG3       PRO  61  15.965   5.587  -1.698
  505   1HD   PRO  61          HD2       PRO  61  14.564   3.893  -0.114
  506   2HD   PRO  61          HD3       PRO  61  14.240   5.657  -0.084
  507    H    VAL  62           H        VAL  62  11.886   4.804  -4.992
  508    HA   VAL  62           HA       VAL  62  11.500   1.934  -5.295
  509    HB   VAL  62           HB       VAL  62  10.604   2.584  -7.491
  510   1HG1  VAL  62          HG11      VAL  62   9.176   2.546  -5.468
  511   2HG1  VAL  62          HG12      VAL  62   9.500   4.274  -5.203
  512   3HG1  VAL  62          HG13      VAL  62   8.627   3.740  -6.652
  513   1HG2  VAL  62          HG21      VAL  62  11.127   5.486  -6.703
  514   2HG2  VAL  62          HG22      VAL  62  12.034   4.588  -7.944
  515   3HG2  VAL  62          HG23      VAL  62  10.309   4.882  -8.156
  516    H    GLN  63           H        GLN  63  14.208   3.898  -5.802
  517    HA   GLN  63           HA       GLN  63  15.545   1.868  -7.480
  518   1HB   GLN  63          HB2       GLN  63  14.512   3.380  -9.112
  519   2HB   GLN  63          HB3       GLN  63  15.142   4.789  -8.266
  520   1HG   GLN  63          HG2       GLN  63  16.345   4.270 -10.352
  521   2HG   GLN  63          HG3       GLN  63  17.371   4.253  -8.926
  522   1HE2  GLN  63          HE21      GLN  63  18.875   2.607  -9.061
  523   2HE2  GLN  63          HE22      GLN  63  18.580   1.035  -9.804
  524    H    GLU  64           H        GLU  64  17.640   1.636  -6.933
  525    HA   GLU  64           HA       GLU  64  18.854   3.293  -4.813
  526   1HB   GLU  64          HB2       GLU  64  19.791   0.802  -6.294
  527   2HB   GLU  64          HB3       GLU  64  20.688   1.603  -4.994
  528   1HG   GLU  64          HG2       GLU  64  18.767   1.244  -3.455
  529   2HG   GLU  64          HG3       GLU  64  17.918   0.369  -4.723
  530    H    ALA  65           H        ALA  65  21.186   3.935  -5.061
  531    HA   ALA  65           HA       ALA  65  21.464   5.872  -7.078
  532   1HB   ALA  65          HB1       ALA  65  22.458   5.983  -4.825
  533   2HB   ALA  65          HB2       ALA  65  23.570   4.657  -5.243
  534   3HB   ALA  65          HB3       ALA  65  23.686   6.219  -6.077
  535    H    GLY  66           H        GLY  66  22.141   2.531  -7.468
  536   1HA   GLY  66          HA2       GLY  66  22.936   2.890 -10.200
  537   2HA   GLY  66          HA3       GLY  66  24.320   2.377  -9.234
  538    H    GLY  67           H        GLY  67  23.485   0.815 -11.259
  539   1HA   GLY  67          HA2       GLY  67  22.952  -1.767 -10.091
  540   2HA   GLY  67          HA3       GLY  67  21.501  -1.113 -10.862
  541    H    GLN  68           H        GLN  68  24.929  -0.820 -11.853
  542    HA   GLN  68           HA       GLN  68  24.375  -2.223 -14.432
  543   1HB   GLN  68          HB2       GLN  68  25.701   0.510 -14.117
  544   2HB   GLN  68          HB3       GLN  68  25.603  -0.424 -15.597
  545   1HG   GLN  68          HG2       GLN  68  23.918   1.147 -15.860
  546   2HG   GLN  68          HG3       GLN  68  23.069  -0.326 -15.416
  547   1HE2  GLN  68          HE21      GLN  68  21.210   0.929 -14.704
  548   2HE2  GLN  68          HE22      GLN  68  21.285   1.875 -13.222
  549    H    GLY  69           H        GLY  69  26.375  -2.694 -15.661
  550   1HA   GLY  69          HA2       GLY  69  28.994  -2.687 -14.524
  551   2HA   GLY  69          HA3       GLY  69  28.222  -4.240 -14.197
  552    H    GLY  70           H        GLY  70  30.282  -4.708 -15.558
  553   1HA   GLY  70          HA2       GLY  70  30.819  -6.014 -17.410
  554   2HA   GLY  70          HA3       GLY  70  29.382  -5.453 -18.258
  555    H    GLY  71           H        GLY  71  31.161  -2.802 -17.090
  556   1HA   GLY  71          HA2       GLY  71  33.051  -2.541 -19.339
  557   2HA   GLY  71          HA3       GLY  71  31.644  -1.475 -19.397
  558    H    GLY  72           H        GLY  72  33.154  -2.389 -16.341
  559   1HA   GLY  72          HA2       GLY  72  34.974  -0.220 -15.967
  560   2HA   GLY  72          HA3       GLY  72  33.399   0.243 -15.319
  Start of MODEL    8
    1   1H    GLY   1           H1       GLY   1  10.942 -11.632   4.363
    2   2H    GLY   1           H2       GLY   1  11.176 -13.231   4.668
    3   3H    GLY   1           H3       GLY   1  10.629 -12.751   3.196
    4   1HA   GLY   1          HA2       GLY   1  12.915 -13.331   2.987
    5   2HA   GLY   1          HA3       GLY   1  12.689 -11.591   2.740
    6    H    SER   2           H        SER   2  15.132 -11.937   3.261
    7    HA   SER   2           HA       SER   2  15.976 -12.572   5.910
    8   1HB   SER   2          HB2       SER   2  18.173 -11.732   5.111
    9   2HB   SER   2          HB3       SER   2  17.408 -12.879   4.005
   10    HG   SER   2           HG       SER   2  18.081 -11.204   2.757
   11    H    HIS   3           H        HIS   3  15.023  -9.489   4.526
   12    HA   HIS   3           HA       HIS   3  15.735  -8.086   7.086
   13   1HB   HIS   3          HB2       HIS   3  16.032  -7.141   4.214
   14   2HB   HIS   3          HB3       HIS   3  16.208  -6.103   5.620
   15    HD1  HIS   3           HD1      HIS   3  18.010  -9.153   4.049
   16    HD2  HIS   3           HD2      HIS   3  18.511  -6.088   6.877
   17    HE1  HIS   3           HE1      HIS   3  20.460  -9.203   4.722
   18    H    MET   4           H        MET   4  13.121  -8.810   5.003
   19    HA   MET   4           HA       MET   4  11.365  -6.979   6.495
   20   1HB   MET   4          HB2       MET   4  11.670  -6.962   3.464
   21   2HB   MET   4          HB3       MET   4  10.161  -6.479   4.233
   22   1HG   MET   4          HG2       MET   4  12.826  -5.167   4.748
   23   2HG   MET   4          HG3       MET   4  11.563  -4.569   3.667
   24   1HE   MET   4          HE1       MET   4  11.457  -1.961   6.589
   25   2HE   MET   4          HE2       MET   4  12.904  -2.800   5.987
   26   3HE   MET   4          HE3       MET   4  11.676  -2.213   4.844
   27    HA   PRO   5           HA       PRO   5   8.854 -10.642   6.330
   28   1HB   PRO   5          HB2       PRO   5   6.457  -9.742   7.229
   29   2HB   PRO   5          HB3       PRO   5   7.924  -9.722   8.252
   30   1HG   PRO   5          HG2       PRO   5   6.793  -7.441   6.599
   31   2HG   PRO   5          HG3       PRO   5   7.242  -7.427   8.337
   32   1HD   PRO   5          HD2       PRO   5   8.936  -6.556   6.383
   33   2HD   PRO   5          HD3       PRO   5   9.539  -7.421   7.828
   34    H    LEU   6           H        LEU   6   8.453  -8.247   3.988
   35    HA   LEU   6           HA       LEU   6   6.306  -9.741   2.527
   36   1HB   LEU   6          HB2       LEU   6   6.789  -6.741   2.705
   37   2HB   LEU   6          HB3       LEU   6   5.618  -7.515   1.637
   38    HG   LEU   6           HG       LEU   6   5.466  -7.714   4.673
   39   1HD1  LEU   6          HD11      LEU   6   4.059  -5.828   2.746
   40   2HD1  LEU   6          HD12      LEU   6   3.700  -6.001   4.483
   41   3HD1  LEU   6          HD13      LEU   6   5.272  -5.379   3.963
   42   1HD2  LEU   6          HD21      LEU   6   3.102  -8.318   4.192
   43   2HD2  LEU   6          HD22      LEU   6   3.449  -8.292   2.452
   44   3HD2  LEU   6          HD23      LEU   6   4.230  -9.497   3.505
   45    H    GLU   7           H        GLU   7   6.696 -10.194   0.449
   46    HA   GLU   7           HA       GLU   7   9.020  -9.040  -1.007
   47   1HB   GLU   7          HB2       GLU   7  10.063 -11.209  -1.352
   48   2HB   GLU   7          HB3       GLU   7   9.980 -10.798   0.356
   49   1HG   GLU   7          HG2       GLU   7   7.921 -12.293   0.534
   50   2HG   GLU   7          HG3       GLU   7   8.230 -12.802  -1.123
   51    H    PHE   8           H        PHE   8   6.053 -10.991  -1.174
   52    HA   PHE   8           HA       PHE   8   6.119 -11.657  -3.901
   53   1HB   PHE   8          HB2       PHE   8   3.662 -10.915  -2.279
   54   2HB   PHE   8          HB3       PHE   8   3.727 -11.966  -3.693
   55    HD1  PHE   8           HD1      PHE   8   5.410 -14.054  -3.452
   56    HD2  PHE   8           HD2      PHE   8   3.598 -11.936  -0.161
   57    HE1  PHE   8           HE1      PHE   8   5.797 -16.011  -1.973
   58    HE2  PHE   8           HE2      PHE   8   3.989 -13.891   1.311
   59    HZ   PHE   8           HZ       PHE   8   5.091 -15.931   0.410
   60    H    LEU   9           H        LEU   9   5.249  -8.579  -2.419
   61    HA   LEU   9           HA       LEU   9   4.328  -7.319  -4.845
   62   1HB   LEU   9          HB2       LEU   9   4.222  -5.308  -3.649
   63   2HB   LEU   9          HB3       LEU   9   3.631  -6.586  -2.608
   64    HG   LEU   9           HG       LEU   9   6.319  -5.161  -2.388
   65   1HD1  LEU   9          HD11      LEU   9   3.898  -5.207  -0.534
   66   2HD1  LEU   9          HD12      LEU   9   5.398  -4.287  -0.301
   67   3HD1  LEU   9          HD13      LEU   9   4.309  -3.883  -1.644
   68   1HD2  LEU   9          HD21      LEU   9   5.117  -7.389  -0.704
   69   2HD2  LEU   9          HD22      LEU   9   6.642  -7.451  -1.624
   70   3HD2  LEU   9          HD23      LEU   9   6.520  -6.392  -0.216
   71    H    ARG  10           H        ARG  10   7.492  -7.510  -3.245
   72    HA   ARG  10           HA       ARG  10   8.845  -5.541  -4.882
   73   1HB   ARG  10          HB2       ARG  10   9.886  -7.778  -3.081
   74   2HB   ARG  10          HB3       ARG  10  10.900  -6.560  -3.866
   75   1HG   ARG  10          HG2       ARG  10   9.504  -4.780  -2.740
   76   2HG   ARG  10          HG3       ARG  10   8.736  -6.043  -1.776
   77   1HD   ARG  10          HD2       ARG  10  11.745  -5.604  -1.887
   78   2HD   ARG  10          HD3       ARG  10  10.699  -4.782  -0.734
   79    HE   ARG  10           HE       ARG  10  10.002  -7.056   0.109
   80   1HH1  ARG  10          HH12      ARG  10  13.194  -6.753  -1.337
   81   2HH1  ARG  10          HH11      ARG  10  13.822  -8.073  -0.376
   82   1HH2  ARG  10          HH22      ARG  10  10.830  -8.639   1.246
   83   2HH2  ARG  10          HH21      ARG  10  12.506  -9.134   1.060
   84    H    ASN  11           H        ASN  11   8.237  -8.938  -5.289
   85    HA   ASN  11           HA       ASN  11   9.999  -9.509  -7.455
   86   1HB   ASN  11          HB2       ASN  11   8.825 -11.200  -6.124
   87   2HB   ASN  11          HB3       ASN  11   7.258 -10.585  -6.663
   88   1HD2  ASN  11          HD21      ASN  11  10.217 -12.256  -7.795
   89   2HD2  ASN  11          HD22      ASN  11   9.406 -12.994  -9.175
   90    H    GLN  12           H        GLN  12   7.161  -7.444  -7.447
   91    HA   GLN  12           HA       GLN  12   6.699  -7.879 -10.340
   92   1HB   GLN  12          HB2       GLN  12   4.956  -6.850  -8.073
   93   2HB   GLN  12          HB3       GLN  12   4.433  -6.905  -9.747
   94   1HG   GLN  12          HG2       GLN  12   5.355  -9.374  -8.197
   95   2HG   GLN  12          HG3       GLN  12   3.684  -8.840  -8.321
   96   1HE2  GLN  12          HE21      GLN  12   5.914 -10.960  -9.767
   97   2HE2  GLN  12          HE22      GLN  12   5.102 -11.091 -11.315
   98    HA   PRO  13           HA       PRO  13   7.604  -3.674 -11.605
   99   1HB   PRO  13          HB2       PRO  13   4.947  -3.770 -13.026
  100   2HB   PRO  13          HB3       PRO  13   6.546  -3.273 -13.654
  101   1HG   PRO  13          HG2       PRO  13   5.538  -5.703 -14.272
  102   2HG   PRO  13          HG3       PRO  13   7.266  -5.544 -13.814
  103   1HD   PRO  13          HD2       PRO  13   4.937  -6.406 -12.086
  104   2HD   PRO  13          HD3       PRO  13   6.557  -7.153 -12.267
  105    H    GLN  14           H        GLN  14   4.536  -4.348  -9.990
  106    HA   GLN  14           HA       GLN  14   3.544  -1.668  -9.961
  107   1HB   GLN  14          HB2       GLN  14   2.221  -3.775  -9.707
  108   2HB   GLN  14          HB3       GLN  14   2.870  -3.957  -8.072
  109   1HG   GLN  14          HG2       GLN  14   1.812  -1.815  -7.408
  110   2HG   GLN  14          HG3       GLN  14   1.298  -1.540  -9.072
  111   1HE2  GLN  14          HE21      GLN  14  -0.930  -1.803  -9.142
  112   2HE2  GLN  14          HE22      GLN  14  -1.767  -3.164  -8.409
  113    H    PHE  15           H        PHE  15   5.562  -3.417  -7.576
  114    HA   PHE  15           HA       PHE  15   5.294  -1.485  -5.431
  115   1HB   PHE  15          HB2       PHE  15   5.939  -3.767  -4.992
  116   2HB   PHE  15          HB3       PHE  15   7.324  -3.653  -6.081
  117    HD1  PHE  15           HD1      PHE  15   5.984  -2.614  -2.771
  118    HD2  PHE  15           HD2      PHE  15   9.433  -2.705  -5.354
  119    HE1  PHE  15           HE1      PHE  15   7.440  -2.040  -0.848
  120    HE2  PHE  15           HE2      PHE  15  10.882  -2.096  -3.434
  121    HZ   PHE  15           HZ       PHE  15   9.893  -1.770  -1.178
  122    H    GLN  16           H        GLN  16   7.350  -1.732  -8.225
  123    HA   GLN  16           HA       GLN  16   9.295   0.294  -7.524
  124   1HB   GLN  16          HB2       GLN  16   8.419  -1.116 -10.062
  125   2HB   GLN  16          HB3       GLN  16   9.763   0.044 -10.031
  126   1HG   GLN  16          HG2       GLN  16  11.005  -1.349  -8.466
  127   2HG   GLN  16          HG3       GLN  16   9.641  -2.443  -8.253
  128   1HE2  GLN  16          HE21      GLN  16   9.343  -4.156  -9.726
  129   2HE2  GLN  16          HE22      GLN  16  10.426  -4.394 -11.093
  130    H    GLN  17           H        GLN  17   5.996   0.594  -8.371
  131    HA   GLN  17           HA       GLN  17   6.355   3.387  -9.405
  132   1HB   GLN  17          HB2       GLN  17   4.348   1.242 -10.201
  133   2HB   GLN  17          HB3       GLN  17   4.363   2.913 -10.791
  134   1HG   GLN  17          HG2       GLN  17   6.611   2.555 -11.767
  135   2HG   GLN  17          HG3       GLN  17   6.618   0.890 -11.196
  136   1HE2  GLN  17          HE21      GLN  17   5.421  -0.692 -12.279
  137   2HE2  GLN  17          HE22      GLN  17   4.595  -0.364 -13.810
  138    H    MET  18           H        MET  18   3.966   1.272  -7.633
  139    HA   MET  18           HA       MET  18   2.112   3.316  -7.128
  140   1HB   MET  18          HB2       MET  18   1.142   1.827  -5.560
  141   2HB   MET  18          HB3       MET  18   1.701   0.917  -6.959
  142   1HG   MET  18          HG2       MET  18   3.748   0.236  -5.621
  143   2HG   MET  18          HG3       MET  18   3.069   1.082  -4.231
  144   1HE   MET  18          HE1       MET  18   3.967  -1.733  -3.626
  145   2HE   MET  18          HE2       MET  18   2.995  -0.752  -2.503
  146   3HE   MET  18          HE3       MET  18   2.531  -2.432  -2.845
  147    H    ARG  19           H        ARG  19   4.966   2.497  -5.202
  148    HA   ARG  19           HA       ARG  19   4.413   4.217  -2.961
  149   1HB   ARG  19          HB2       ARG  19   7.115   3.352  -4.102
  150   2HB   ARG  19          HB3       ARG  19   6.776   3.899  -2.455
  151   1HG   ARG  19          HG2       ARG  19   5.183   1.941  -2.236
  152   2HG   ARG  19          HG3       ARG  19   5.782   1.317  -3.764
  153   1HD   ARG  19          HD2       ARG  19   7.672   1.997  -1.494
  154   2HD   ARG  19          HD3       ARG  19   6.973   0.377  -1.715
  155    HE   ARG  19           HE       ARG  19   7.975   0.566  -4.089
  156   1HH1  ARG  19          HH12      ARG  19   9.683   1.778  -1.258
  157   2HH1  ARG  19          HH11      ARG  19  11.185   1.901  -2.133
  158   1HH2  ARG  19          HH22      ARG  19   9.921   0.506  -5.019
  159   2HH2  ARG  19          HH21      ARG  19  11.353   1.021  -4.150
  160    H    GLN  20           H        GLN  20   5.846   4.854  -6.093
  161    HA   GLN  20           HA       GLN  20   6.977   7.457  -5.526
  162   1HB   GLN  20          HB2       GLN  20   5.768   6.533  -8.167
  163   2HB   GLN  20          HB3       GLN  20   6.819   7.907  -7.898
  164   1HG   GLN  20          HG2       GLN  20   8.638   6.315  -7.142
  165   2HG   GLN  20          HG3       GLN  20   7.581   4.973  -7.596
  166   1HE2  GLN  20          HE21      GLN  20   8.666   4.120  -9.450
  167   2HE2  GLN  20          HE22      GLN  20   9.051   5.125 -10.840
  168    H    ILE  21           H        ILE  21   3.735   6.359  -6.456
  169    HA   ILE  21           HA       ILE  21   2.514   8.873  -6.848
  170    HB   ILE  21           HB       ILE  21   1.094   6.403  -5.749
  171   1HG1  ILE  21          HG12      ILE  21   1.997   6.937  -8.595
  172   2HG1  ILE  21          HG13      ILE  21   2.492   5.606  -7.555
  173   1HG2  ILE  21          HG21      ILE  21  -0.821   7.306  -6.965
  174   2HG2  ILE  21          HG22      ILE  21  -0.180   8.554  -5.904
  175   3HG2  ILE  21          HG23      ILE  21   0.183   8.609  -7.642
  176   1HD1  ILE  21          HD11      ILE  21  -0.269   5.941  -8.740
  177   2HD1  ILE  21          HD12      ILE  21   0.952   4.709  -9.109
  178   3HD1  ILE  21          HD13      ILE  21   0.181   4.716  -7.519
  179    H    ILE  22           H        ILE  22   2.829   6.821  -3.977
  180    HA   ILE  22           HA       ILE  22   1.322   8.542  -2.190
  181    HB   ILE  22           HB       ILE  22   3.267   6.315  -1.480
  182   1HG1  ILE  22          HG12      ILE  22   1.723   5.173  -2.818
  183   2HG1  ILE  22          HG13      ILE  22   1.094   4.954  -1.202
  184   1HG2  ILE  22          HG21      ILE  22   2.669   7.730   0.456
  185   2HG2  ILE  22          HG22      ILE  22   0.941   7.490   0.095
  186   3HG2  ILE  22          HG23      ILE  22   1.961   6.125   0.589
  187   1HD1  ILE  22          HD11      ILE  22  -0.005   6.753  -3.375
  188   2HD1  ILE  22          HD12      ILE  22  -0.778   5.393  -2.545
  189   3HD1  ILE  22          HD13      ILE  22  -0.488   6.914  -1.670
  190    H    GLN  23           H        GLN  23   4.757   8.184  -2.912
  191    HA   GLN  23           HA       GLN  23   5.755  10.029  -0.959
  192   1HB   GLN  23          HB2       GLN  23   6.804   8.770  -3.500
  193   2HB   GLN  23          HB3       GLN  23   7.780   9.934  -2.586
  194   1HG   GLN  23          HG2       GLN  23   7.687   8.558  -0.579
  195   2HG   GLN  23          HG3       GLN  23   6.557   7.436  -1.335
  196   1HE2  GLN  23          HE21      GLN  23   7.887   5.608  -1.061
  197   2HE2  GLN  23          HE22      GLN  23   9.466   5.462  -1.801
  198    H    GLN  24           H        GLN  24   3.712  10.806  -3.432
  199    HA   GLN  24           HA       GLN  24   4.566  13.683  -3.306
  200   1HB   GLN  24          HB2       GLN  24   3.093  12.384  -5.629
  201   2HB   GLN  24          HB3       GLN  24   3.644  14.064  -5.508
  202   1HG   GLN  24          HG2       GLN  24   5.999  13.216  -5.409
  203   2HG   GLN  24          HG3       GLN  24   5.363  11.574  -5.631
  204   1HE2  GLN  24          HE21      GLN  24   7.270  12.626  -7.429
  205   2HE2  GLN  24          HE22      GLN  24   6.472  12.892  -8.975
  206    H    ASN  25           H        ASN  25   1.923  11.364  -3.507
  207    HA   ASN  25           HA       ASN  25   0.133  13.251  -2.028
  208   1HB   ASN  25          HB2       ASN  25  -0.420  11.594  -4.469
  209   2HB   ASN  25          HB3       ASN  25  -1.701  11.787  -3.267
  210   1HD2  ASN  25          HD21      ASN  25  -2.163  14.023  -2.485
  211   2HD2  ASN  25          HD22      ASN  25  -2.128  15.281  -3.722
  212    HA   PRO  26           HA       PRO  26   0.758   9.556   0.660
  213   1HB   PRO  26          HB2       PRO  26   0.768  10.895   3.053
  214   2HB   PRO  26          HB3       PRO  26   2.214  10.699   2.012
  215   1HG   PRO  26          HG2       PRO  26   0.320  13.061   2.123
  216   2HG   PRO  26          HG3       PRO  26   2.115  13.078   2.218
  217   1HD   PRO  26          HD2       PRO  26   0.804  13.566  -0.074
  218   2HD   PRO  26          HD3       PRO  26   2.299  12.577  -0.099
  219    H    SER  27           H        SER  27  -1.617  12.119   0.528
  220    HA   SER  27           HA       SER  27  -3.733  11.091   2.106
  221   1HB   SER  27          HB2       SER  27  -5.150  12.400   0.488
  222   2HB   SER  27          HB3       SER  27  -3.831  13.310   1.237
  223    HG   SER  27           HG       SER  27  -4.067  13.580  -1.077
  224    H    LEU  28           H        LEU  28  -2.418   9.813  -0.870
  225    HA   LEU  28           HA       LEU  28  -4.831   8.145  -1.345
  226   1HB   LEU  28          HB2       LEU  28  -2.344   8.567  -3.036
  227   2HB   LEU  28          HB3       LEU  28  -3.743   7.586  -3.474
  228    HG   LEU  28           HG       LEU  28  -3.663  10.609  -3.168
  229   1HD1  LEU  28          HD11      LEU  28  -4.245  10.532  -5.558
  230   2HD1  LEU  28          HD12      LEU  28  -2.750   9.625  -5.258
  231   3HD1  LEU  28          HD13      LEU  28  -4.281   8.753  -5.502
  232   1HD2  LEU  28          HD21      LEU  28  -6.028  10.579  -3.941
  233   2HD2  LEU  28          HD22      LEU  28  -6.067   8.814  -3.727
  234   3HD2  LEU  28          HD23      LEU  28  -5.849   9.895  -2.327
  235    H    LEU  29           H        LEU  29  -2.246   7.742   0.667
  236    HA   LEU  29           HA       LEU  29  -1.405   5.086   0.130
  237   1HB   LEU  29          HB2       LEU  29  -0.340   6.505   1.771
  238   2HB   LEU  29          HB3       LEU  29  -1.755   6.575   2.768
  239    HG   LEU  29           HG       LEU  29  -1.603   4.181   3.297
  240   1HD1  LEU  29          HD11      LEU  29  -0.614   3.240   1.280
  241   2HD1  LEU  29          HD12      LEU  29   0.850   4.224   1.492
  242   3HD1  LEU  29          HD13      LEU  29   0.469   2.915   2.640
  243   1HD2  LEU  29          HD21      LEU  29   1.043   5.643   3.662
  244   2HD2  LEU  29          HD22      LEU  29  -0.396   5.811   4.689
  245   3HD2  LEU  29          HD23      LEU  29   0.462   4.264   4.626
  246    HA   PRO  30           HA       PRO  30  -5.450   3.547   2.547
  247   1HB   PRO  30          HB2       PRO  30  -7.215   5.835   1.679
  248   2HB   PRO  30          HB3       PRO  30  -7.281   4.876   3.169
  249   1HG   PRO  30          HG2       PRO  30  -6.254   7.445   2.878
  250   2HG   PRO  30          HG3       PRO  30  -5.791   6.321   4.205
  251   1HD   PRO  30          HD2       PRO  30  -4.193   7.241   1.922
  252   2HD   PRO  30          HD3       PRO  30  -3.682   6.333   3.364
  253    H    ALA  31           H        ALA  31  -5.816   5.700  -0.226
  254    HA   ALA  31           HA       ALA  31  -7.565   4.045  -1.739
  255   1HB   ALA  31          HB1       ALA  31  -5.777   6.314  -2.693
  256   2HB   ALA  31          HB2       ALA  31  -7.295   5.747  -3.418
  257   3HB   ALA  31          HB3       ALA  31  -7.310   6.531  -1.817
  258    H    LEU  32           H        LEU  32  -4.183   3.565  -1.256
  259    HA   LEU  32           HA       LEU  32  -3.899   2.023  -3.798
  260   1HB   LEU  32          HB2       LEU  32  -2.086   3.556  -3.272
  261   2HB   LEU  32          HB3       LEU  32  -1.993   2.899  -1.624
  262    HG   LEU  32           HG       LEU  32  -1.134   0.789  -2.439
  263   1HD1  LEU  32          HD11      LEU  32  -0.553   0.440  -4.809
  264   2HD1  LEU  32          HD12      LEU  32  -2.287   0.633  -4.615
  265   3HD1  LEU  32          HD13      LEU  32  -1.322   1.996  -5.233
  266   1HD2  LEU  32          HD21      LEU  32   0.375   3.110  -3.715
  267   2HD2  LEU  32          HD22      LEU  32   0.392   2.706  -1.984
  268   3HD2  LEU  32          HD23      LEU  32   1.068   1.574  -3.160
  269    H    LEU  33           H        LEU  33  -3.741   1.728  -0.230
  270    HA   LEU  33           HA       LEU  33  -3.501  -1.111  -0.047
  271   1HB   LEU  33          HB2       LEU  33  -4.892   0.947   1.708
  272   2HB   LEU  33          HB3       LEU  33  -4.608  -0.728   2.186
  273    HG   LEU  33           HG       LEU  33  -2.242   0.967   1.326
  274   1HD1  LEU  33          HD11      LEU  33  -1.959   1.702   3.650
  275   2HD1  LEU  33          HD12      LEU  33  -3.430   2.354   2.910
  276   3HD1  LEU  33          HD13      LEU  33  -3.550   1.006   4.069
  277   1HD2  LEU  33          HD21      LEU  33  -2.595  -1.276   3.358
  278   2HD2  LEU  33          HD22      LEU  33  -1.923  -1.449   1.723
  279   3HD2  LEU  33          HD23      LEU  33  -1.068  -0.475   2.930
  280    H    GLN  34           H        GLN  34  -6.440   0.970  -0.290
  281    HA   GLN  34           HA       GLN  34  -8.326  -1.154  -0.395
  282   1HB   GLN  34          HB2       GLN  34  -8.725   1.301   0.005
  283   2HB   GLN  34          HB3       GLN  34  -8.538   1.587  -1.719
  284   1HG   GLN  34          HG2       GLN  34 -10.591  -0.316  -0.491
  285   2HG   GLN  34          HG3       GLN  34 -10.913   1.387  -0.763
  286   1HE2  GLN  34          HE21      GLN  34 -12.437  -0.794  -1.911
  287   2HE2  GLN  34          HE22      GLN  34 -12.260  -0.627  -3.653
  288    H    GLN  35           H        GLN  35  -6.121   0.090  -2.914
  289    HA   GLN  35           HA       GLN  35  -7.649  -1.160  -5.062
  290   1HB   GLN  35          HB2       GLN  35  -6.261   1.020  -5.113
  291   2HB   GLN  35          HB3       GLN  35  -4.834  -0.004  -5.241
  292   1HG   GLN  35          HG2       GLN  35  -7.269  -0.079  -7.065
  293   2HG   GLN  35          HG3       GLN  35  -5.818   0.893  -7.386
  294   1HE2  GLN  35          HE21      GLN  35  -3.707  -0.889  -6.884
  295   2HE2  GLN  35          HE22      GLN  35  -3.920  -2.331  -7.876
  296    H    ILE  36           H        ILE  36  -4.659  -1.866  -3.219
  297    HA   ILE  36           HA       ILE  36  -4.085  -4.397  -4.450
  298    HB   ILE  36           HB       ILE  36  -3.699  -3.487  -1.600
  299   1HG1  ILE  36          HG12      ILE  36  -1.623  -3.635  -3.838
  300   2HG1  ILE  36          HG13      ILE  36  -2.522  -2.161  -3.491
  301   1HG2  ILE  36          HG21      ILE  36  -3.625  -5.997  -1.824
  302   2HG2  ILE  36          HG22      ILE  36  -2.500  -5.852  -3.169
  303   3HG2  ILE  36          HG23      ILE  36  -2.007  -5.378  -1.527
  304   1HD1  ILE  36          HD11      ILE  36  -0.626  -3.576  -1.611
  305   2HD1  ILE  36          HD12      ILE  36  -0.440  -1.983  -2.368
  306   3HD1  ILE  36          HD13      ILE  36  -1.693  -2.228  -1.131
  307    H    GLY  37           H        GLY  37  -6.322  -3.498  -1.726
  308   1HA   GLY  37          HA2       GLY  37  -7.604  -5.992  -1.453
  309   2HA   GLY  37          HA3       GLY  37  -8.274  -4.412  -1.041
  310    H    ARG  38           H        ARG  38  -7.718  -4.176  -4.323
  311    HA   ARG  38           HA       ARG  38 -10.307  -5.438  -5.089
  312   1HB   ARG  38          HB2       ARG  38 -11.014  -3.685  -6.226
  313   2HB   ARG  38          HB3       ARG  38  -9.987  -2.797  -5.109
  314   1HG   ARG  38          HG2       ARG  38  -8.243  -2.604  -6.817
  315   2HG   ARG  38          HG3       ARG  38  -9.191  -3.595  -7.936
  316   1HD   ARG  38          HD2       ARG  38  -9.466  -1.355  -8.583
  317   2HD   ARG  38          HD3       ARG  38 -11.000  -1.901  -7.910
  318    HE   ARG  38           HE       ARG  38  -9.989  -0.698  -5.730
  319   1HH1  ARG  38          HH22      ARG  38 -10.031   0.517  -9.028
  320   2HH1  ARG  38          HH21      ARG  38 -10.013   2.184  -8.500
  321   1HH2  ARG  38          HH12      ARG  38  -9.996   1.417  -5.150
  322   2HH2  ARG  38          HH11      ARG  38  -9.980   2.681  -6.359
  323    H    GLU  39           H        GLU  39  -7.037  -5.868  -5.492
  324    HA   GLU  39           HA       GLU  39  -7.579  -7.616  -7.863
  325   1HB   GLU  39          HB2       GLU  39  -5.654  -7.000  -8.995
  326   2HB   GLU  39          HB3       GLU  39  -6.437  -5.483  -8.526
  327   1HG   GLU  39          HG2       GLU  39  -4.843  -5.239  -6.660
  328   2HG   GLU  39          HG3       GLU  39  -4.058  -6.757  -7.111
  329    H    ASN  40           H        ASN  40  -5.806  -7.223  -4.871
  330    HA   ASN  40           HA       ASN  40  -5.427 -10.126  -4.743
  331   1HB   ASN  40          HB2       ASN  40  -3.261  -8.965  -5.665
  332   2HB   ASN  40          HB3       ASN  40  -3.065  -8.340  -4.050
  333   1HD2  ASN  40          HD21      ASN  40  -1.416 -10.317  -5.566
  334   2HD2  ASN  40          HD22      ASN  40  -1.432 -11.774  -4.572
  335    HA   PRO  41           HA       PRO  41  -7.242  -8.252  -0.823
  336   1HB   PRO  41          HB2       PRO  41  -8.481 -10.992  -1.097
  337   2HB   PRO  41          HB3       PRO  41  -9.174  -9.505  -0.371
  338   1HG   PRO  41          HG2       PRO  41  -9.872 -10.169  -2.864
  339   2HG   PRO  41          HG3       PRO  41  -9.390  -8.471  -2.531
  340   1HD   PRO  41          HD2       PRO  41  -7.717 -10.709  -3.689
  341   2HD   PRO  41          HD3       PRO  41  -7.908  -9.025  -4.289
  342    H    GLN  42           H        GLN  42  -5.641 -11.330  -1.624
  343    HA   GLN  42           HA       GLN  42  -5.040 -12.123   1.095
  344   1HB   GLN  42          HB2       GLN  42  -3.567 -12.933  -1.438
  345   2HB   GLN  42          HB3       GLN  42  -3.638 -13.799   0.102
  346   1HG   GLN  42          HG2       GLN  42  -6.135 -14.039  -0.238
  347   2HG   GLN  42          HG3       GLN  42  -5.931 -13.338  -1.847
  348   1HE2  GLN  42          HE21      GLN  42  -4.509 -14.551  -3.422
  349   2HE2  GLN  42          HE22      GLN  42  -4.394 -16.296  -3.231
  350    H    LEU  43           H        LEU  43  -3.079 -10.537  -1.491
  351    HA   LEU  43           HA       LEU  43  -0.775 -10.017   0.113
  352   1HB   LEU  43          HB2       LEU  43  -0.968  -9.791  -2.423
  353   2HB   LEU  43          HB3       LEU  43  -1.930  -8.339  -2.150
  354    HG   LEU  43           HG       LEU  43  -0.096  -7.152  -1.205
  355   1HD1  LEU  43          HD11      LEU  43   2.206  -8.127  -1.073
  356   2HD1  LEU  43          HD12      LEU  43   1.085  -8.852   0.080
  357   3HD1  LEU  43          HD13      LEU  43   1.512  -9.735  -1.404
  358   1HD2  LEU  43          HD21      LEU  43  -0.260  -7.296  -3.673
  359   2HD2  LEU  43          HD22      LEU  43   1.405  -7.065  -3.124
  360   3HD2  LEU  43          HD23      LEU  43   0.865  -8.672  -3.660
  361    H    LEU  44           H        LEU  44  -3.864  -8.365  -0.225
  362    HA   LEU  44           HA       LEU  44  -3.077  -5.939   1.116
  363   1HB   LEU  44          HB2       LEU  44  -5.138  -6.361  -0.339
  364   2HB   LEU  44          HB3       LEU  44  -5.884  -7.148   1.012
  365    HG   LEU  44           HG       LEU  44  -6.264  -4.597   0.406
  366   1HD1  LEU  44          HD11      LEU  44  -7.113  -4.172   2.590
  367   2HD1  LEU  44          HD12      LEU  44  -7.496  -5.814   2.067
  368   3HD1  LEU  44          HD13      LEU  44  -6.195  -5.547   3.268
  369   1HD2  LEU  44          HD21      LEU  44  -4.095  -4.293   2.526
  370   2HD2  LEU  44          HD22      LEU  44  -3.944  -3.820   0.810
  371   3HD2  LEU  44          HD23      LEU  44  -5.132  -3.030   1.859
  372    H    GLN  45           H        GLN  45  -5.005  -8.662   2.273
  373    HA   GLN  45           HA       GLN  45  -4.863  -8.156   5.061
  374   1HB   GLN  45          HB2       GLN  45  -5.064 -10.784   3.547
  375   2HB   GLN  45          HB3       GLN  45  -5.173 -10.682   5.299
  376   1HG   GLN  45          HG2       GLN  45  -7.033  -9.261   3.347
  377   2HG   GLN  45          HG3       GLN  45  -7.407 -10.740   4.233
  378   1HE2  GLN  45          HE21      GLN  45  -8.512  -7.801   4.260
  379   2HE2  GLN  45          HE22      GLN  45  -8.562  -7.460   5.985
  380    H    GLN  46           H        GLN  46  -2.306  -9.668   3.043
  381    HA   GLN  46           HA       GLN  46  -0.589 -10.352   5.288
  382   1HB   GLN  46          HB2       GLN  46  -0.205  -9.923   2.305
  383   2HB   GLN  46          HB3       GLN  46   1.163 -10.194   3.375
  384   1HG   GLN  46          HG2       GLN  46   0.278 -12.359   4.072
  385   2HG   GLN  46          HG3       GLN  46  -1.227 -12.089   3.208
  386   1HE2  GLN  46          HE21      GLN  46  -0.447 -14.335   2.350
  387   2HE2  GLN  46          HE22      GLN  46   0.535 -14.256   0.886
  388    H    ILE  47           H        ILE  47  -0.710  -7.486   3.099
  389    HA   ILE  47           HA       ILE  47   1.322  -5.974   4.396
  390    HB   ILE  47           HB       ILE  47  -1.056  -5.265   2.675
  391   1HG1  ILE  47          HG12      ILE  47   1.951  -4.955   2.265
  392   2HG1  ILE  47          HG13      ILE  47   1.078  -6.427   1.830
  393   1HG2  ILE  47          HG21      ILE  47   0.897  -3.341   3.998
  394   2HG2  ILE  47          HG22      ILE  47  -0.082  -2.922   2.578
  395   3HG2  ILE  47          HG23      ILE  47  -0.876  -3.322   4.097
  396   1HD1  ILE  47          HD11      ILE  47  -0.380  -5.105   0.312
  397   2HD1  ILE  47          HD12      ILE  47   0.641  -3.677   0.627
  398   3HD1  ILE  47          HD13      ILE  47   1.339  -5.112  -0.145
  399    H    SER  48           H        SER  48  -2.173  -6.256   5.146
  400    HA   SER  48           HA       SER  48  -2.196  -4.365   7.297
  401   1HB   SER  48          HB2       SER  48  -3.933  -6.820   6.852
  402   2HB   SER  48          HB3       SER  48  -4.228  -5.571   8.074
  403    HG   SER  48           HG       SER  48  -5.393  -5.137   6.176
  404    H    GLN  49           H        GLN  49  -1.441  -7.853   7.294
  405    HA   GLN  49           HA       GLN  49  -1.067  -8.118  10.139
  406   1HB   GLN  49          HB2       GLN  49  -0.337  -9.740   7.688
  407   2HB   GLN  49          HB3       GLN  49   0.253 -10.222   9.278
  408   1HG   GLN  49          HG2       GLN  49  -1.986 -10.439  10.159
  409   2HG   GLN  49          HG3       GLN  49  -2.697  -9.719   8.715
  410   1HE2  GLN  49          HE21      GLN  49  -2.677 -10.934   6.727
  411   2HE2  GLN  49          HE22      GLN  49  -2.520 -12.699   6.766
  412    H    HIS  50           H        HIS  50   0.945  -6.602   7.794
  413    HA   HIS  50           HA       HIS  50   3.251  -6.534   9.693
  414   1HB   HIS  50          HB2       HIS  50   3.335  -7.038   6.692
  415   2HB   HIS  50          HB3       HIS  50   4.745  -6.828   7.738
  416    HD1  HIS  50           HD1      HIS  50   4.570  -8.802   9.966
  417    HD2  HIS  50           HD2      HIS  50   2.890  -9.549   6.186
  418    HE1  HIS  50           HE1      HIS  50   4.312 -11.323   9.784
  419    H    GLN  51           H        GLN  51   1.085  -4.526   9.028
  420    HA   GLN  51           HA       GLN  51   1.836  -2.780   7.083
  421   1HB   GLN  51          HB2       GLN  51  -0.354  -3.029   8.413
  422   2HB   GLN  51          HB3       GLN  51   0.338  -1.854   9.549
  423   1HG   GLN  51          HG2       GLN  51   0.589  -0.234   7.670
  424   2HG   GLN  51          HG3       GLN  51   0.002  -1.465   6.544
  425   1HE2  GLN  51          HE21      GLN  51  -1.786  -0.128   5.854
  426   2HE2  GLN  51          HE22      GLN  51  -3.152   0.144   6.937
  427    H    GLU  52           H        GLU  52   2.999  -2.627  10.434
  428    HA   GLU  52           HA       GLU  52   4.242  -0.050  10.276
  429   1HB   GLU  52          HB2       GLU  52   5.451  -0.690  12.259
  430   2HB   GLU  52          HB3       GLU  52   3.766  -1.183  12.384
  431   1HG   GLU  52          HG2       GLU  52   4.448  -3.527  11.764
  432   2HG   GLU  52          HG3       GLU  52   6.128  -3.002  11.749
  433    H    HIS  53           H        HIS  53   5.300  -3.156   9.002
  434    HA   HIS  53           HA       HIS  53   8.006  -2.139   8.329
  435   1HB   HIS  53          HB2       HIS  53   6.592  -4.768   7.714
  436   2HB   HIS  53          HB3       HIS  53   8.212  -4.345   7.183
  437    HD1  HIS  53           HD1      HIS  53   6.363  -5.437  10.342
  438    HD2  HIS  53           HD2      HIS  53  10.188  -4.301   9.022
  439    HE1  HIS  53           HE1      HIS  53   7.980  -6.081  12.198
  440    H    PHE  54           H        PHE  54   4.877  -2.922   6.736
  441    HA   PHE  54           HA       PHE  54   5.697  -2.456   4.049
  442   1HB   PHE  54          HB2       PHE  54   3.552  -3.498   4.549
  443   2HB   PHE  54          HB3       PHE  54   2.998  -2.037   5.374
  444    HD1  PHE  54           HD1      PHE  54   1.889  -0.312   4.184
  445    HD2  PHE  54           HD2      PHE  54   4.152  -3.272   2.012
  446    HE1  PHE  54           HE1      PHE  54   1.053   0.617   2.038
  447    HE2  PHE  54           HE2      PHE  54   3.308  -2.335  -0.128
  448    HZ   PHE  54           HZ       PHE  54   1.759  -0.394  -0.116
  449    H    ILE  55           H        ILE  55   4.307  -0.123   6.416
  450    HA   ILE  55           HA       ILE  55   4.300   2.107   4.690
  451    HB   ILE  55           HB       ILE  55   4.298   1.831   7.648
  452   1HG1  ILE  55          HG12      ILE  55   2.270   2.749   5.543
  453   2HG1  ILE  55          HG13      ILE  55   2.346   1.126   6.234
  454   1HG2  ILE  55          HG21      ILE  55   5.409   4.012   7.221
  455   2HG2  ILE  55          HG22      ILE  55   4.086   4.466   6.118
  456   3HG2  ILE  55          HG23      ILE  55   3.794   4.243   7.856
  457   1HD1  ILE  55          HD11      ILE  55   1.898   2.100   8.486
  458   2HD1  ILE  55          HD12      ILE  55   1.627   3.679   7.691
  459   3HD1  ILE  55          HD13      ILE  55   0.581   2.302   7.305
  460    H    GLN  56           H        GLN  56   7.060   0.735   6.503
  461    HA   GLN  56           HA       GLN  56   8.796   3.026   5.946
  462   1HB   GLN  56          HB2       GLN  56   9.419   0.165   6.796
  463   2HB   GLN  56          HB3       GLN  56  10.620   1.439   6.637
  464   1HG   GLN  56          HG2       GLN  56   8.241   1.546   8.545
  465   2HG   GLN  56          HG3       GLN  56   9.873   1.061   8.985
  466   1HE2  GLN  56          HE21      GLN  56  11.602   2.721   8.955
  467   2HE2  GLN  56          HE22      GLN  56  11.145   4.418   9.032
  468    H    MET  57           H        MET  57   8.223  -0.155   4.379
  469    HA   MET  57           HA       MET  57  10.198   0.110   2.295
  470   1HB   MET  57          HB2       MET  57   7.539  -1.386   2.306
  471   2HB   MET  57          HB3       MET  57   8.847  -1.610   1.139
  472   1HG   MET  57          HG2       MET  57  10.283  -2.582   2.774
  473   2HG   MET  57          HG3       MET  57   9.269  -2.051   4.108
  474   1HE   MET  57          HE1       MET  57   8.332  -5.606   1.301
  475   2HE   MET  57          HE2       MET  57   8.362  -3.940   0.687
  476   3HE   MET  57          HE3       MET  57   9.849  -4.681   1.334
  477    H    LEU  58           H        LEU  58   6.783   0.976   2.505
  478    HA   LEU  58           HA       LEU  58   6.230   2.198   0.039
  479   1HB   LEU  58          HB2       LEU  58   4.736   1.249   1.607
  480   2HB   LEU  58          HB3       LEU  58   5.271   2.327   2.879
  481    HG   LEU  58           HG       LEU  58   3.011   2.570   1.845
  482   1HD1  LEU  58          HD11      LEU  58   2.984   4.974   2.344
  483   2HD1  LEU  58          HD12      LEU  58   3.954   4.073   3.510
  484   3HD1  LEU  58          HD13      LEU  58   4.755   5.029   2.242
  485   1HD2  LEU  58          HD21      LEU  58   4.441   4.241  -0.258
  486   2HD2  LEU  58          HD22      LEU  58   3.734   2.629  -0.536
  487   3HD2  LEU  58          HD23      LEU  58   2.698   3.974  -0.056
  488    H    ASN  59           H        ASN  59   7.758   3.577   3.002
  489    HA   ASN  59           HA       ASN  59   7.703   6.303   1.905
  490   1HB   ASN  59          HB2       ASN  59   8.453   5.010   4.514
  491   2HB   ASN  59          HB3       ASN  59   9.273   6.507   4.100
  492   1HD2  ASN  59          HD21      ASN  59   6.146   5.112   4.853
  493   2HD2  ASN  59          HD22      ASN  59   5.327   6.666   5.074
  494    H    GLU  60           H        GLU  60  10.179   3.725   2.144
  495    HA   GLU  60           HA       GLU  60  12.359   5.486   1.627
  496   1HB   GLU  60          HB2       GLU  60  13.724   3.704   1.711
  497   2HB   GLU  60          HB3       GLU  60  12.339   3.081   2.593
  498   1HG   GLU  60          HG2       GLU  60  11.596   1.917   0.502
  499   2HG   GLU  60          HG3       GLU  60  13.046   2.523  -0.310
  500    HA   PRO  61           HA       PRO  61  11.910   6.483  -2.542
  501   1HB   PRO  61          HB2       PRO  61  14.429   7.120  -3.387
  502   2HB   PRO  61          HB3       PRO  61  13.526   8.062  -2.158
  503   1HG   PRO  61          HG2       PRO  61  15.611   5.917  -1.722
  504   2HG   PRO  61          HG3       PRO  61  15.513   7.539  -0.955
  505   1HD   PRO  61          HD2       PRO  61  14.604   5.270   0.255
  506   2HD   PRO  61          HD3       PRO  61  13.773   6.843   0.480
  507    H    VAL  62           H        VAL  62  12.013   5.844  -4.708
  508    HA   VAL  62           HA       VAL  62  12.916   3.171  -5.442
  509    HB   VAL  62           HB       VAL  62  12.205   3.872  -7.695
  510   1HG1  VAL  62          HG11      VAL  62  10.109   4.485  -5.576
  511   2HG1  VAL  62          HG12      VAL  62   9.830   3.977  -7.258
  512   3HG1  VAL  62          HG13      VAL  62  10.601   2.865  -6.125
  513   1HG2  VAL  62          HG21      VAL  62  12.721   6.304  -7.567
  514   2HG2  VAL  62          HG22      VAL  62  11.089   5.960  -8.139
  515   3HG2  VAL  62          HG23      VAL  62  11.334   6.525  -6.473
  516    H    GLN  63           H        GLN  63  14.256   2.956  -7.484
  517    HA   GLN  63           HA       GLN  63  16.890   3.981  -7.261
  518   1HB   GLN  63          HB2       GLN  63  17.230   3.069  -9.478
  519   2HB   GLN  63          HB3       GLN  63  16.467   1.921  -8.399
  520   1HG   GLN  63          HG2       GLN  63  14.685   3.548 -10.244
  521   2HG   GLN  63          HG3       GLN  63  15.711   2.299 -10.915
  522   1HE2  GLN  63          HE21      GLN  63  14.259   0.650 -11.438
  523   2HE2  GLN  63          HE22      GLN  63  13.156  -0.058 -10.267
  524    H    GLU  64           H        GLU  64  18.068   5.484  -8.492
  525    HA   GLU  64           HA       GLU  64  16.703   7.945  -9.157
  526   1HB   GLU  64          HB2       GLU  64  18.982   7.762  -8.149
  527   2HB   GLU  64          HB3       GLU  64  19.580   7.076  -9.661
  528   1HG   GLU  64          HG2       GLU  64  20.185   9.425  -9.440
  529   2HG   GLU  64          HG3       GLU  64  19.146   9.193 -10.825
  530    H    ALA  65           H        ALA  65  16.784   9.063 -11.219
  531    HA   ALA  65           HA       ALA  65  17.059   7.433 -13.677
  532   1HB   ALA  65          HB1       ALA  65  14.718   7.137 -12.923
  533   2HB   ALA  65          HB2       ALA  65  14.503   8.900 -12.890
  534   3HB   ALA  65          HB3       ALA  65  14.794   8.064 -14.429
  535    H    GLY  66           H        GLY  66  16.865   8.738 -15.659
  536   1HA   GLY  66          HA2       GLY  66  17.211  11.639 -15.576
  537   2HA   GLY  66          HA3       GLY  66  18.722  10.761 -15.829
  538    H    GLY  67           H        GLY  67  15.560   9.734 -17.113
  539   1HA   GLY  67          HA2       GLY  67  15.770  10.818 -19.744
  540   2HA   GLY  67          HA3       GLY  67  16.474   9.201 -19.732
  541    H    GLN  68           H        GLN  68  14.518   9.317 -21.361
  542    HA   GLN  68           HA       GLN  68  12.056   8.230 -20.040
  543   1HB   GLN  68          HB2       GLN  68  12.241  10.124 -22.416
  544   2HB   GLN  68          HB3       GLN  68  10.753   9.426 -21.794
  545   1HG   GLN  68          HG2       GLN  68  12.562  11.365 -20.302
  546   2HG   GLN  68          HG3       GLN  68  11.035  11.752 -21.071
  547   1HE2  GLN  68          HE21      GLN  68  11.744  12.112 -18.221
  548   2HE2  GLN  68          HE22      GLN  68  10.566  11.147 -17.339
  549    H    GLY  69           H        GLY  69  14.531   7.101 -21.725
  550   1HA   GLY  69          HA2       GLY  69  13.236   4.793 -22.731
  551   2HA   GLY  69          HA3       GLY  69  13.513   5.888 -24.087
  552    H    GLY  70           H        GLY  70  14.724   3.682 -24.483
  553   1HA   GLY  70          HA2       GLY  70  17.366   4.119 -24.967
  554   2HA   GLY  70          HA3       GLY  70  17.420   3.465 -23.328
  555    H    GLY  71           H        GLY  71  15.069   1.644 -23.898
  556   1HA   GLY  71          HA2       GLY  71  15.601  -0.128 -26.066
  557   2HA   GLY  71          HA3       GLY  71  16.437  -0.717 -24.628
  558    H    GLY  72           H        GLY  72  13.159  -2.403 -24.480
  559   1HA   GLY  72          HA2       GLY  72  14.979  -2.484 -26.650
  560   2HA   GLY  72          HA3       GLY  72  15.862  -2.998 -25.209
  Start of MODEL    9
    1   1H    GLY   1           H1       GLY   1  14.277 -20.230   9.964
    2   2H    GLY   1           H2       GLY   1  13.656 -20.632  11.425
    3   3H    GLY   1           H3       GLY   1  14.935 -21.468  10.821
    4   1HA   GLY   1          HA2       GLY   1  15.660 -19.957  12.559
    5   2HA   GLY   1          HA3       GLY   1  16.361 -19.549  10.980
    6    H    SER   2           H        SER   2  16.642 -17.344  11.456
    7    HA   SER   2           HA       SER   2  14.418 -15.597  12.195
    8   1HB   SER   2          HB2       SER   2  17.154 -14.964  11.023
    9   2HB   SER   2          HB3       SER   2  16.003 -13.787  11.677
   10    HG   SER   2           HG       SER   2  17.579 -14.419  13.221
   11    H    HIS   3           H        HIS   3  12.940 -14.722  10.868
   12    HA   HIS   3           HA       HIS   3  13.408 -14.430   7.949
   13   1HB   HIS   3          HB2       HIS   3  10.998 -15.843   9.165
   14   2HB   HIS   3          HB3       HIS   3  11.224 -15.475   7.460
   15    HD1  HIS   3           HD1      HIS   3  13.603 -16.776   6.403
   16    HD2  HIS   3           HD2      HIS   3  11.724 -18.236   9.864
   17    HE1  HIS   3           HE1      HIS   3  14.424 -19.163   6.703
   18    H    MET   4           H        MET   4  11.603 -13.159   6.915
   19    HA   MET   4           HA       MET   4  10.192 -11.261   8.691
   20   1HB   MET   4          HB2       MET   4  12.485 -10.377   8.298
   21   2HB   MET   4          HB3       MET   4  12.196 -10.407   6.558
   22   1HG   MET   4          HG2       MET   4  10.376  -8.775   6.816
   23   2HG   MET   4          HG3       MET   4  10.602  -8.774   8.573
   24   1HE   MET   4          HE1       MET   4  12.443  -7.544   9.858
   25   2HE   MET   4          HE2       MET   4  13.684  -8.594   9.136
   26   3HE   MET   4          HE3       MET   4  13.895  -6.832   9.125
   27    HA   PRO   5           HA       PRO   5   7.319 -11.837   5.243
   28   1HB   PRO   5          HB2       PRO   5   5.268 -10.243   6.017
   29   2HB   PRO   5          HB3       PRO   5   5.711 -11.715   6.930
   30   1HG   PRO   5          HG2       PRO   5   6.555  -8.858   7.509
   31   2HG   PRO   5          HG3       PRO   5   5.822 -10.039   8.645
   32   1HD   PRO   5          HD2       PRO   5   8.512  -9.655   8.496
   33   2HD   PRO   5          HD3       PRO   5   7.811 -11.274   8.800
   34    H    LEU   6           H        LEU   6   6.141 -10.514   3.615
   35    HA   LEU   6           HA       LEU   6   5.973  -9.056   1.935
   36   1HB   LEU   6          HB2       LEU   6   6.819  -6.912   3.885
   37   2HB   LEU   6          HB3       LEU   6   5.886  -6.719   2.404
   38    HG   LEU   6           HG       LEU   6   4.935  -8.071   4.959
   39   1HD1  LEU   6          HD11      LEU   6   4.176  -5.484   3.548
   40   2HD1  LEU   6          HD12      LEU   6   3.397  -6.123   5.010
   41   3HD1  LEU   6          HD13      LEU   6   5.095  -5.622   5.065
   42   1HD2  LEU   6          HD21      LEU   6   2.712  -8.124   3.854
   43   2HD2  LEU   6          HD22      LEU   6   3.456  -7.592   2.329
   44   3HD2  LEU   6          HD23      LEU   6   3.871  -9.174   3.031
   45    H    GLU   7           H        GLU   7   9.159  -9.482   3.048
   46    HA   GLU   7           HA       GLU   7  10.622  -7.754   1.323
   47   1HB   GLU   7          HB2       GLU   7  12.457  -9.314   1.575
   48   2HB   GLU   7          HB3       GLU   7  11.649  -9.036   3.119
   49   1HG   GLU   7          HG2       GLU   7  10.507 -11.203   2.958
   50   2HG   GLU   7          HG3       GLU   7  11.137 -11.454   1.336
   51    H    PHE   8           H        PHE   8   8.635 -10.410   0.344
   52    HA   PHE   8           HA       PHE   8   9.801 -10.795  -2.276
   53   1HB   PHE   8          HB2       PHE   8   7.494 -11.752  -2.757
   54   2HB   PHE   8          HB3       PHE   8   8.463 -12.522  -1.511
   55    HD1  PHE   8           HD1      PHE   8   5.642 -10.073  -1.966
   56    HD2  PHE   8           HD2      PHE   8   7.597 -12.887   0.651
   57    HE1  PHE   8           HE1      PHE   8   3.774  -9.878  -0.349
   58    HE2  PHE   8           HE2      PHE   8   5.705 -12.720   2.244
   59    HZ   PHE   8           HZ       PHE   8   3.781 -11.226   1.739
   60    H    LEU   9           H        LEU   9   7.949  -8.140  -0.984
   61    HA   LEU   9           HA       LEU   9   6.988  -7.162  -3.584
   62   1HB   LEU   9          HB2       LEU   9   7.213  -5.768  -0.883
   63   2HB   LEU   9          HB3       LEU   9   6.352  -5.162  -2.287
   64    HG   LEU   9           HG       LEU   9   5.605  -7.664  -0.713
   65   1HD1  LEU   9          HD11      LEU   9   3.695  -6.328   0.041
   66   2HD1  LEU   9          HD12      LEU   9   5.214  -5.537   0.489
   67   3HD1  LEU   9          HD13      LEU   9   4.274  -4.930  -0.891
   68   1HD2  LEU   9          HD21      LEU   9   4.953  -7.872  -3.095
   69   2HD2  LEU   9          HD22      LEU   9   3.543  -7.640  -2.065
   70   3HD2  LEU   9          HD23      LEU   9   4.170  -6.276  -3.022
   71    H    ARG  10           H        ARG  10   9.895  -6.834  -1.697
   72    HA   ARG  10           HA       ARG  10  10.821  -4.292  -2.307
   73   1HB   ARG  10          HB2       ARG  10  12.284  -6.883  -1.730
   74   2HB   ARG  10          HB3       ARG  10  13.127  -5.339  -1.932
   75   1HG   ARG  10          HG2       ARG  10  11.860  -4.366  -0.071
   76   2HG   ARG  10          HG3       ARG  10  10.914  -5.860   0.096
   77   1HD   ARG  10          HD2       ARG  10  13.031  -7.106   0.551
   78   2HD   ARG  10          HD3       ARG  10  13.919  -5.571   0.488
   79    HE   ARG  10           HE       ARG  10  11.865  -5.217   2.378
   80   1HH1  ARG  10          HH22      ARG  10  14.731  -7.222   2.099
   81   2HH1  ARG  10          HH21      ARG  10  14.924  -7.346   3.833
   82   1HH2  ARG  10          HH12      ARG  10  12.162  -5.452   4.598
   83   2HH2  ARG  10          HH11      ARG  10  13.515  -6.364   5.189
   84    H    ASN  11           H        ASN  11  10.978  -3.369  -4.033
   85    HA   ASN  11           HA       ASN  11  11.437  -2.633  -6.103
   86   1HB   ASN  11          HB2       ASN  11  13.741  -3.283  -5.279
   87   2HB   ASN  11          HB3       ASN  11  13.591  -4.762  -6.239
   88   1HD2  ASN  11          HD21      ASN  11  15.150  -4.375  -7.823
   89   2HD2  ASN  11          HD22      ASN  11  15.107  -2.960  -8.876
   90    H    GLN  12           H        GLN  12   9.438  -4.971  -5.912
   91    HA   GLN  12           HA       GLN  12   9.483  -6.299  -8.458
   92   1HB   GLN  12          HB2       GLN  12   7.199  -5.544  -6.594
   93   2HB   GLN  12          HB3       GLN  12   6.970  -6.519  -8.036
   94   1HG   GLN  12          HG2       GLN  12   8.827  -7.291  -5.748
   95   2HG   GLN  12          HG3       GLN  12   7.150  -7.817  -5.909
   96   1HE2  GLN  12          HE21      GLN  12   8.740  -9.829  -5.651
   97   2HE2  GLN  12          HE22      GLN  12   9.103 -10.627  -7.186
   98    HA   PRO  13           HA       PRO  13   8.526  -3.234 -11.463
   99   1HB   PRO  13          HB2       PRO  13   6.247  -5.011 -12.362
  100   2HB   PRO  13          HB3       PRO  13   7.478  -4.171 -13.355
  101   1HG   PRO  13          HG2       PRO  13   7.777  -6.791 -12.803
  102   2HG   PRO  13          HG3       PRO  13   9.187  -5.691 -12.649
  103   1HD   PRO  13          HD2       PRO  13   7.383  -6.754 -10.475
  104   2HD   PRO  13          HD3       PRO  13   9.171  -6.619 -10.504
  105    H    GLN  14           H        GLN  14   5.542  -4.365  -9.795
  106    HA   GLN  14           HA       GLN  14   4.113  -1.838 -10.266
  107   1HB   GLN  14          HB2       GLN  14   3.568  -4.174  -8.386
  108   2HB   GLN  14          HB3       GLN  14   2.500  -2.787  -8.619
  109   1HG   GLN  14          HG2       GLN  14   2.233  -3.359 -11.010
  110   2HG   GLN  14          HG3       GLN  14   3.285  -4.762 -10.802
  111   1HE2  GLN  14          HE21      GLN  14   0.109  -3.369  -9.838
  112   2HE2  GLN  14          HE22      GLN  14  -0.563  -4.900  -9.310
  113    H    PHE  15           H        PHE  15   6.169  -3.168  -7.707
  114    HA   PHE  15           HA       PHE  15   5.457  -1.206  -5.685
  115   1HB   PHE  15          HB2       PHE  15   6.328  -3.618  -5.407
  116   2HB   PHE  15          HB3       PHE  15   7.930  -2.947  -5.715
  117    HD1  PHE  15           HD1      PHE  15   9.150  -2.120  -3.831
  118    HD2  PHE  15           HD2      PHE  15   4.863  -2.488  -3.588
  119    HE1  PHE  15           HE1      PHE  15   9.239  -1.597  -1.405
  120    HE2  PHE  15           HE2      PHE  15   4.953  -1.928  -1.174
  121    HZ   PHE  15           HZ       PHE  15   7.125  -1.506  -0.074
  122    H    GLN  16           H        GLN  16   7.876  -1.418  -8.218
  123    HA   GLN  16           HA       GLN  16   9.436   0.913  -7.643
  124   1HB   GLN  16          HB2       GLN  16   8.626  -0.539 -10.185
  125   2HB   GLN  16          HB3       GLN  16   9.692   0.870 -10.203
  126   1HG   GLN  16          HG2       GLN  16  11.342  -0.281  -8.817
  127   2HG   GLN  16          HG3       GLN  16  10.282  -1.676  -8.640
  128   1HE2  GLN  16          HE21      GLN  16  11.456  -3.291  -9.761
  129   2HE2  GLN  16          HE22      GLN  16  11.920  -3.116 -11.449
  130    H    GLN  17           H        GLN  17   6.072   0.719  -8.498
  131    HA   GLN  17           HA       GLN  17   6.061   3.526  -9.549
  132   1HB   GLN  17          HB2       GLN  17   4.285   1.151 -10.217
  133   2HB   GLN  17          HB3       GLN  17   4.076   2.800 -10.826
  134   1HG   GLN  17          HG2       GLN  17   6.320   2.691 -11.890
  135   2HG   GLN  17          HG3       GLN  17   6.535   1.046 -11.296
  136   1HE2  GLN  17          HE21      GLN  17   5.659  -0.663 -12.475
  137   2HE2  GLN  17          HE22      GLN  17   4.678  -0.423 -13.923
  138    H    MET  18           H        MET  18   3.953   1.239  -7.623
  139    HA   MET  18           HA       MET  18   1.989   3.170  -7.064
  140   1HB   MET  18          HB2       MET  18   1.231   1.687  -5.368
  141   2HB   MET  18          HB3       MET  18   1.702   0.774  -6.803
  142   1HG   MET  18          HG2       MET  18   3.851   0.163  -5.680
  143   2HG   MET  18          HG3       MET  18   3.363   1.093  -4.259
  144   1HE   MET  18          HE1       MET  18   1.351  -1.530  -6.526
  145   2HE   MET  18          HE2       MET  18   2.959  -2.249  -6.254
  146   3HE   MET  18          HE3       MET  18   1.522  -2.971  -5.503
  147    H    ARG  19           H        ARG  19   5.013   2.621  -5.316
  148    HA   ARG  19           HA       ARG  19   4.468   4.387  -3.098
  149   1HB   ARG  19          HB2       ARG  19   7.141   3.601  -4.357
  150   2HB   ARG  19          HB3       ARG  19   6.886   4.260  -2.733
  151   1HG   ARG  19          HG2       ARG  19   5.400   2.259  -2.280
  152   2HG   ARG  19          HG3       ARG  19   5.950   1.545  -3.784
  153   1HD   ARG  19          HD2       ARG  19   7.925   2.477  -1.670
  154   2HD   ARG  19          HD3       ARG  19   7.294   0.820  -1.747
  155    HE   ARG  19           HE       ARG  19   8.152   1.093  -4.261
  156   1HH1  ARG  19          HH22      ARG  19   9.918   1.709  -1.289
  157   2HH1  ARG  19          HH21      ARG  19  11.465   1.497  -2.069
  158   1HH2  ARG  19          HH12      ARG  19  10.118   0.768  -5.156
  159   2HH2  ARG  19          HH11      ARG  19  11.568   0.922  -4.194
  160    H    GLN  20           H        GLN  20   5.598   5.009  -6.341
  161    HA   GLN  20           HA       GLN  20   6.555   7.722  -5.956
  162   1HB   GLN  20          HB2       GLN  20   5.137   6.639  -8.429
  163   2HB   GLN  20          HB3       GLN  20   6.090   8.102  -8.304
  164   1HG   GLN  20          HG2       GLN  20   8.132   6.738  -7.837
  165   2HG   GLN  20          HG3       GLN  20   7.161   5.269  -8.016
  166   1HE2  GLN  20          HE21      GLN  20   8.283   4.462  -9.861
  167   2HE2  GLN  20          HE22      GLN  20   8.245   5.309 -11.408
  168    H    ILE  21           H        ILE  21   3.345   6.359  -6.562
  169    HA   ILE  21           HA       ILE  21   1.878   8.751  -6.850
  170    HB   ILE  21           HB       ILE  21   0.781   6.164  -5.660
  171   1HG1  ILE  21          HG12      ILE  21   1.465   6.780  -8.547
  172   2HG1  ILE  21          HG13      ILE  21   2.128   5.487  -7.551
  173   1HG2  ILE  21          HG21      ILE  21  -1.285   6.851  -6.776
  174   2HG2  ILE  21          HG22      ILE  21  -0.728   8.155  -5.738
  175   3HG2  ILE  21          HG23      ILE  21  -0.465   8.257  -7.493
  176   1HD1  ILE  21          HD11      ILE  21  -0.694   5.578  -8.619
  177   2HD1  ILE  21          HD12      ILE  21   0.621   4.465  -9.042
  178   3HD1  ILE  21          HD13      ILE  21  -0.091   4.394  -7.423
  179    H    ILE  22           H        ILE  22   2.826   6.913  -4.018
  180    HA   ILE  22           HA       ILE  22   1.217   8.520  -2.140
  181    HB   ILE  22           HB       ILE  22   3.291   6.374  -1.549
  182   1HG1  ILE  22          HG12      ILE  22   1.708   5.133  -2.722
  183   2HG1  ILE  22          HG13      ILE  22   1.161   4.977  -1.062
  184   1HG2  ILE  22          HG21      ILE  22   1.067   7.548   0.169
  185   2HG2  ILE  22          HG22      ILE  22   2.157   6.216   0.623
  186   3HG2  ILE  22          HG23      ILE  22   2.811   7.835   0.366
  187   1HD1  ILE  22          HD11      ILE  22  -0.087   6.598  -3.285
  188   2HD1  ILE  22          HD12      ILE  22  -0.794   5.329  -2.268
  189   3HD1  ILE  22          HD13      ILE  22  -0.448   6.931  -1.574
  190    H    GLN  23           H        GLN  23   4.691   8.164  -2.910
  191    HA   GLN  23           HA       GLN  23   5.568  10.194  -1.061
  192   1HB   GLN  23          HB2       GLN  23   6.809   8.836  -3.473
  193   2HB   GLN  23          HB3       GLN  23   7.672  10.053  -2.505
  194   1HG   GLN  23          HG2       GLN  23   7.316   8.704  -0.454
  195   2HG   GLN  23          HG3       GLN  23   6.442   7.491  -1.386
  196   1HE2  GLN  23          HE21      GLN  23   7.818   5.772  -0.881
  197   2HE2  GLN  23          HE22      GLN  23   9.525   5.777  -1.263
  198    H    GLN  24           H        GLN  24   3.826  10.475  -4.000
  199    HA   GLN  24           HA       GLN  24   4.418  13.334  -4.413
  200   1HB   GLN  24          HB2       GLN  24   4.128  12.073  -6.371
  201   2HB   GLN  24          HB3       GLN  24   2.857  11.085  -5.683
  202   1HG   GLN  24          HG2       GLN  24   1.974  12.380  -7.364
  203   2HG   GLN  24          HG3       GLN  24   1.228  12.839  -5.849
  204   1HE2  GLN  24          HE21      GLN  24   0.776  15.028  -5.899
  205   2HE2  GLN  24          HE22      GLN  24   1.864  16.261  -6.532
  206    H    ASN  25           H        ASN  25   1.695  11.218  -3.375
  207    HA   ASN  25           HA       ASN  25   0.531  13.449  -1.779
  208   1HB   ASN  25          HB2       ASN  25  -0.744  11.905  -4.029
  209   2HB   ASN  25          HB3       ASN  25  -1.725  12.360  -2.633
  210   1HD2  ASN  25          HD21      ASN  25  -1.871  14.618  -1.994
  211   2HD2  ASN  25          HD22      ASN  25  -1.822  15.791  -3.309
  212    HA   PRO  26           HA       PRO  26   1.088   9.702   0.765
  213   1HB   PRO  26          HB2       PRO  26   1.160  10.895   3.241
  214   2HB   PRO  26          HB3       PRO  26   2.551  10.819   2.114
  215   1HG   PRO  26          HG2       PRO  26   0.582  13.093   2.475
  216   2HG   PRO  26          HG3       PRO  26   2.378  13.175   2.447
  217   1HD   PRO  26          HD2       PRO  26   0.890  13.734   0.280
  218   2HD   PRO  26          HD3       PRO  26   2.417  12.807   0.096
  219    H    SER  27           H        SER  27  -1.440  12.144   1.143
  220    HA   SER  27           HA       SER  27  -3.298  10.769   2.748
  221   1HB   SER  27          HB2       SER  27  -3.913  12.538   0.356
  222   2HB   SER  27          HB3       SER  27  -4.964  12.212   1.745
  223    HG   SER  27           HG       SER  27  -3.866  14.202   1.968
  224    H    LEU  28           H        LEU  28  -2.243   9.861  -0.432
  225    HA   LEU  28           HA       LEU  28  -4.670   8.247  -0.974
  226   1HB   LEU  28          HB2       LEU  28  -2.177   8.662  -2.656
  227   2HB   LEU  28          HB3       LEU  28  -3.657   7.838  -3.146
  228    HG   LEU  28           HG       LEU  28  -3.307  10.806  -2.598
  229   1HD1  LEU  28          HD11      LEU  28  -4.128   9.214  -5.059
  230   2HD1  LEU  28          HD12      LEU  28  -3.927  10.984  -4.973
  231   3HD1  LEU  28          HD13      LEU  28  -2.520   9.924  -4.780
  232   1HD2  LEU  28          HD21      LEU  28  -5.656  11.088  -3.298
  233   2HD2  LEU  28          HD22      LEU  28  -5.883   9.321  -3.262
  234   3HD2  LEU  28          HD23      LEU  28  -5.533  10.224  -1.766
  235    H    LEU  29           H        LEU  29  -1.988   7.692   0.921
  236    HA   LEU  29           HA       LEU  29  -1.230   5.050   0.270
  237   1HB   LEU  29          HB2       LEU  29  -0.105   6.361   1.938
  238   2HB   LEU  29          HB3       LEU  29  -1.514   6.477   2.944
  239    HG   LEU  29           HG       LEU  29  -1.451   4.060   3.430
  240   1HD1  LEU  29          HD11      LEU  29   0.957   4.072   1.569
  241   2HD1  LEU  29          HD12      LEU  29   0.613   2.765   2.734
  242   3HD1  LEU  29          HD13      LEU  29  -0.517   3.101   1.416
  243   1HD2  LEU  29          HD21      LEU  29  -0.181   5.635   4.840
  244   2HD2  LEU  29          HD22      LEU  29   0.597   4.049   4.764
  245   3HD2  LEU  29          HD23      LEU  29   1.252   5.406   3.817
  246    HA   PRO  30           HA       PRO  30  -5.304   3.502   2.662
  247   1HB   PRO  30          HB2       PRO  30  -7.001   5.856   1.833
  248   2HB   PRO  30          HB3       PRO  30  -7.114   4.854   3.292
  249   1HG   PRO  30          HG2       PRO  30  -6.010   7.399   3.081
  250   2HG   PRO  30          HG3       PRO  30  -5.611   6.236   4.396
  251   1HD   PRO  30          HD2       PRO  30  -3.932   7.172   2.190
  252   2HD   PRO  30          HD3       PRO  30  -3.473   6.181   3.592
  253    H    ALA  31           H        ALA  31  -5.620   5.736  -0.064
  254    HA   ALA  31           HA       ALA  31  -7.359   4.139  -1.636
  255   1HB   ALA  31          HB1       ALA  31  -7.047   6.624  -1.652
  256   2HB   ALA  31          HB2       ALA  31  -5.533   6.396  -2.549
  257   3HB   ALA  31          HB3       ALA  31  -7.067   5.872  -3.267
  258    H    LEU  32           H        LEU  32  -3.985   3.593  -1.119
  259    HA   LEU  32           HA       LEU  32  -3.701   2.049  -3.658
  260   1HB   LEU  32          HB2       LEU  32  -1.869   3.516  -3.129
  261   2HB   LEU  32          HB3       LEU  32  -1.803   2.890  -1.467
  262    HG   LEU  32           HG       LEU  32  -0.980   0.750  -2.235
  263   1HD1  LEU  32          HD11      LEU  32  -1.116   1.901  -5.054
  264   2HD1  LEU  32          HD12      LEU  32  -0.396   0.332  -4.586
  265   3HD1  LEU  32          HD13      LEU  32  -2.125   0.582  -4.424
  266   1HD2  LEU  32          HD21      LEU  32   0.589   2.633  -1.804
  267   2HD2  LEU  32          HD22      LEU  32   1.247   1.499  -2.991
  268   3HD2  LEU  32          HD23      LEU  32   0.563   3.040  -3.533
  269    H    LEU  33           H        LEU  33  -3.700   1.704  -0.096
  270    HA   LEU  33           HA       LEU  33  -3.515  -1.156   0.023
  271   1HB   LEU  33          HB2       LEU  33  -4.907   0.886   1.798
  272   2HB   LEU  33          HB3       LEU  33  -4.646  -0.801   2.244
  273    HG   LEU  33           HG       LEU  33  -2.247   0.886   1.450
  274   1HD1  LEU  33          HD11      LEU  33  -1.978   1.577   3.786
  275   2HD1  LEU  33          HD12      LEU  33  -3.420   2.271   3.033
  276   3HD1  LEU  33          HD13      LEU  33  -3.592   0.910   4.171
  277   1HD2  LEU  33          HD21      LEU  33  -2.637  -1.369   3.457
  278   2HD2  LEU  33          HD22      LEU  33  -1.978  -1.544   1.815
  279   3HD2  LEU  33          HD23      LEU  33  -1.099  -0.588   3.018
  280    H    GLN  34           H        GLN  34  -6.362   1.023  -0.263
  281    HA   GLN  34           HA       GLN  34  -8.336  -1.018  -0.579
  282   1HB   GLN  34          HB2       GLN  34  -8.181   1.875  -1.490
  283   2HB   GLN  34          HB3       GLN  34  -9.608   0.867  -1.741
  284   1HG   GLN  34          HG2       GLN  34  -9.876   0.498   0.644
  285   2HG   GLN  34          HG3       GLN  34  -8.409   1.389   1.017
  286   1HE2  GLN  34          HE21      GLN  34 -11.564   1.782   1.425
  287   2HE2  GLN  34          HE22      GLN  34 -11.719   3.497   1.063
  288    H    GLN  35           H        GLN  35  -5.930   0.206  -2.935
  289    HA   GLN  35           HA       GLN  35  -7.388  -0.905  -5.203
  290   1HB   GLN  35          HB2       GLN  35  -5.932   1.159  -5.220
  291   2HB   GLN  35          HB3       GLN  35  -4.513   0.134  -5.011
  292   1HG   GLN  35          HG2       GLN  35  -6.518  -0.108  -7.275
  293   2HG   GLN  35          HG3       GLN  35  -5.078   0.910  -7.356
  294   1HE2  GLN  35          HE21      GLN  35  -5.914  -1.599  -8.948
  295   2HE2  GLN  35          HE22      GLN  35  -4.517  -2.658  -8.760
  296    H    ILE  36           H        ILE  36  -4.553  -1.828  -3.216
  297    HA   ILE  36           HA       ILE  36  -3.958  -4.301  -4.491
  298    HB   ILE  36           HB       ILE  36  -3.692  -3.447  -1.606
  299   1HG1  ILE  36          HG12      ILE  36  -1.511  -3.719  -3.721
  300   2HG1  ILE  36          HG13      ILE  36  -2.395  -2.213  -3.493
  301   1HG2  ILE  36          HG21      ILE  36  -2.550  -5.909  -3.055
  302   2HG2  ILE  36          HG22      ILE  36  -2.033  -5.374  -1.442
  303   3HG2  ILE  36          HG23      ILE  36  -3.678  -5.931  -1.697
  304   1HD1  ILE  36          HD11      ILE  36  -1.697  -2.172  -1.097
  305   2HD1  ILE  36          HD12      ILE  36  -0.655  -3.581  -1.427
  306   3HD1  ILE  36          HD13      ILE  36  -0.362  -2.045  -2.262
  307    H    GLY  37           H        GLY  37  -6.411  -3.540  -1.932
  308   1HA   GLY  37          HA2       GLY  37  -7.460  -6.138  -1.641
  309   2HA   GLY  37          HA3       GLY  37  -8.326  -4.632  -1.343
  310    H    ARG  38           H        ARG  38  -7.674  -4.271  -4.520
  311    HA   ARG  38           HA       ARG  38 -10.054  -5.782  -5.514
  312   1HB   ARG  38          HB2       ARG  38  -8.736  -3.242  -6.511
  313   2HB   ARG  38          HB3       ARG  38 -10.082  -4.050  -7.303
  314   1HG   ARG  38          HG2       ARG  38 -10.180  -2.963  -4.455
  315   2HG   ARG  38          HG3       ARG  38 -10.751  -2.136  -5.909
  316   1HD   ARG  38          HD2       ARG  38 -12.348  -4.056  -6.302
  317   2HD   ARG  38          HD3       ARG  38 -11.827  -4.748  -4.769
  318    HE   ARG  38           HE       ARG  38 -12.981  -3.121  -3.576
  319   1HH1  ARG  38          HH22      ARG  38 -13.163  -2.258  -6.977
  320   2HH1  ARG  38          HH21      ARG  38 -14.400  -1.053  -6.691
  321   1HH2  ARG  38          HH12      ARG  38 -14.548  -1.582  -3.293
  322   2HH2  ARG  38          HH11      ARG  38 -15.155  -0.686  -4.662
  323    H    GLU  39           H        GLU  39  -6.741  -6.128  -5.587
  324    HA   GLU  39           HA       GLU  39  -6.993  -7.866  -8.009
  325   1HB   GLU  39          HB2       GLU  39  -4.929  -7.186  -8.944
  326   2HB   GLU  39          HB3       GLU  39  -5.976  -5.772  -8.728
  327   1HG   GLU  39          HG2       GLU  39  -4.693  -5.052  -6.802
  328   2HG   GLU  39          HG3       GLU  39  -3.720  -6.531  -6.843
  329    H    ASN  40           H        ASN  40  -5.456  -7.321  -4.930
  330    HA   ASN  40           HA       ASN  40  -5.046 -10.209  -4.677
  331   1HB   ASN  40          HB2       ASN  40  -2.840  -9.080  -5.500
  332   2HB   ASN  40          HB3       ASN  40  -2.733  -8.401  -3.894
  333   1HD2  ASN  40          HD21      ASN  40  -0.984 -10.410  -5.215
  334   2HD2  ASN  40          HD22      ASN  40  -1.083 -11.848  -4.199
  335    HA   PRO  41           HA       PRO  41  -6.910  -8.113  -0.927
  336   1HB   PRO  41          HB2       PRO  41  -8.877  -9.968  -0.439
  337   2HB   PRO  41          HB3       PRO  41  -9.048  -8.585  -1.567
  338   1HG   PRO  41          HG2       PRO  41  -8.268 -11.422  -2.247
  339   2HG   PRO  41          HG3       PRO  41  -9.550 -10.417  -3.008
  340   1HD   PRO  41          HD2       PRO  41  -7.115 -10.624  -4.128
  341   2HD   PRO  41          HD3       PRO  41  -7.929  -9.030  -4.074
  342    H    GLN  42           H        GLN  42  -5.539 -11.249  -1.611
  343    HA   GLN  42           HA       GLN  42  -5.248 -12.124   1.162
  344   1HB   GLN  42          HB2       GLN  42  -3.741 -13.020  -1.318
  345   2HB   GLN  42          HB3       GLN  42  -3.906 -13.906   0.197
  346   1HG   GLN  42          HG2       GLN  42  -6.188 -13.206  -1.700
  347   2HG   GLN  42          HG3       GLN  42  -5.360 -14.758  -1.651
  348   1HE2  GLN  42          HE21      GLN  42  -5.663 -16.153   0.284
  349   2HE2  GLN  42          HE22      GLN  42  -7.068 -15.882   1.308
  350    H    LEU  43           H        LEU  43  -3.108 -10.559  -1.284
  351    HA   LEU  43           HA       LEU  43  -0.879 -10.111   0.481
  352   1HB   LEU  43          HB2       LEU  43  -0.864  -9.802  -2.049
  353   2HB   LEU  43          HB3       LEU  43  -1.927  -8.411  -1.827
  354    HG   LEU  43           HG       LEU  43  -0.261  -7.168  -0.672
  355   1HD1  LEU  43          HD11      LEU  43   2.067  -7.994  -0.395
  356   2HD1  LEU  43          HD12      LEU  43   0.933  -8.900   0.592
  357   3HD1  LEU  43          HD13      LEU  43   1.537  -9.616  -0.925
  358   1HD2  LEU  43          HD21      LEU  43  -0.256  -7.176  -3.147
  359   2HD2  LEU  43          HD22      LEU  43   1.342  -6.854  -2.465
  360   3HD2  LEU  43          HD23      LEU  43   0.971  -8.463  -3.133
  361    H    LEU  44           H        LEU  44  -3.951  -8.460  -0.058
  362    HA   LEU  44           HA       LEU  44  -3.213  -6.027   1.278
  363   1HB   LEU  44          HB2       LEU  44  -5.189  -6.486  -0.294
  364   2HB   LEU  44          HB3       LEU  44  -6.037  -7.170   1.050
  365    HG   LEU  44           HG       LEU  44  -6.292  -4.657   0.257
  366   1HD1  LEU  44          HD11      LEU  44  -6.475  -5.423   3.174
  367   2HD1  LEU  44          HD12      LEU  44  -7.301  -4.075   2.339
  368   3HD1  LEU  44          HD13      LEU  44  -7.685  -5.738   1.893
  369   1HD2  LEU  44          HD21      LEU  44  -4.267  -4.288   2.513
  370   2HD2  LEU  44          HD22      LEU  44  -3.998  -3.894   0.792
  371   3HD2  LEU  44          HD23      LEU  44  -5.230  -3.036   1.733
  372    H    GLN  45           H        GLN  45  -5.207  -8.685   2.392
  373    HA   GLN  45           HA       GLN  45  -5.301  -8.233   5.181
  374   1HB   GLN  45          HB2       GLN  45  -5.094 -10.808   3.591
  375   2HB   GLN  45          HB3       GLN  45  -5.300 -10.802   5.342
  376   1HG   GLN  45          HG2       GLN  45  -7.430  -9.740   5.228
  377   2HG   GLN  45          HG3       GLN  45  -7.222  -9.305   3.527
  378   1HE2  GLN  45          HE21      GLN  45  -7.327 -10.957   1.919
  379   2HE2  GLN  45          HE22      GLN  45  -8.079 -12.513   2.230
  380    H    GLN  46           H        GLN  46  -2.555  -9.711   3.361
  381    HA   GLN  46           HA       GLN  46  -0.965 -10.236   5.734
  382   1HB   GLN  46          HB2       GLN  46  -0.451 -10.136   2.744
  383   2HB   GLN  46          HB3       GLN  46   0.884 -10.313   3.871
  384   1HG   GLN  46          HG2       GLN  46  -0.111 -12.337   4.831
  385   2HG   GLN  46          HG3       GLN  46  -1.560 -12.146   3.851
  386   1HE2  GLN  46          HE21      GLN  46  -1.411 -12.450   1.544
  387   2HE2  GLN  46          HE22      GLN  46  -0.093 -13.419   0.858
  388    H    ILE  47           H        ILE  47  -0.965  -7.511   3.396
  389    HA   ILE  47           HA       ILE  47   1.080  -5.972   4.682
  390    HB   ILE  47           HB       ILE  47  -1.231  -5.280   2.869
  391   1HG1  ILE  47          HG12      ILE  47   1.802  -5.143   2.498
  392   2HG1  ILE  47          HG13      ILE  47   0.841  -6.563   2.078
  393   1HG2  ILE  47          HG21      ILE  47   0.813  -3.386   4.113
  394   2HG2  ILE  47          HG22      ILE  47  -0.161  -2.980   2.687
  395   3HG2  ILE  47          HG23      ILE  47  -0.957  -3.280   4.225
  396   1HD1  ILE  47          HD11      ILE  47   1.217  -5.296   0.082
  397   2HD1  ILE  47          HD12      ILE  47  -0.509  -5.183   0.516
  398   3HD1  ILE  47          HD13      ILE  47   0.585  -3.813   0.817
  399    H    SER  48           H        SER  48  -2.421  -6.277   5.318
  400    HA   SER  48           HA       SER  48  -2.535  -4.224   7.340
  401   1HB   SER  48          HB2       SER  48  -4.320  -6.671   7.036
  402   2HB   SER  48          HB3       SER  48  -4.655  -5.235   8.010
  403    HG   SER  48           HG       SER  48  -4.337  -5.342   5.191
  404    H    GLN  49           H        GLN  49  -1.790  -7.703   7.534
  405    HA   GLN  49           HA       GLN  49  -1.545  -7.855  10.405
  406   1HB   GLN  49          HB2       GLN  49  -0.555  -9.531   8.070
  407   2HB   GLN  49          HB3       GLN  49  -0.155  -9.952   9.727
  408   1HG   GLN  49          HG2       GLN  49  -3.002  -9.633   8.684
  409   2HG   GLN  49          HG3       GLN  49  -2.132 -11.158   8.805
  410   1HE2  GLN  49          HE21      GLN  49  -4.447  -9.381  10.378
  411   2HE2  GLN  49          HE22      GLN  49  -4.143  -9.947  12.020
  412    H    HIS  50           H        HIS  50   0.670  -6.744   7.939
  413    HA   HIS  50           HA       HIS  50   2.891  -6.487   9.935
  414   1HB   HIS  50          HB2       HIS  50   3.115  -7.213   7.001
  415   2HB   HIS  50          HB3       HIS  50   4.423  -7.186   8.187
  416    HD1  HIS  50           HD1      HIS  50   3.402  -8.992  10.475
  417    HD2  HIS  50           HD2      HIS  50   2.610  -9.676   6.406
  418    HE1  HIS  50           HE1      HIS  50   2.862 -11.468  10.260
  419    H    GLN  51           H        GLN  51   0.960  -4.416   9.163
  420    HA   GLN  51           HA       GLN  51   1.684  -2.885   7.035
  421   1HB   GLN  51          HB2       GLN  51  -0.420  -2.893   8.539
  422   2HB   GLN  51          HB3       GLN  51   0.423  -1.674   9.509
  423   1HG   GLN  51          HG2       GLN  51   0.609  -0.234   7.478
  424   2HG   GLN  51          HG3       GLN  51  -0.147  -1.513   6.520
  425   1HE2  GLN  51          HE21      GLN  51  -1.774   0.137   5.903
  426   2HE2  GLN  51          HE22      GLN  51  -3.073   0.488   7.043
  427    H    GLU  52           H        GLU  52   3.178  -2.578  10.246
  428    HA   GLU  52           HA       GLU  52   4.412  -0.044   9.846
  429   1HB   GLU  52          HB2       GLU  52   4.195  -1.584  11.946
  430   2HB   GLU  52          HB3       GLU  52   5.702  -2.306  11.408
  431   1HG   GLU  52          HG2       GLU  52   5.203   0.650  11.984
  432   2HG   GLU  52          HG3       GLU  52   5.907  -0.483  13.123
  433    H    HIS  53           H        HIS  53   5.608  -3.358   9.013
  434    HA   HIS  53           HA       HIS  53   8.095  -2.409   7.895
  435   1HB   HIS  53          HB2       HIS  53   7.803  -4.715   8.703
  436   2HB   HIS  53          HB3       HIS  53   6.592  -5.016   7.456
  437    HD1  HIS  53           HD1      HIS  53   7.976  -6.845   6.081
  438    HD2  HIS  53           HD2      HIS  53  10.009  -3.230   6.783
  439    HE1  HIS  53           HE1      HIS  53  10.048  -6.909   4.649
  440    H    PHE  54           H        PHE  54   4.851  -2.991   6.509
  441    HA   PHE  54           HA       PHE  54   5.588  -2.572   3.756
  442   1HB   PHE  54          HB2       PHE  54   3.383  -3.489   4.426
  443   2HB   PHE  54          HB3       PHE  54   2.968  -1.957   5.185
  444    HD1  PHE  54           HD1      PHE  54   3.863  -3.501   1.883
  445    HD2  PHE  54           HD2      PHE  54   1.981  -0.195   3.914
  446    HE1  PHE  54           HE1      PHE  54   2.950  -2.686  -0.276
  447    HE2  PHE  54           HE2      PHE  54   1.085   0.620   1.745
  448    HZ   PHE  54           HZ       PHE  54   1.574  -0.620  -0.350
  449    H    ILE  55           H        ILE  55   4.357  -0.243   6.234
  450    HA   ILE  55           HA       ILE  55   4.533   2.042   4.591
  451    HB   ILE  55           HB       ILE  55   4.456   1.746   7.544
  452   1HG1  ILE  55          HG12      ILE  55   2.516   2.766   5.405
  453   2HG1  ILE  55          HG13      ILE  55   2.494   1.137   6.084
  454   1HG2  ILE  55          HG21      ILE  55   4.061   4.214   7.674
  455   2HG2  ILE  55          HG22      ILE  55   5.685   3.869   7.125
  456   3HG2  ILE  55          HG23      ILE  55   4.454   4.366   5.950
  457   1HD1  ILE  55          HD11      ILE  55   2.069   2.119   8.340
  458   2HD1  ILE  55          HD12      ILE  55   1.883   3.712   7.550
  459   3HD1  ILE  55          HD13      ILE  55   0.779   2.388   7.143
  460    H    GLN  56           H        GLN  56   7.128   0.593   6.679
  461    HA   GLN  56           HA       GLN  56   9.058   2.644   6.218
  462   1HB   GLN  56          HB2       GLN  56   9.439  -0.352   6.600
  463   2HB   GLN  56          HB3       GLN  56  10.762   0.803   6.543
  464   1HG   GLN  56          HG2       GLN  56   8.523   0.790   8.600
  465   2HG   GLN  56          HG3       GLN  56  10.158   0.199   8.858
  466   1HE2  GLN  56          HE21      GLN  56   8.729   2.287  10.340
  467   2HE2  GLN  56          HE22      GLN  56   9.698   3.750  10.171
  468    H    MET  57           H        MET  57   8.385  -0.283   4.230
  469    HA   MET  57           HA       MET  57  10.417   0.308   2.250
  470   1HB   MET  57          HB2       MET  57   7.985  -1.520   2.253
  471   2HB   MET  57          HB3       MET  57   9.190  -1.465   0.957
  472   1HG   MET  57          HG2       MET  57  10.962  -1.999   2.648
  473   2HG   MET  57          HG3       MET  57   9.691  -2.275   3.837
  474   1HE   MET  57          HE1       MET  57   7.382  -3.721   2.046
  475   2HE   MET  57          HE2       MET  57   7.831  -5.408   2.348
  476   3HE   MET  57          HE3       MET  57   7.892  -4.227   3.677
  477    H    LEU  58           H        LEU  58   6.950   0.951   2.459
  478    HA   LEU  58           HA       LEU  58   6.355   2.103  -0.049
  479   1HB   LEU  58          HB2       LEU  58   4.868   1.109   1.465
  480   2HB   LEU  58          HB3       LEU  58   5.360   2.178   2.768
  481    HG   LEU  58           HG       LEU  58   3.113   2.390   1.793
  482   1HD1  LEU  58          HD11      LEU  58   3.016   4.784   2.275
  483   2HD1  LEU  58          HD12      LEU  58   4.091   3.953   3.398
  484   3HD1  LEU  58          HD13      LEU  58   4.769   4.927   2.070
  485   1HD2  LEU  58          HD21      LEU  58   2.694   3.766  -0.111
  486   2HD2  LEU  58          HD22      LEU  58   4.422   4.048  -0.396
  487   3HD2  LEU  58          HD23      LEU  58   3.726   2.422  -0.606
  488    H    ASN  59           H        ASN  59   7.819   3.528   2.887
  489    HA   ASN  59           HA       ASN  59   7.441   6.261   1.804
  490   1HB   ASN  59          HB2       ASN  59   6.446   5.447   3.984
  491   2HB   ASN  59          HB3       ASN  59   8.096   5.329   4.613
  492   1HD2  ASN  59          HD21      ASN  59   7.443   6.792   6.275
  493   2HD2  ASN  59          HD22      ASN  59   7.206   8.502   5.933
  494    H    GLU  60           H        GLU  60  10.086   4.043   2.582
  495    HA   GLU  60           HA       GLU  60  12.184   6.018   2.512
  496   1HB   GLU  60          HB2       GLU  60  13.699   4.245   2.252
  497   2HB   GLU  60          HB3       GLU  60  12.444   3.703   3.366
  498   1HG   GLU  60          HG2       GLU  60  11.371   2.439   1.527
  499   2HG   GLU  60          HG3       GLU  60  12.608   3.038   0.412
  500    HA   PRO  61           HA       PRO  61  12.193   7.633  -1.456
  501   1HB   PRO  61          HB2       PRO  61  15.081   6.879  -1.867
  502   2HB   PRO  61          HB3       PRO  61  14.257   8.468  -2.059
  503   1HG   PRO  61          HG2       PRO  61  15.759   7.904   0.134
  504   2HG   PRO  61          HG3       PRO  61  14.270   8.895   0.207
  505   1HD   PRO  61          HD2       PRO  61  14.668   6.057   1.060
  506   2HD   PRO  61          HD3       PRO  61  13.583   7.348   1.690
  507    H    VAL  62           H        VAL  62  11.012   6.709  -2.998
  508    HA   VAL  62           HA       VAL  62  11.428   4.093  -4.118
  509    HB   VAL  62           HB       VAL  62   9.257   5.228  -4.000
  510   1HG1  VAL  62          HG11      VAL  62  10.112   6.925  -6.374
  511   2HG1  VAL  62          HG12      VAL  62   8.572   6.957  -5.487
  512   3HG1  VAL  62          HG13      VAL  62  10.044   7.541  -4.709
  513   1HG2  VAL  62          HG21      VAL  62   9.975   4.543  -6.875
  514   2HG2  VAL  62          HG22      VAL  62   9.608   3.360  -5.599
  515   3HG2  VAL  62          HG23      VAL  62   8.370   4.511  -6.130
  516    H    GLN  63           H        GLN  63  12.719   7.213  -4.953
  517    HA   GLN  63           HA       GLN  63  14.630   6.031  -6.812
  518   1HB   GLN  63          HB2       GLN  63  14.188   7.601  -8.632
  519   2HB   GLN  63          HB3       GLN  63  12.788   6.578  -8.330
  520   1HG   GLN  63          HG2       GLN  63  11.709   8.472  -7.063
  521   2HG   GLN  63          HG3       GLN  63  13.118   9.468  -7.407
  522   1HE2  GLN  63          HE21      GLN  63  12.185  11.041  -8.766
  523   2HE2  GLN  63          HE22      GLN  63  11.386  10.626 -10.277
  524    H    GLU  64           H        GLU  64  16.360   7.637  -7.371
  525    HA   GLU  64           HA       GLU  64  16.708   9.870  -5.436
  526   1HB   GLU  64          HB2       GLU  64  18.602   7.498  -5.714
  527   2HB   GLU  64          HB3       GLU  64  18.966   8.997  -4.849
  528   1HG   GLU  64          HG2       GLU  64  17.048   8.552  -3.315
  529   2HG   GLU  64          HG3       GLU  64  16.807   6.993  -4.103
  530    H    ALA  65           H        ALA  65  18.620  11.171  -5.881
  531    HA   ALA  65           HA       ALA  65  19.996  10.934  -8.453
  532   1HB   ALA  65          HB1       ALA  65  19.364  13.220  -9.172
  533   2HB   ALA  65          HB2       ALA  65  17.936  12.180  -9.059
  534   3HB   ALA  65          HB3       ALA  65  18.272  13.367  -7.780
  535    H    GLY  66           H        GLY  66  21.764  12.607  -8.613
  536   1HA   GLY  66          HA2       GLY  66  22.608  14.252  -6.462
  537   2HA   GLY  66          HA3       GLY  66  23.343  12.668  -6.240
  538    H    GLY  67           H        GLY  67  25.174  14.339  -6.405
  539   1HA   GLY  67          HA2       GLY  67  26.721  13.840  -8.737
  540   2HA   GLY  67          HA3       GLY  67  26.085  15.489  -8.815
  541    H    GLN  68           H        GLN  68  29.273  15.969  -7.016
  542    HA   GLN  68           HA       GLN  68  28.183  16.308  -9.645
  543   1HB   GLN  68          HB2       GLN  68  30.414  16.981 -10.232
  544   2HB   GLN  68          HB3       GLN  68  30.018  17.615  -8.643
  545   1HG   GLN  68          HG2       GLN  68  31.270  15.425  -7.775
  546   2HG   GLN  68          HG3       GLN  68  31.977  15.437  -9.390
  547   1HE2  GLN  68          HE21      GLN  68  32.968  17.738 -10.027
  548   2HE2  GLN  68          HE22      GLN  68  33.812  18.537  -8.706
  549    H    GLY  69           H        GLY  69  29.079  15.319 -11.639
  550   1HA   GLY  69          HA2       GLY  69  30.050  12.557 -11.592
  551   2HA   GLY  69          HA3       GLY  69  28.317  12.695 -11.894
  552    H    GLY  70           H        GLY  70  31.036  14.746 -13.017
  553   1HA   GLY  70          HA2       GLY  70  31.274  13.780 -15.647
  554   2HA   GLY  70          HA3       GLY  70  30.002  15.001 -15.703
  555    H    GLY  71           H        GLY  71  31.652  16.459 -13.433
  556   1HA   GLY  71          HA2       GLY  71  34.162  17.261 -14.592
  557   2HA   GLY  71          HA3       GLY  71  32.896  18.444 -14.935
  558    H    GLY  72           H        GLY  72  34.723  19.577 -13.613
  559   1HA   GLY  72          HA2       GLY  72  33.700  20.368 -11.051
  560   2HA   GLY  72          HA3       GLY  72  35.090  19.302 -10.829
  Start of MODEL   10
    1   1H    GLY   1           H1       GLY   1  15.801  -4.771  15.742
    2   2H    GLY   1           H2       GLY   1  15.449  -3.858  14.422
    3   3H    GLY   1           H3       GLY   1  16.950  -3.804  15.078
    4   1HA   GLY   1          HA2       GLY   1  17.357  -6.109  14.498
    5   2HA   GLY   1          HA3       GLY   1  15.738  -6.156  13.777
    6    H    SER   2           H        SER   2  17.080  -6.869  11.899
    7    HA   SER   2           HA       SER   2  18.032  -4.567  10.236
    8   1HB   SER   2          HB2       SER   2  19.870  -6.044   9.470
    9   2HB   SER   2          HB3       SER   2  19.946  -5.678  11.197
   10    HG   SER   2           HG       SER   2  20.272  -7.904  10.778
   11    H    HIS   3           H        HIS   3  15.743  -6.973  10.311
   12    HA   HIS   3           HA       HIS   3  15.372  -6.932   7.374
   13   1HB   HIS   3          HB2       HIS   3  15.543  -9.464   9.060
   14   2HB   HIS   3          HB3       HIS   3  14.872  -9.407   7.438
   15    HD1  HIS   3           HD1      HIS   3  16.678  -8.746   5.423
   16    HD2  HIS   3           HD2      HIS   3  18.185  -9.695   9.230
   17    HE1  HIS   3           HE1      HIS   3  19.151  -9.254   5.105
   18    H    MET   4           H        MET   4  13.215  -7.799   6.775
   19    HA   MET   4           HA       MET   4  11.055  -7.446   8.788
   20   1HB   MET   4          HB2       MET   4  11.521  -5.773   6.277
   21   2HB   MET   4          HB3       MET   4   9.974  -5.831   7.109
   22   1HG   MET   4          HG2       MET   4  11.122  -5.063   9.208
   23   2HG   MET   4          HG3       MET   4  12.586  -4.797   8.252
   24   1HE   MET   4          HE1       MET   4  11.444  -3.614   5.482
   25   2HE   MET   4          HE2       MET   4  11.554  -1.883   5.848
   26   3HE   MET   4          HE3       MET   4  12.850  -2.980   6.371
   27    HA   PRO   5           HA       PRO   5   8.846 -10.198   5.850
   28   1HB   PRO   5          HB2       PRO   5   6.247  -9.424   6.165
   29   2HB   PRO   5          HB3       PRO   5   7.138 -10.338   7.415
   30   1HG   PRO   5          HG2       PRO   5   6.738  -7.337   7.248
   31   2HG   PRO   5          HG3       PRO   5   6.408  -8.415   8.647
   32   1HD   PRO   5          HD2       PRO   5   8.725  -7.030   8.456
   33   2HD   PRO   5          HD3       PRO   5   8.715  -8.702   9.079
   34    H    LEU   6           H        LEU   6   7.208  -9.879   3.988
   35    HA   LEU   6           HA       LEU   6   6.609  -9.045   1.989
   36   1HB   LEU   6          HB2       LEU   6   6.902  -6.294   3.219
   37   2HB   LEU   6          HB3       LEU   6   5.958  -6.728   1.800
   38    HG   LEU   6           HG       LEU   6   5.363  -7.691   4.634
   39   1HD1  LEU   6          HD11      LEU   6   5.003  -5.289   4.359
   40   2HD1  LEU   6          HD12      LEU   6   4.025  -5.587   2.901
   41   3HD1  LEU   6          HD13      LEU   6   3.459  -6.147   4.494
   42   1HD2  LEU   6          HD21      LEU   6   3.796  -7.981   2.029
   43   2HD2  LEU   6          HD22      LEU   6   4.527  -9.299   2.976
   44   3HD2  LEU   6          HD23      LEU   6   3.177  -8.375   3.647
   45    H    GLU   7           H        GLU   7   9.667  -9.112   2.692
   46    HA   GLU   7           HA       GLU   7  11.108  -7.406   0.973
   47   1HB   GLU   7          HB2       GLU   7  11.509 -10.292   1.814
   48   2HB   GLU   7          HB3       GLU   7  12.681  -9.473   0.801
   49   1HG   GLU   7          HG2       GLU   7  11.786  -8.419   3.511
   50   2HG   GLU   7          HG3       GLU   7  13.158  -9.500   3.293
   51    H    PHE   8           H        PHE   8   9.178 -10.239   0.063
   52    HA   PHE   8           HA       PHE   8  10.170 -10.603  -2.573
   53   1HB   PHE   8          HB2       PHE   8   8.079 -11.843  -2.941
   54   2HB   PHE   8          HB3       PHE   8   8.895 -12.290  -1.450
   55    HD1  PHE   8           HD1      PHE   8   5.972 -10.459  -2.862
   56    HD2  PHE   8           HD2      PHE   8   7.817 -12.038   0.702
   57    HE1  PHE   8           HE1      PHE   8   3.865 -10.097  -1.606
   58    HE2  PHE   8           HE2      PHE   8   5.704 -11.671   1.952
   59    HZ   PHE   8           HZ       PHE   8   3.729 -10.694   0.802
   60    H    LEU   9           H        LEU   9   8.252  -7.958  -1.424
   61    HA   LEU   9           HA       LEU   9   7.069  -7.278  -4.024
   62   1HB   LEU   9          HB2       LEU   9   7.392  -5.639  -1.478
   63   2HB   LEU   9          HB3       LEU   9   6.412  -5.207  -2.872
   64    HG   LEU   9           HG       LEU   9   5.888  -7.562  -1.016
   65   1HD1  LEU   9          HD11      LEU   9   5.435  -5.304  -0.060
   66   2HD1  LEU   9          HD12      LEU   9   4.377  -4.947  -1.439
   67   3HD1  LEU   9          HD13      LEU   9   3.954  -6.246  -0.302
   68   1HD2  LEU   9          HD21      LEU   9   4.295  -6.511  -3.401
   69   2HD2  LEU   9          HD22      LEU   9   5.117  -8.087  -3.296
   70   3HD2  LEU   9          HD23      LEU   9   3.742  -7.747  -2.247
   71    H    ARG  10           H        ARG  10  10.146  -6.728  -2.550
   72    HA   ARG  10           HA       ARG  10  10.464  -4.055  -2.808
   73   1HB   ARG  10          HB2       ARG  10  12.741  -4.353  -2.200
   74   2HB   ARG  10          HB3       ARG  10  11.784  -5.613  -1.438
   75   1HG   ARG  10          HG2       ARG  10  12.520  -7.160  -3.369
   76   2HG   ARG  10          HG3       ARG  10  13.668  -5.885  -3.818
   77   1HD   ARG  10          HD2       ARG  10  14.664  -5.982  -1.549
   78   2HD   ARG  10          HD3       ARG  10  13.468  -7.210  -1.088
   79    HE   ARG  10           HE       ARG  10  15.087  -7.935  -3.415
   80   1HH1  ARG  10          HH22      ARG  10  14.934  -8.141   0.104
   81   2HH1  ARG  10          HH21      ARG  10  16.047  -9.483   0.149
   82   1HH2  ARG  10          HH12      ARG  10  16.467  -9.666  -3.260
   83   2HH2  ARG  10          HH11      ARG  10  16.872 -10.329  -1.699
   84    H    ASN  11           H        ASN  11  10.620  -5.914  -5.631
   85    HA   ASN  11           HA       ASN  11  11.412  -3.494  -7.113
   86   1HB   ASN  11          HB2       ASN  11  13.509  -4.893  -6.667
   87   2HB   ASN  11          HB3       ASN  11  12.788  -6.147  -7.686
   88   1HD2  ASN  11          HD21      ASN  11  14.528  -5.971  -9.216
   89   2HD2  ASN  11          HD22      ASN  11  14.671  -4.553 -10.255
   90    H    GLN  12           H        GLN  12   8.901  -5.245  -6.725
   91    HA   GLN  12           HA       GLN  12   8.381  -6.490  -9.271
   92   1HB   GLN  12          HB2       GLN  12   6.510  -5.556  -7.057
   93   2HB   GLN  12          HB3       GLN  12   5.985  -6.403  -8.517
   94   1HG   GLN  12          HG2       GLN  12   7.585  -8.283  -7.929
   95   2HG   GLN  12          HG3       GLN  12   7.881  -7.473  -6.388
   96   1HE2  GLN  12          HE21      GLN  12   7.057  -9.445  -5.336
   97   2HE2  GLN  12          HE22      GLN  12   5.321  -9.760  -5.323
   98    HA   PRO  13           HA       PRO  13   7.564  -3.165 -12.012
   99   1HB   PRO  13          HB2       PRO  13   4.981  -4.576 -12.712
  100   2HB   PRO  13          HB3       PRO  13   6.202  -3.857 -13.809
  101   1HG   PRO  13          HG2       PRO  13   6.196  -6.518 -13.389
  102   2HG   PRO  13          HG3       PRO  13   7.751  -5.623 -13.358
  103   1HD   PRO  13          HD2       PRO  13   6.064  -6.550 -11.032
  104   2HD   PRO  13          HD3       PRO  13   7.839  -6.650 -11.261
  105    H    GLN  14           H        GLN  14   4.714  -3.974  -9.991
  106    HA   GLN  14           HA       GLN  14   3.582  -1.267 -10.267
  107   1HB   GLN  14          HB2       GLN  14   2.842  -3.597  -8.453
  108   2HB   GLN  14          HB3       GLN  14   1.975  -2.058  -8.549
  109   1HG   GLN  14          HG2       GLN  14   1.637  -2.456 -11.012
  110   2HG   GLN  14          HG3       GLN  14   2.309  -4.074 -10.816
  111   1HE2  GLN  14          HE21      GLN  14  -0.524  -2.948 -11.493
  112   2HE2  GLN  14          HE22      GLN  14  -1.557  -3.842 -10.394
  113    H    PHE  15           H        PHE  15   5.610  -2.978  -7.899
  114    HA   PHE  15           HA       PHE  15   5.415  -1.015  -5.770
  115   1HB   PHE  15          HB2       PHE  15   6.021  -3.412  -5.477
  116   2HB   PHE  15          HB3       PHE  15   7.506  -3.142  -6.379
  117    HD1  PHE  15           HD1      PHE  15   5.837  -2.825  -3.140
  118    HD2  PHE  15           HD2      PHE  15   9.365  -1.794  -5.394
  119    HE1  PHE  15           HE1      PHE  15   7.053  -2.355  -1.027
  120    HE2  PHE  15           HE2      PHE  15  10.562  -1.286  -3.280
  121    HZ   PHE  15           HZ       PHE  15   9.416  -1.569  -1.099
  122    H    GLN  16           H        GLN  16   7.459  -1.378  -8.613
  123    HA   GLN  16           HA       GLN  16   9.334   0.725  -8.148
  124   1HB   GLN  16          HB2       GLN  16   8.079  -0.539 -10.598
  125   2HB   GLN  16          HB3       GLN  16   9.297   0.740 -10.736
  126   1HG   GLN  16          HG2       GLN  16  10.928  -0.625  -9.513
  127   2HG   GLN  16          HG3       GLN  16   9.750  -1.914  -9.294
  128   1HE2  GLN  16          HE22      GLN  16  12.090  -2.648 -10.481
  129   2HE2  GLN  16          HE21      GLN  16  11.851  -2.877 -12.209
  130    H    GLN  17           H        GLN  17   5.895   0.980  -8.720
  131    HA   GLN  17           HA       GLN  17   6.160   3.812  -9.674
  132   1HB   GLN  17          HB2       GLN  17   4.185   1.646 -10.487
  133   2HB   GLN  17          HB3       GLN  17   4.160   3.329 -11.034
  134   1HG   GLN  17          HG2       GLN  17   6.423   3.013 -12.042
  135   2HG   GLN  17          HG3       GLN  17   6.402   1.320 -11.550
  136   1HE2  GLN  17          HE21      GLN  17   5.184  -0.186 -12.760
  137   2HE2  GLN  17          HE22      GLN  17   4.342   0.273 -14.242
  138    H    MET  18           H        MET  18   3.771   1.628  -7.991
  139    HA   MET  18           HA       MET  18   1.894   3.629  -7.378
  140   1HB   MET  18          HB2       MET  18   0.960   2.039  -5.873
  141   2HB   MET  18          HB3       MET  18   1.526   1.216  -7.322
  142   1HG   MET  18          HG2       MET  18   3.635   0.574  -6.004
  143   2HG   MET  18          HG3       MET  18   2.860   1.240  -4.575
  144   1HE   MET  18          HE1       MET  18   3.927  -1.547  -4.199
  145   2HE   MET  18          HE2       MET  18   2.841  -0.763  -3.029
  146   3HE   MET  18          HE3       MET  18   2.526  -2.428  -3.557
  147    H    ARG  19           H        ARG  19   4.790   2.761  -5.596
  148    HA   ARG  19           HA       ARG  19   4.330   4.292  -3.207
  149   1HB   ARG  19          HB2       ARG  19   6.974   3.569  -4.543
  150   2HB   ARG  19          HB3       ARG  19   6.692   3.937  -2.838
  151   1HG   ARG  19          HG2       ARG  19   5.083   1.913  -2.837
  152   2HG   ARG  19          HG3       ARG  19   5.723   1.505  -4.419
  153   1HD   ARG  19          HD2       ARG  19   7.291   1.583  -1.825
  154   2HD   ARG  19          HD3       ARG  19   6.881   0.183  -2.820
  155    HE   ARG  19           HE       ARG  19   8.486   0.871  -4.442
  156   1HH1  ARG  19          HH22      ARG  19   8.461   3.126  -1.750
  157   2HH1  ARG  19          HH21      ARG  19  10.091   3.658  -2.064
  158   1HH2  ARG  19          HH12      ARG  19  10.659   1.467  -4.641
  159   2HH2  ARG  19          HH11      ARG  19  11.307   2.717  -3.599
  160    H    GLN  20           H        GLN  20   5.692   5.168  -6.337
  161    HA   GLN  20           HA       GLN  20   6.747   7.753  -5.570
  162   1HB   GLN  20          HB2       GLN  20   5.724   6.903  -8.309
  163   2HB   GLN  20          HB3       GLN  20   6.728   8.291  -7.927
  164   1HG   GLN  20          HG2       GLN  20   8.435   6.627  -6.936
  165   2HG   GLN  20          HG3       GLN  20   7.497   5.350  -7.711
  166   1HE2  GLN  20          HE21      GLN  20   8.845   4.670  -9.411
  167   2HE2  GLN  20          HE22      GLN  20   9.706   5.785 -10.457
  168    H    ILE  21           H        ILE  21   3.536   6.594  -6.458
  169    HA   ILE  21           HA       ILE  21   2.344   9.141  -6.870
  170    HB   ILE  21           HB       ILE  21   0.905   6.645  -5.849
  171   1HG1  ILE  21          HG12      ILE  21   1.786   7.305  -8.677
  172   2HG1  ILE  21          HG13      ILE  21   2.298   5.928  -7.706
  173   1HG2  ILE  21          HG21      ILE  21  -1.013   7.603  -7.019
  174   2HG2  ILE  21          HG22      ILE  21  -0.359   8.802  -5.908
  175   3HG2  ILE  21          HG23      ILE  21  -0.006   8.930  -7.646
  176   1HD1  ILE  21          HD11      ILE  21   0.754   5.094  -9.286
  177   2HD1  ILE  21          HD12      ILE  21  -0.014   5.032  -7.694
  178   3HD1  ILE  21          HD13      ILE  21  -0.470   6.307  -8.860
  179    H    ILE  22           H        ILE  22   2.693   7.008  -4.075
  180    HA   ILE  22           HA       ILE  22   1.244   8.630  -2.157
  181    HB   ILE  22           HB       ILE  22   3.296   6.444  -1.625
  182   1HG1  ILE  22          HG12      ILE  22   1.730   5.285  -2.909
  183   2HG1  ILE  22          HG13      ILE  22   1.203   4.997  -1.268
  184   1HG2  ILE  22          HG21      ILE  22   1.038   7.494   0.126
  185   2HG2  ILE  22          HG22      ILE  22   2.124   6.137   0.501
  186   3HG2  ILE  22          HG23      ILE  22   2.775   7.766   0.387
  187   1HD1  ILE  22          HD11      ILE  22  -0.466   6.942  -1.619
  188   2HD1  ILE  22          HD12      ILE  22  -0.081   6.804  -3.344
  189   3HD1  ILE  22          HD13      ILE  22  -0.773   5.419  -2.489
  190    H    GLN  23           H        GLN  23   4.668   8.341  -3.004
  191    HA   GLN  23           HA       GLN  23   5.716  10.133  -1.040
  192   1HB   GLN  23          HB2       GLN  23   6.655   8.993  -3.675
  193   2HB   GLN  23          HB3       GLN  23   7.678  10.118  -2.760
  194   1HG   GLN  23          HG2       GLN  23   7.666   8.686  -0.810
  195   2HG   GLN  23          HG3       GLN  23   6.528   7.560  -1.548
  196   1HE2  GLN  23          HE21      GLN  23   9.406   7.251  -0.519
  197   2HE2  GLN  23          HE22      GLN  23  10.152   6.384  -1.849
  198    H    GLN  24           H        GLN  24   3.579  11.006  -3.378
  199    HA   GLN  24           HA       GLN  24   4.466  13.876  -3.318
  200   1HB   GLN  24          HB2       GLN  24   3.010  12.483  -5.604
  201   2HB   GLN  24          HB3       GLN  24   3.492  14.184  -5.543
  202   1HG   GLN  24          HG2       GLN  24   5.861  13.519  -5.535
  203   2HG   GLN  24          HG3       GLN  24   5.376  11.813  -5.469
  204   1HE2  GLN  24          HE21      GLN  24   4.898  10.742  -7.362
  205   2HE2  GLN  24          HE22      GLN  24   4.890  11.515  -8.952
  206    H    ASN  25           H        ASN  25   1.830  11.564  -3.494
  207    HA   ASN  25           HA       ASN  25   0.032  13.431  -2.003
  208   1HB   ASN  25          HB2       ASN  25  -0.531  11.752  -4.440
  209   2HB   ASN  25          HB3       ASN  25  -1.811  12.034  -3.253
  210   1HD2  ASN  25          HD21      ASN  25  -2.082  14.374  -2.504
  211   2HD2  ASN  25          HD22      ASN  25  -2.099  15.525  -3.838
  212    HA   PRO  26           HA       PRO  26   0.873   9.674   0.548
  213   1HB   PRO  26          HB2       PRO  26   0.845  10.929   3.000
  214   2HB   PRO  26          HB3       PRO  26   2.277  10.840   1.928
  215   1HG   PRO  26          HG2       PRO  26   0.260  13.095   2.134
  216   2HG   PRO  26          HG3       PRO  26   2.054  13.206   2.211
  217   1HD   PRO  26          HD2       PRO  26   0.709  13.698  -0.044
  218   2HD   PRO  26          HD3       PRO  26   2.226  12.741  -0.123
  219    H    SER  27           H        SER  27  -1.686  12.100   0.780
  220    HA   SER  27           HA       SER  27  -3.587  10.776   2.374
  221   1HB   SER  27          HB2       SER  27  -4.141  12.414  -0.123
  222   2HB   SER  27          HB3       SER  27  -5.224  12.172   1.254
  223    HG   SER  27           HG       SER  27  -3.779  13.353   2.531
  224    H    LEU  28           H        LEU  28  -2.431   9.765  -0.746
  225    HA   LEU  28           HA       LEU  28  -4.814   8.082  -1.265
  226   1HB   LEU  28          HB2       LEU  28  -2.313   8.514  -2.931
  227   2HB   LEU  28          HB3       LEU  28  -3.752   7.611  -3.407
  228    HG   LEU  28           HG       LEU  28  -3.524  10.610  -2.985
  229   1HD1  LEU  28          HD11      LEU  28  -2.697   9.659  -5.126
  230   2HD1  LEU  28          HD12      LEU  28  -4.275   8.876  -5.374
  231   3HD1  LEU  28          HD13      LEU  28  -4.146  10.652  -5.371
  232   1HD2  LEU  28          HD21      LEU  28  -5.881  10.768  -3.708
  233   2HD2  LEU  28          HD22      LEU  28  -6.039   8.998  -3.586
  234   3HD2  LEU  28          HD23      LEU  28  -5.731   9.986  -2.135
  235    H    LEU  29           H        LEU  29  -2.142   7.635   0.688
  236    HA   LEU  29           HA       LEU  29  -1.388   4.967   0.084
  237   1HB   LEU  29          HB2       LEU  29  -0.233   6.375   1.698
  238   2HB   LEU  29          HB3       LEU  29  -1.596   6.390   2.773
  239    HG   LEU  29           HG       LEU  29  -1.387   3.983   3.203
  240   1HD1  LEU  29          HD11      LEU  29   0.988   4.113   1.298
  241   2HD1  LEU  29          HD12      LEU  29   0.652   2.764   2.406
  242   3HD1  LEU  29          HD13      LEU  29  -0.485   3.131   1.103
  243   1HD2  LEU  29          HD21      LEU  29   1.272   5.448   3.471
  244   2HD2  LEU  29          HD22      LEU  29  -0.112   5.593   4.577
  245   3HD2  LEU  29          HD23      LEU  29   0.737   4.047   4.428
  246    HA   PRO  30           HA       PRO  30  -5.426   3.548   2.609
  247   1HB   PRO  30          HB2       PRO  30  -7.112   5.901   1.754
  248   2HB   PRO  30          HB3       PRO  30  -7.205   4.943   3.243
  249   1HG   PRO  30          HG2       PRO  30  -6.082   7.467   2.940
  250   2HG   PRO  30          HG3       PRO  30  -5.650   6.330   4.269
  251   1HD   PRO  30          HD2       PRO  30  -4.047   7.191   1.973
  252   2HD   PRO  30          HD3       PRO  30  -3.543   6.260   3.403
  253    H    ALA  31           H        ALA  31  -5.761   5.698  -0.173
  254    HA   ALA  31           HA       ALA  31  -7.595   4.106  -1.648
  255   1HB   ALA  31          HB1       ALA  31  -7.198   6.582  -1.754
  256   2HB   ALA  31          HB2       ALA  31  -5.711   6.268  -2.672
  257   3HB   ALA  31          HB3       ALA  31  -7.278   5.780  -3.344
  258    H    LEU  32           H        LEU  32  -4.192   3.575  -1.218
  259    HA   LEU  32           HA       LEU  32  -3.976   1.958  -3.717
  260   1HB   LEU  32          HB2       LEU  32  -2.200   3.567  -3.283
  261   2HB   LEU  32          HB3       LEU  32  -1.985   2.906  -1.650
  262    HG   LEU  32           HG       LEU  32  -1.100   0.837  -2.519
  263   1HD1  LEU  32          HD11      LEU  32  -0.654   0.517  -4.938
  264   2HD1  LEU  32          HD12      LEU  32  -2.378   0.572  -4.600
  265   3HD1  LEU  32          HD13      LEU  32  -1.575   2.000  -5.298
  266   1HD2  LEU  32          HD21      LEU  32   0.992   1.699  -3.433
  267   2HD2  LEU  32          HD22      LEU  32   0.196   3.200  -3.946
  268   3HD2  LEU  32          HD23      LEU  32   0.370   2.828  -2.217
  269    H    LEU  33           H        LEU  33  -3.806   1.737  -0.139
  270    HA   LEU  33           HA       LEU  33  -3.594  -1.113   0.076
  271   1HB   LEU  33          HB2       LEU  33  -4.992   0.981   1.780
  272   2HB   LEU  33          HB3       LEU  33  -4.751  -0.695   2.277
  273    HG   LEU  33           HG       LEU  33  -2.328   0.938   1.456
  274   1HD1  LEU  33          HD11      LEU  33  -3.503   2.385   2.978
  275   2HD1  LEU  33          HD12      LEU  33  -3.718   1.066   4.155
  276   3HD1  LEU  33          HD13      LEU  33  -2.086   1.693   3.784
  277   1HD2  LEU  33          HD21      LEU  33  -1.226  -0.499   3.103
  278   2HD2  LEU  33          HD22      LEU  33  -2.779  -1.255   3.522
  279   3HD2  LEU  33          HD23      LEU  33  -2.083  -1.479   1.902
  280    H    GLN  34           H        GLN  34  -6.488   1.010  -0.248
  281    HA   GLN  34           HA       GLN  34  -8.420  -1.054  -0.451
  282   1HB   GLN  34          HB2       GLN  34  -8.929   1.316  -0.037
  283   2HB   GLN  34          HB3       GLN  34  -8.353   1.746  -1.645
  284   1HG   GLN  34          HG2       GLN  34 -10.785   1.739  -1.568
  285   2HG   GLN  34          HG3       GLN  34 -10.217   0.508  -2.681
  286   1HE2  GLN  34          HE21      GLN  34 -10.412  -1.777  -2.007
  287   2HE2  GLN  34          HE22      GLN  34 -11.574  -2.201  -0.747
  288    H    GLN  35           H        GLN  35  -6.104   0.111  -2.887
  289    HA   GLN  35           HA       GLN  35  -7.541  -1.155  -5.116
  290   1HB   GLN  35          HB2       GLN  35  -6.409   0.898  -5.564
  291   2HB   GLN  35          HB3       GLN  35  -4.906   0.341  -4.813
  292   1HG   GLN  35          HG2       GLN  35  -4.509  -1.247  -6.542
  293   2HG   GLN  35          HG3       GLN  35  -6.071  -0.906  -7.317
  294   1HE2  GLN  35          HE21      GLN  35  -3.803  -0.792  -8.822
  295   2HE2  GLN  35          HE22      GLN  35  -3.400   0.886  -9.214
  296    H    ILE  36           H        ILE  36  -4.631  -1.825  -3.141
  297    HA   ILE  36           HA       ILE  36  -3.970  -4.361  -4.272
  298    HB   ILE  36           HB       ILE  36  -3.638  -3.328  -1.454
  299   1HG1  ILE  36          HG12      ILE  36  -1.501  -3.574  -3.622
  300   2HG1  ILE  36          HG13      ILE  36  -2.465  -2.115  -3.462
  301   1HG2  ILE  36          HG21      ILE  36  -2.368  -5.745  -2.865
  302   2HG2  ILE  36          HG22      ILE  36  -1.886  -5.144  -1.265
  303   3HG2  ILE  36          HG23      ILE  36  -3.486  -5.827  -1.501
  304   1HD1  ILE  36          HD11      ILE  36  -0.416  -1.777  -2.276
  305   2HD1  ILE  36          HD12      ILE  36  -1.735  -1.885  -1.089
  306   3HD1  ILE  36          HD13      ILE  36  -0.635  -3.265  -1.336
  307    H    GLY  37           H        GLY  37  -6.369  -3.474  -1.699
  308   1HA   GLY  37          HA2       GLY  37  -7.444  -6.012  -1.215
  309   2HA   GLY  37          HA3       GLY  37  -8.300  -4.477  -1.065
  310    H    ARG  38           H        ARG  38  -7.551  -4.564  -4.292
  311    HA   ARG  38           HA       ARG  38  -9.783  -6.393  -5.116
  312   1HB   ARG  38          HB2       ARG  38  -8.922  -3.737  -6.300
  313   2HB   ARG  38          HB3       ARG  38 -10.167  -4.797  -6.962
  314   1HG   ARG  38          HG2       ARG  38 -10.277  -3.554  -4.166
  315   2HG   ARG  38          HG3       ARG  38 -11.023  -2.894  -5.615
  316   1HD   ARG  38          HD2       ARG  38 -12.445  -4.877  -5.850
  317   2HD   ARG  38          HD3       ARG  38 -11.662  -5.666  -4.488
  318    HE   ARG  38           HE       ARG  38 -13.580  -3.410  -4.399
  319   1HH1  ARG  38          HH22      ARG  38 -11.491  -5.490  -2.452
  320   2HH1  ARG  38          HH21      ARG  38 -12.449  -5.227  -1.021
  321   1HH2  ARG  38          HH12      ARG  38 -14.682  -3.081  -2.513
  322   2HH2  ARG  38          HH11      ARG  38 -14.178  -3.877  -1.048
  323    H    GLU  39           H        GLU  39  -6.519  -5.155  -6.021
  324    HA   GLU  39           HA       GLU  39  -6.269  -6.996  -8.258
  325   1HB   GLU  39          HB2       GLU  39  -4.430  -5.072  -6.777
  326   2HB   GLU  39          HB3       GLU  39  -3.879  -6.132  -8.079
  327   1HG   GLU  39          HG2       GLU  39  -5.725  -5.129  -9.528
  328   2HG   GLU  39          HG3       GLU  39  -5.966  -3.925  -8.258
  329    H    ASN  40           H        ASN  40  -5.303  -7.049  -4.844
  330    HA   ASN  40           HA       ASN  40  -4.737  -9.902  -4.989
  331   1HB   ASN  40          HB2       ASN  40  -2.526  -8.686  -5.536
  332   2HB   ASN  40          HB3       ASN  40  -2.540  -8.107  -3.885
  333   1HD2  ASN  40          HD21      ASN  40  -0.679  -9.993  -5.299
  334   2HD2  ASN  40          HD22      ASN  40  -0.756 -11.481  -4.356
  335    HA   PRO  41           HA       PRO  41  -6.975  -8.143  -1.299
  336   1HB   PRO  41          HB2       PRO  41  -8.867 -10.150  -1.020
  337   2HB   PRO  41          HB3       PRO  41  -9.024  -8.710  -2.077
  338   1HG   PRO  41          HG2       PRO  41  -8.045 -11.459  -2.849
  339   2HG   PRO  41          HG3       PRO  41  -9.300 -10.462  -3.664
  340   1HD   PRO  41          HD2       PRO  41  -6.792 -10.479  -4.595
  341   2HD   PRO  41          HD3       PRO  41  -7.652  -8.917  -4.455
  342    H    GLN  42           H        GLN  42  -5.332 -11.229  -1.734
  343    HA   GLN  42           HA       GLN  42  -5.212 -11.675   1.186
  344   1HB   GLN  42          HB2       GLN  42  -3.623 -13.374   0.701
  345   2HB   GLN  42          HB3       GLN  42  -5.224 -13.667  -0.030
  346   1HG   GLN  42          HG2       GLN  42  -4.280 -12.968  -2.241
  347   2HG   GLN  42          HG3       GLN  42  -2.681 -12.812  -1.487
  348   1HE2  GLN  42          HE21      GLN  42  -3.470 -14.609  -3.710
  349   2HE2  GLN  42          HE22      GLN  42  -3.136 -16.231  -3.112
  350    H    LEU  43           H        LEU  43  -2.962 -10.351  -1.334
  351    HA   LEU  43           HA       LEU  43  -0.777  -9.913   0.460
  352   1HB   LEU  43          HB2       LEU  43  -0.741  -9.605  -2.049
  353   2HB   LEU  43          HB3       LEU  43  -1.743  -8.163  -1.836
  354    HG   LEU  43           HG       LEU  43  -0.007  -6.995  -0.680
  355   1HD1  LEU  43          HD11      LEU  43   1.094  -8.756   0.603
  356   2HD1  LEU  43          HD12      LEU  43   1.637  -9.554  -0.892
  357   3HD1  LEU  43          HD13      LEU  43   2.286  -7.962  -0.419
  358   1HD2  LEU  43          HD21      LEU  43   1.605  -6.770  -2.472
  359   2HD2  LEU  43          HD22      LEU  43   1.159  -8.363  -3.130
  360   3HD2  LEU  43          HD23      LEU  43  -0.005  -7.017  -3.155
  361    H    LEU  44           H        LEU  44  -3.837  -8.409   0.106
  362    HA   LEU  44           HA       LEU  44  -3.161  -5.878   1.409
  363   1HB   LEU  44          HB2       LEU  44  -5.113  -6.313  -0.197
  364   2HB   LEU  44          HB3       LEU  44  -5.941  -7.116   1.093
  365    HG   LEU  44           HG       LEU  44  -6.314  -4.572   0.477
  366   1HD1  LEU  44          HD11      LEU  44  -7.282  -4.131   2.593
  367   2HD1  LEU  44          HD12      LEU  44  -7.609  -5.790   2.089
  368   3HD1  LEU  44          HD13      LEU  44  -6.382  -5.475   3.353
  369   1HD2  LEU  44          HD21      LEU  44  -5.270  -2.974   1.951
  370   2HD2  LEU  44          HD22      LEU  44  -4.250  -4.213   2.688
  371   3HD2  LEU  44          HD23      LEU  44  -4.025  -3.767   0.974
  372    H    GLN  45           H        GLN  45  -5.089  -8.637   2.391
  373    HA   GLN  45           HA       GLN  45  -5.193  -8.242   5.199
  374   1HB   GLN  45          HB2       GLN  45  -5.089 -10.800   3.565
  375   2HB   GLN  45          HB3       GLN  45  -5.387 -10.774   5.305
  376   1HG   GLN  45          HG2       GLN  45  -7.414  -9.499   5.049
  377   2HG   GLN  45          HG3       GLN  45  -7.103  -9.204   3.336
  378   1HE2  GLN  45          HE21      GLN  45  -7.549 -10.840   1.810
  379   2HE2  GLN  45          HE22      GLN  45  -8.421 -12.311   2.254
  380    H    GLN  46           H        GLN  46  -2.459  -9.594   3.311
  381    HA   GLN  46           HA       GLN  46  -0.825 -10.243   5.632
  382   1HB   GLN  46          HB2       GLN  46  -0.296  -9.830   2.666
  383   2HB   GLN  46          HB3       GLN  46   0.995 -10.181   3.807
  384   1HG   GLN  46          HG2       GLN  46   0.021 -12.329   4.383
  385   2HG   GLN  46          HG3       GLN  46  -1.468 -11.958   3.529
  386   1HE2  GLN  46          HE21      GLN  46  -1.234 -13.917   2.246
  387   2HE2  GLN  46          HE22      GLN  46  -0.054 -13.958   0.935
  388    H    ILE  47           H        ILE  47  -0.855  -7.394   3.403
  389    HA   ILE  47           HA       ILE  47   1.102  -5.857   4.792
  390    HB   ILE  47           HB       ILE  47  -1.212  -5.173   2.976
  391   1HG1  ILE  47          HG12      ILE  47   1.808  -4.826   2.698
  392   2HG1  ILE  47          HG13      ILE  47   0.968  -6.296   2.201
  393   1HG2  ILE  47          HG21      ILE  47  -0.264  -2.818   2.923
  394   2HG2  ILE  47          HG22      ILE  47  -1.111  -3.229   4.408
  395   3HG2  ILE  47          HG23      ILE  47   0.666  -3.226   4.378
  396   1HD1  ILE  47          HD11      ILE  47   1.306  -4.949   0.258
  397   2HD1  ILE  47          HD12      ILE  47  -0.432  -4.950   0.639
  398   3HD1  ILE  47          HD13      ILE  47   0.572  -3.528   1.018
  399    H    SER  48           H        SER  48  -2.392  -6.239   5.378
  400    HA   SER  48           HA       SER  48  -2.610  -4.278   7.462
  401   1HB   SER  48          HB2       SER  48  -4.247  -6.813   7.062
  402   2HB   SER  48          HB3       SER  48  -4.676  -5.449   8.102
  403    HG   SER  48           HG       SER  48  -4.342  -5.402   5.285
  404    H    GLN  49           H        GLN  49  -1.611  -7.668   7.548
  405    HA   GLN  49           HA       GLN  49  -1.354  -7.865  10.442
  406   1HB   GLN  49          HB2       GLN  49  -0.578  -9.543   8.038
  407   2HB   GLN  49          HB3       GLN  49   0.000  -9.976   9.643
  408   1HG   GLN  49          HG2       GLN  49  -2.257 -10.201  10.497
  409   2HG   GLN  49          HG3       GLN  49  -2.948  -9.542   9.014
  410   1HE2  GLN  49          HE21      GLN  49  -2.917 -10.830   7.085
  411   2HE2  GLN  49          HE22      GLN  49  -2.696 -12.586   7.181
  412    H    HIS  50           H        HIS  50   0.595  -6.309   8.089
  413    HA   HIS  50           HA       HIS  50   2.991  -6.292   9.875
  414   1HB   HIS  50          HB2       HIS  50   2.943  -6.688   6.860
  415   2HB   HIS  50          HB3       HIS  50   4.387  -6.615   7.867
  416    HD1  HIS  50           HD1      HIS  50   3.442  -8.744  10.128
  417    HD2  HIS  50           HD2      HIS  50   3.174  -9.129   5.955
  418    HE1  HIS  50           HE1      HIS  50   3.467 -11.238   9.642
  419    H    GLN  51           H        GLN  51   0.839  -4.209   9.299
  420    HA   GLN  51           HA       GLN  51   1.468  -2.632   7.194
  421   1HB   GLN  51          HB2       GLN  51  -0.607  -2.732   8.725
  422   2HB   GLN  51          HB3       GLN  51   0.182  -1.454   9.667
  423   1HG   GLN  51          HG2       GLN  51   0.266  -0.040   7.606
  424   2HG   GLN  51          HG3       GLN  51  -0.430  -1.378   6.682
  425   1HE2  GLN  51          HE21      GLN  51  -2.265  -0.085   6.027
  426   2HE2  GLN  51          HE22      GLN  51  -3.525   0.309   7.198
  427    H    GLU  52           H        GLU  52   2.921  -2.167  10.412
  428    HA   GLU  52           HA       GLU  52   4.212   0.357   9.807
  429   1HB   GLU  52          HB2       GLU  52   4.936  -1.846  11.781
  430   2HB   GLU  52          HB3       GLU  52   5.721  -0.265  11.695
  431   1HG   GLU  52          HG2       GLU  52   3.535   0.842  12.126
  432   2HG   GLU  52          HG3       GLU  52   2.767  -0.734  12.280
  433    H    HIS  53           H        HIS  53   5.256  -3.056   9.407
  434    HA   HIS  53           HA       HIS  53   7.873  -2.399   8.335
  435   1HB   HIS  53          HB2       HIS  53   6.229  -4.942   8.046
  436   2HB   HIS  53          HB3       HIS  53   7.942  -4.758   7.700
  437    HD1  HIS  53           HD1      HIS  53   6.006  -6.244  10.287
  438    HD2  HIS  53           HD2      HIS  53   9.206  -3.519  10.199
  439    HE1  HIS  53           HE1      HIS  53   7.117  -6.371  12.571
  440    H    PHE  54           H        PHE  54   4.627  -2.838   6.927
  441    HA   PHE  54           HA       PHE  54   5.476  -2.791   4.172
  442   1HB   PHE  54          HB2       PHE  54   3.217  -3.501   4.724
  443   2HB   PHE  54          HB3       PHE  54   2.856  -1.929   5.438
  444    HD1  PHE  54           HD1      PHE  54   1.650  -0.409   4.121
  445    HD2  PHE  54           HD2      PHE  54   4.189  -3.296   2.167
  446    HE1  PHE  54           HE1      PHE  54   0.924   0.442   1.906
  447    HE2  PHE  54           HE2      PHE  54   3.476  -2.425  -0.041
  448    HZ   PHE  54           HZ       PHE  54   1.839  -0.558  -0.175
  449    H    ILE  55           H        ILE  55   4.417  -0.089   6.364
  450    HA   ILE  55           HA       ILE  55   4.892   1.993   4.507
  451    HB   ILE  55           HB       ILE  55   4.871   1.991   7.476
  452   1HG1  ILE  55          HG12      ILE  55   3.013   3.089   5.303
  453   2HG1  ILE  55          HG13      ILE  55   2.792   1.536   6.114
  454   1HG2  ILE  55          HG21      ILE  55   4.845   4.493   7.352
  455   2HG2  ILE  55          HG22      ILE  55   6.380   3.856   6.805
  456   3HG2  ILE  55          HG23      ILE  55   5.190   4.409   5.613
  457   1HD1  ILE  55          HD11      ILE  55   2.614   4.277   7.381
  458   2HD1  ILE  55          HD12      ILE  55   1.315   3.097   7.118
  459   3HD1  ILE  55          HD13      ILE  55   2.605   2.737   8.293
  460    H    GLN  56           H        GLN  56   7.212   0.417   6.749
  461    HA   GLN  56           HA       GLN  56   9.489   1.992   5.983
  462   1HB   GLN  56          HB2       GLN  56   9.215  -0.740   7.279
  463   2HB   GLN  56          HB3       GLN  56  10.766   0.064   7.053
  464   1HG   GLN  56          HG2       GLN  56   8.446   1.186   8.678
  465   2HG   GLN  56          HG3       GLN  56   9.869   0.389   9.334
  466   1HE2  GLN  56          HE21      GLN  56   8.613   3.386   9.091
  467   2HE2  GLN  56          HE22      GLN  56  10.099   4.307   8.887
  468    H    MET  57           H        MET  57   7.856  -0.151   3.987
  469    HA   MET  57           HA       MET  57  10.262  -0.555   2.226
  470   1HB   MET  57          HB2       MET  57   7.667  -2.107   2.459
  471   2HB   MET  57          HB3       MET  57   8.818  -2.300   1.131
  472   1HG   MET  57          HG2       MET  57   9.525  -2.655   4.068
  473   2HG   MET  57          HG3       MET  57   9.036  -3.961   3.001
  474   1HE   MET  57          HE1       MET  57  10.521  -3.664   0.266
  475   2HE   MET  57          HE2       MET  57  12.001  -4.563   0.662
  476   3HE   MET  57          HE3       MET  57  10.430  -5.123   1.278
  477    H    LEU  58           H        LEU  58   6.779   0.246   2.245
  478    HA   LEU  58           HA       LEU  58   6.212   1.301  -0.226
  479   1HB   LEU  58          HB2       LEU  58   4.703   0.722   1.435
  480   2HB   LEU  58          HB3       LEU  58   5.429   1.815   2.603
  481    HG   LEU  58           HG       LEU  58   3.160   2.246   1.654
  482   1HD1  LEU  58          HD11      LEU  58   4.377   3.761   3.152
  483   2HD1  LEU  58          HD12      LEU  58   5.137   4.554   1.752
  484   3HD1  LEU  58          HD13      LEU  58   3.382   4.646   1.994
  485   1HD2  LEU  58          HD21      LEU  58   2.910   3.617  -0.312
  486   2HD2  LEU  58          HD22      LEU  58   4.652   3.616  -0.621
  487   3HD2  LEU  58          HD23      LEU  58   3.716   2.107  -0.762
  488    H    ASN  59           H        ASN  59   7.862   2.960   2.530
  489    HA   ASN  59           HA       ASN  59   7.697   5.525   1.128
  490   1HB   ASN  59          HB2       ASN  59   7.079   4.993   3.561
  491   2HB   ASN  59          HB3       ASN  59   8.816   4.919   3.883
  492   1HD2  ASN  59          HD21      ASN  59   8.322   6.627   5.434
  493   2HD2  ASN  59          HD22      ASN  59   8.081   8.278   4.869
  494    H    GLU  60           H        GLU  60   9.964   3.149   0.907
  495    HA   GLU  60           HA       GLU  60  12.462   4.474   1.340
  496   1HB   GLU  60          HB2       GLU  60  11.582   2.010  -0.158
  497   2HB   GLU  60          HB3       GLU  60  13.282   2.497  -0.094
  498   1HG   GLU  60          HG2       GLU  60  11.544   2.024   2.365
  499   2HG   GLU  60          HG3       GLU  60  12.599   0.819   1.628
  500    HA   PRO  61           HA       PRO  61  12.978   6.853  -2.346
  501   1HB   PRO  61          HB2       PRO  61  15.689   6.875  -2.759
  502   2HB   PRO  61          HB3       PRO  61  14.868   7.739  -1.421
  503   1HG   PRO  61          HG2       PRO  61  16.226   5.042  -1.362
  504   2HG   PRO  61          HG3       PRO  61  16.394   6.396  -0.195
  505   1HD   PRO  61          HD2       PRO  61  14.757   4.259   0.239
  506   2HD   PRO  61          HD3       PRO  61  14.313   5.902   0.799
  507    H    VAL  62           H        VAL  62  12.656   6.496  -4.487
  508    HA   VAL  62           HA       VAL  62  13.257   3.933  -5.752
  509    HB   VAL  62           HB       VAL  62  12.171   5.054  -7.728
  510   1HG1  VAL  62          HG11      VAL  62   9.929   4.870  -6.826
  511   2HG1  VAL  62          HG12      VAL  62  10.956   3.605  -6.160
  512   3HG1  VAL  62          HG13      VAL  62  10.538   5.022  -5.161
  513   1HG2  VAL  62          HG21      VAL  62  12.646   7.442  -7.087
  514   2HG2  VAL  62          HG22      VAL  62  10.959   7.109  -7.487
  515   3HG2  VAL  62          HG23      VAL  62  11.434   7.289  -5.793
  516    H    GLN  63           H        GLN  63  15.048   6.763  -5.375
  517    HA   GLN  63           HA       GLN  63  16.962   7.581  -6.180
  518   1HB   GLN  63          HB2       GLN  63  17.399   4.868  -7.462
  519   2HB   GLN  63          HB3       GLN  63  18.622   6.094  -7.136
  520   1HG   GLN  63          HG2       GLN  63  18.170   5.906  -4.697
  521   2HG   GLN  63          HG3       GLN  63  17.000   4.623  -5.012
  522   1HE2  GLN  63          HE21      GLN  63  18.998   3.969  -3.300
  523   2HE2  GLN  63          HE22      GLN  63  20.161   2.922  -4.105
  524    H    GLU  64           H        GLU  64  14.528   7.031  -8.400
  525    HA   GLU  64           HA       GLU  64  15.825   7.925 -10.828
  526   1HB   GLU  64          HB2       GLU  64  12.911   8.069  -9.949
  527   2HB   GLU  64          HB3       GLU  64  13.516   8.466 -11.564
  528   1HG   GLU  64          HG2       GLU  64  14.489   6.103 -11.651
  529   2HG   GLU  64          HG3       GLU  64  13.536   5.750 -10.213
  530    H    ALA  65           H        ALA  65  15.628   9.957 -11.875
  531    HA   ALA  65           HA       ALA  65  15.155  12.360 -10.170
  532   1HB   ALA  65          HB1       ALA  65  17.549  11.756 -10.111
  533   2HB   ALA  65          HB2       ALA  65  17.608  11.791 -11.886
  534   3HB   ALA  65          HB3       ALA  65  17.299  13.282 -10.970
  535    H    GLY  66           H        GLY  66  13.898  10.942 -12.710
  536   1HA   GLY  66          HA2       GLY  66  12.447  11.681 -14.318
  537   2HA   GLY  66          HA3       GLY  66  12.798  13.337 -13.838
  538    H    GLY  67           H        GLY  67  15.442  13.649 -14.495
  539   1HA   GLY  67          HA2       GLY  67  16.287  12.716 -17.071
  540   2HA   GLY  67          HA3       GLY  67  15.367  14.212 -17.267
  541    H    GLN  68           H        GLN  68  17.549  13.420 -14.543
  542    HA   GLN  68           HA       GLN  68  19.579  15.370 -15.448
  543   1HB   GLN  68          HB2       GLN  68  17.818  16.670 -14.284
  544   2HB   GLN  68          HB3       GLN  68  17.963  15.631 -12.873
  545   1HG   GLN  68          HG2       GLN  68  19.068  17.808 -12.563
  546   2HG   GLN  68          HG3       GLN  68  20.205  16.480 -12.411
  547   1HE2  GLN  68          HE21      GLN  68  19.226  19.232 -14.481
  548   2HE2  GLN  68          HE22      GLN  68  20.682  19.179 -15.469
  549    H    GLY  69           H        GLY  69  21.561  15.195 -14.381
  550   1HA   GLY  69          HA2       GLY  69  22.107  13.415 -12.179
  551   2HA   GLY  69          HA3       GLY  69  22.520  12.651 -13.714
  552    H    GLY  70           H        GLY  70  23.007  16.079 -13.791
  553   1HA   GLY  70          HA2       GLY  70  25.749  16.080 -12.749
  554   2HA   GLY  70          HA3       GLY  70  25.626  16.095 -14.511
  555    H    GLY  71           H        GLY  71  23.253  17.737 -12.461
  556   1HA   GLY  71          HA2       GLY  71  24.343  20.357 -12.354
  557   2HA   GLY  71          HA3       GLY  71  23.411  20.204 -13.844
  558    H    GLY  72           H        GLY  72  22.375  22.037 -12.481
  559   1HA   GLY  72          HA2       GLY  72  19.741  21.248 -11.655
  560   2HA   GLY  72          HA3       GLY  72  20.716  21.636 -10.237
  Start of MODEL   11
    1   1H    GLY   1           H1       GLY   1  14.958  -8.527   9.883
    2   2H    GLY   1           H2       GLY   1  14.810  -9.026   8.327
    3   3H    GLY   1           H3       GLY   1  14.637  -7.435   8.697
    4   1HA   GLY   1          HA2       GLY   1  16.952  -7.308   9.401
    5   2HA   GLY   1          HA3       GLY   1  17.123  -9.005   8.922
    6    H    SER   2           H        SER   2  18.856  -8.142   7.546
    7    HA   SER   2           HA       SER   2  18.580  -6.184   5.559
    8   1HB   SER   2          HB2       SER   2  20.658  -7.168   4.624
    9   2HB   SER   2          HB3       SER   2  20.723  -6.912   6.372
   10    HG   SER   2           HG       SER   2  21.503  -8.986   5.759
   11    H    HIS   3           H        HIS   3  17.441  -9.464   5.368
   12    HA   HIS   3           HA       HIS   3  17.215  -9.796   2.550
   13   1HB   HIS   3          HB2       HIS   3  15.487 -11.439   3.132
   14   2HB   HIS   3          HB3       HIS   3  16.911 -11.609   4.145
   15    HD1  HIS   3           HD1      HIS   3  13.305 -10.197   4.407
   16    HD2  HIS   3           HD2      HIS   3  16.556 -11.416   6.772
   17    HE1  HIS   3           HE1      HIS   3  12.474 -10.196   6.805
   18    H    MET   4           H        MET   4  15.470  -7.661   4.644
   19    HA   MET   4           HA       MET   4  13.814  -6.189   4.448
   20   1HB   MET   4          HB2       MET   4  13.931  -6.639   1.443
   21   2HB   MET   4          HB3       MET   4  13.055  -5.349   2.246
   22   1HG   MET   4          HG2       MET   4  15.166  -4.499   3.220
   23   2HG   MET   4          HG3       MET   4  16.060  -5.774   2.375
   24   1HE   MET   4          HE1       MET   4  16.855  -2.733   2.198
   25   2HE   MET   4          HE2       MET   4  17.708  -4.041   1.349
   26   3HE   MET   4          HE3       MET   4  17.202  -2.587   0.462
   27    HA   PRO   5           HA       PRO   5  10.084  -8.584   4.602
   28   1HB   PRO   5          HB2       PRO   5   8.132  -6.708   4.842
   29   2HB   PRO   5          HB3       PRO   5   9.392  -6.927   6.094
   30   1HG   PRO   5          HG2       PRO   5   9.368  -4.931   3.811
   31   2HG   PRO   5          HG3       PRO   5   9.630  -4.582   5.551
   32   1HD   PRO   5          HD2       PRO   5  11.706  -4.890   3.856
   33   2HD   PRO   5          HD3       PRO   5  11.782  -5.536   5.522
   34    H    LEU   6           H        LEU   6   8.020  -9.030   3.528
   35    HA   LEU   6           HA       LEU   6   6.810  -9.613   1.675
   36   1HB   LEU   6          HB2       LEU   6   6.972  -6.594   1.399
   37   2HB   LEU   6          HB3       LEU   6   5.775  -7.600   0.584
   38    HG   LEU   6           HG       LEU   6   6.036  -7.525   3.619
   39   1HD1  LEU   6          HD11      LEU   6   5.525  -5.263   2.826
   40   2HD1  LEU   6          HD12      LEU   6   4.164  -5.896   1.864
   41   3HD1  LEU   6          HD13      LEU   6   4.139  -5.990   3.642
   42   1HD2  LEU   6          HD21      LEU   6   3.780  -8.407   1.765
   43   2HD2  LEU   6          HD22      LEU   6   4.817  -9.482   2.728
   44   3HD2  LEU   6          HD23      LEU   6   3.710  -8.367   3.539
   45    H    GLU   7           H        GLU   7   9.360 -10.270   1.094
   46    HA   GLU   7           HA       GLU   7  10.690  -9.037  -0.977
   47   1HB   GLU   7          HB2       GLU   7  10.667 -11.994  -0.270
   48   2HB   GLU   7          HB3       GLU   7  11.791 -11.245  -1.404
   49   1HG   GLU   7          HG2       GLU   7  12.428  -9.632   0.483
   50   2HG   GLU   7          HG3       GLU   7  11.564 -10.730   1.569
   51    H    PHE   8           H        PHE   8   7.966 -11.236  -1.454
   52    HA   PHE   8           HA       PHE   8   8.437 -11.742  -4.244
   53   1HB   PHE   8          HB2       PHE   8   6.169 -12.579  -4.282
   54   2HB   PHE   8          HB3       PHE   8   7.060 -13.192  -2.901
   55    HD1  PHE   8           HD1      PHE   8   6.476 -12.500  -0.588
   56    HD2  PHE   8           HD2      PHE   8   4.222 -11.138  -4.002
   57    HE1  PHE   8           HE1      PHE   8   4.616 -11.823   0.908
   58    HE2  PHE   8           HE2      PHE   8   2.349 -10.507  -2.510
   59    HZ   PHE   8           HZ       PHE   8   2.547 -10.844  -0.046
   60    H    LEU   9           H        LEU   9   7.611  -8.793  -2.783
   61    HA   LEU   9           HA       LEU   9   6.404  -7.675  -5.273
   62   1HB   LEU   9          HB2       LEU   9   7.019  -6.315  -2.627
   63   2HB   LEU   9          HB3       LEU   9   6.077  -5.673  -3.966
   64    HG   LEU   9           HG       LEU   9   5.268  -7.966  -2.134
   65   1HD1  LEU   9          HD11      LEU   9   5.174  -5.696  -1.154
   66   2HD1  LEU   9          HD12      LEU   9   4.183  -5.142  -2.521
   67   3HD1  LEU   9          HD13      LEU   9   3.553  -6.367  -1.399
   68   1HD2  LEU   9          HD21      LEU   9   3.729  -6.701  -4.446
   69   2HD2  LEU   9          HD22      LEU   9   4.382  -8.358  -4.414
   70   3HD2  LEU   9          HD23      LEU   9   3.107  -7.904  -3.285
   71    H    ARG  10           H        ARG  10   9.469  -8.034  -3.744
   72    HA   ARG  10           HA       ARG  10  10.393  -5.413  -3.764
   73   1HB   ARG  10          HB2       ARG  10  11.046  -7.357  -2.344
   74   2HB   ARG  10          HB3       ARG  10  12.087  -7.943  -3.648
   75   1HG   ARG  10          HG2       ARG  10  13.561  -6.071  -3.404
   76   2HG   ARG  10          HG3       ARG  10  12.350  -5.153  -2.497
   77   1HD   ARG  10          HD2       ARG  10  14.078  -5.893  -0.979
   78   2HD   ARG  10          HD3       ARG  10  12.541  -6.656  -0.589
   79    HE   ARG  10           HE       ARG  10  13.507  -8.719  -0.904
   80   1HH1  ARG  10          HH22      ARG  10  15.649  -6.436  -2.495
   81   2HH1  ARG  10          HH21      ARG  10  16.898  -7.645  -2.698
   82   1HH2  ARG  10          HH12      ARG  10  15.130 -10.153  -1.143
   83   2HH2  ARG  10          HH11      ARG  10  16.593  -9.705  -1.978
   84    H    ASN  11           H        ASN  11  10.240  -7.247  -6.561
   85    HA   ASN  11           HA       ASN  11  11.859  -5.196  -7.984
   86   1HB   ASN  11          HB2       ASN  11  13.172  -7.342  -7.603
   87   2HB   ASN  11          HB3       ASN  11  11.980  -8.180  -8.607
   88   1HD2  ASN  11          HD21      ASN  11  14.165  -5.292  -8.697
   89   2HD2  ASN  11          HD22      ASN  11  14.615  -5.542 -10.382
   90    H    GLN  12           H        GLN  12   8.812  -6.078  -7.582
   91    HA   GLN  12           HA       GLN  12   7.964  -6.858 -10.229
   92   1HB   GLN  12          HB2       GLN  12   6.400  -5.893  -7.806
   93   2HB   GLN  12          HB3       GLN  12   5.672  -6.506  -9.288
   94   1HG   GLN  12          HG2       GLN  12   7.510  -8.104  -7.456
   95   2HG   GLN  12          HG3       GLN  12   5.749  -8.224  -7.537
   96   1HE2  GLN  12          HE21      GLN  12   4.779  -9.049  -9.615
   97   2HE2  GLN  12          HE22      GLN  12   5.768 -10.121 -10.598
   98    HA   PRO  13           HA       PRO  13   7.919  -2.932 -12.281
   99   1HB   PRO  13          HB2       PRO  13   5.359  -3.966 -13.519
  100   2HB   PRO  13          HB3       PRO  13   6.735  -3.138 -14.311
  101   1HG   PRO  13          HG2       PRO  13   6.533  -5.821 -14.453
  102   2HG   PRO  13          HG3       PRO  13   8.122  -5.072 -14.082
  103   1HD   PRO  13          HD2       PRO  13   6.137  -6.319 -12.183
  104   2HD   PRO  13          HD3       PRO  13   7.922  -6.490 -12.245
  105    H    GLN  14           H        GLN  14   4.740  -3.877 -10.890
  106    HA   GLN  14           HA       GLN  14   3.806  -1.117 -10.772
  107   1HB   GLN  14          HB2       GLN  14   1.895  -1.973  -9.594
  108   2HB   GLN  14          HB3       GLN  14   2.174  -2.813 -11.104
  109   1HG   GLN  14          HG2       GLN  14   3.210  -4.025  -8.532
  110   2HG   GLN  14          HG3       GLN  14   1.491  -4.089  -8.899
  111   1HE2  GLN  14          HE21      GLN  14   0.792  -5.876 -10.084
  112   2HE2  GLN  14          HE22      GLN  14   1.868  -6.844 -11.083
  113    H    PHE  15           H        PHE  15   5.590  -3.176  -8.528
  114    HA   PHE  15           HA       PHE  15   5.054  -1.511  -6.175
  115   1HB   PHE  15          HB2       PHE  15   5.522  -3.971  -6.108
  116   2HB   PHE  15          HB3       PHE  15   7.169  -3.638  -6.640
  117    HD1  PHE  15           HD1      PHE  15   4.715  -2.588  -3.965
  118    HD2  PHE  15           HD2      PHE  15   8.815  -3.487  -4.952
  119    HE1  PHE  15           HE1      PHE  15   5.344  -2.375  -1.573
  120    HE2  PHE  15           HE2      PHE  15   9.431  -3.293  -2.555
  121    HZ   PHE  15           HZ       PHE  15   7.694  -2.743  -0.863
  122    H    GLN  16           H        GLN  16   7.419  -1.605  -8.759
  123    HA   GLN  16           HA       GLN  16   9.243   0.384  -7.717
  124   1HB   GLN  16          HB2       GLN  16   8.537  -0.608 -10.501
  125   2HB   GLN  16          HB3       GLN  16   9.812   0.580 -10.194
  126   1HG   GLN  16          HG2       GLN  16  10.994  -1.023  -8.741
  127   2HG   GLN  16          HG3       GLN  16   9.761  -2.247  -9.038
  128   1HE2  GLN  16          HE21      GLN  16  12.819  -1.857  -9.802
  129   2HE2  GLN  16          HE22      GLN  16  12.801  -2.336 -11.495
  130    H    GLN  17           H        GLN  17   5.957   0.726  -8.675
  131    HA   GLN  17           HA       GLN  17   6.342   3.613  -9.385
  132   1HB   GLN  17          HB2       GLN  17   4.366   1.568 -10.452
  133   2HB   GLN  17          HB3       GLN  17   4.354   3.301 -10.826
  134   1HG   GLN  17          HG2       GLN  17   6.646   3.116 -11.762
  135   2HG   GLN  17          HG3       GLN  17   6.649   1.386 -11.444
  136   1HE2  GLN  17          HE21      GLN  17   5.594  -0.005 -12.873
  137   2HE2  GLN  17          HE22      GLN  17   4.771   0.562 -14.332
  138    H    MET  18           H        MET  18   3.868   1.402  -7.840
  139    HA   MET  18           HA       MET  18   2.055   3.430  -7.199
  140   1HB   MET  18          HB2       MET  18   1.073   1.859  -5.686
  141   2HB   MET  18          HB3       MET  18   1.576   1.054  -7.168
  142   1HG   MET  18          HG2       MET  18   3.602   0.174  -5.990
  143   2HG   MET  18          HG3       MET  18   3.098   1.006  -4.519
  144   1HE   MET  18          HE1       MET  18   2.494  -2.075  -6.884
  145   2HE   MET  18          HE2       MET  18   0.983  -2.742  -6.235
  146   3HE   MET  18          HE3       MET  18   0.960  -1.192  -7.100
  147    H    ARG  19           H        ARG  19   4.889   2.472  -5.319
  148    HA   ARG  19           HA       ARG  19   4.349   4.068  -2.975
  149   1HB   ARG  19          HB2       ARG  19   7.032   3.159  -4.149
  150   2HB   ARG  19          HB3       ARG  19   6.718   3.656  -2.482
  151   1HG   ARG  19          HG2       ARG  19   5.046   1.769  -2.330
  152   2HG   ARG  19          HG3       ARG  19   5.598   1.175  -3.885
  153   1HD   ARG  19          HD2       ARG  19   7.623   1.673  -1.697
  154   2HD   ARG  19          HD3       ARG  19   6.691   0.160  -1.746
  155    HE   ARG  19           HE       ARG  19   7.588   0.236  -4.266
  156   1HH1  ARG  19          HH22      ARG  19   9.519   0.772  -1.367
  157   2HH1  ARG  19          HH21      ARG  19  10.922   0.035  -2.098
  158   1HH2  ARG  19          HH12      ARG  19   9.363  -0.571  -5.111
  159   2HH2  ARG  19          HH11      ARG  19  10.851  -0.689  -4.191
  160    H    GLN  20           H        GLN  20   5.814   4.845  -6.052
  161    HA   GLN  20           HA       GLN  20   6.963   7.399  -5.298
  162   1HB   GLN  20          HB2       GLN  20   5.930   6.622  -8.055
  163   2HB   GLN  20          HB3       GLN  20   6.993   7.954  -7.643
  164   1HG   GLN  20          HG2       GLN  20   8.620   6.197  -6.692
  165   2HG   GLN  20          HG3       GLN  20   7.630   4.985  -7.515
  166   1HE2  GLN  20          HE21      GLN  20   8.764   4.358  -9.383
  167   2HE2  GLN  20          HE22      GLN  20   9.546   5.505 -10.466
  168    H    ILE  21           H        ILE  21   3.725   6.358  -6.289
  169    HA   ILE  21           HA       ILE  21   2.615   8.935  -6.723
  170    HB   ILE  21           HB       ILE  21   1.100   6.482  -5.703
  171   1HG1  ILE  21          HG12      ILE  21   2.034   7.097  -8.522
  172   2HG1  ILE  21          HG13      ILE  21   2.473   5.710  -7.532
  173   1HG2  ILE  21          HG21      ILE  21  -0.114   8.672  -5.779
  174   2HG2  ILE  21          HG22      ILE  21   0.257   8.784  -7.513
  175   3HG2  ILE  21          HG23      ILE  21  -0.787   7.485  -6.887
  176   1HD1  ILE  21          HD11      ILE  21   0.910   4.930  -9.133
  177   2HD1  ILE  21          HD12      ILE  21   0.128   4.905  -7.547
  178   3HD1  ILE  21          HD13      ILE  21  -0.267   6.191  -8.723
  179    H    ILE  22           H        ILE  22   2.809   6.809  -3.907
  180    HA   ILE  22           HA       ILE  22   1.338   8.501  -2.078
  181    HB   ILE  22           HB       ILE  22   3.249   6.224  -1.438
  182   1HG1  ILE  22          HG12      ILE  22   1.703   5.140  -2.813
  183   2HG1  ILE  22          HG13      ILE  22   1.047   4.889  -1.212
  184   1HG2  ILE  22          HG21      ILE  22   1.923   5.978   0.609
  185   2HG2  ILE  22          HG22      ILE  22   2.673   7.568   0.544
  186   3HG2  ILE  22          HG23      ILE  22   0.940   7.389   0.166
  187   1HD1  ILE  22          HD11      ILE  22   0.009   6.759  -3.354
  188   2HD1  ILE  22          HD12      ILE  22  -0.798   5.395  -2.566
  189   3HD1  ILE  22          HD13      ILE  22  -0.492   6.892  -1.652
  190    H    GLN  23           H        GLN  23   4.776   8.107  -2.775
  191    HA   GLN  23           HA       GLN  23   5.816   9.878  -0.790
  192   1HB   GLN  23          HB2       GLN  23   6.777   8.753  -3.428
  193   2HB   GLN  23          HB3       GLN  23   7.788   9.875  -2.497
  194   1HG   GLN  23          HG2       GLN  23   7.805   8.408  -0.570
  195   2HG   GLN  23          HG3       GLN  23   6.610   7.336  -1.295
  196   1HE2  GLN  23          HE21      GLN  23   7.889   5.484  -1.205
  197   2HE2  GLN  23          HE22      GLN  23   9.445   5.343  -1.994
  198    H    GLN  24           H        GLN  24   3.729  10.771  -3.195
  199    HA   GLN  24           HA       GLN  24   4.635  13.636  -3.107
  200   1HB   GLN  24          HB2       GLN  24   3.172  12.254  -5.394
  201   2HB   GLN  24          HB3       GLN  24   3.681  13.947  -5.337
  202   1HG   GLN  24          HG2       GLN  24   6.037  13.253  -5.329
  203   2HG   GLN  24          HG3       GLN  24   5.534  11.553  -5.232
  204   1HE2  GLN  24          HE21      GLN  24   5.138  10.445  -7.107
  205   2HE2  GLN  24          HE22      GLN  24   5.102  11.190  -8.710
  206    H    ASN  25           H        ASN  25   1.964  11.360  -3.306
  207    HA   ASN  25           HA       ASN  25   0.203  13.247  -1.796
  208   1HB   ASN  25          HB2       ASN  25  -0.378  11.696  -4.297
  209   2HB   ASN  25          HB3       ASN  25  -1.657  11.845  -3.087
  210   1HD2  ASN  25          HD21      ASN  25  -2.112  14.044  -2.212
  211   2HD2  ASN  25          HD22      ASN  25  -2.062  15.358  -3.388
  212    HA   PRO  26           HA       PRO  26   0.740   9.452   0.767
  213   1HB   PRO  26          HB2       PRO  26   0.775  10.702   3.205
  214   2HB   PRO  26          HB3       PRO  26   2.218  10.520   2.158
  215   1HG   PRO  26          HG2       PRO  26   0.367  12.910   2.357
  216   2HG   PRO  26          HG3       PRO  26   2.162  12.892   2.450
  217   1HD   PRO  26          HD2       PRO  26   0.857  13.484   0.178
  218   2HD   PRO  26          HD3       PRO  26   2.340  12.478   0.118
  219    H    SER  27           H        SER  27  -1.583  12.065   0.711
  220    HA   SER  27           HA       SER  27  -3.732  11.011   2.230
  221   1HB   SER  27          HB2       SER  27  -5.112  12.403   0.651
  222   2HB   SER  27          HB3       SER  27  -3.788  13.263   1.446
  223    HG   SER  27           HG       SER  27  -4.005  13.621  -0.860
  224    H    LEU  28           H        LEU  28  -2.393   9.825  -0.771
  225    HA   LEU  28           HA       LEU  28  -4.812   8.192  -1.329
  226   1HB   LEU  28          HB2       LEU  28  -2.300   8.652  -2.974
  227   2HB   LEU  28          HB3       LEU  28  -3.693   7.690  -3.462
  228    HG   LEU  28           HG       LEU  28  -3.633  10.701  -3.042
  229   1HD1  LEU  28          HD11      LEU  28  -2.646   9.815  -5.143
  230   2HD1  LEU  28          HD12      LEU  28  -4.161   8.941  -5.471
  231   3HD1  LEU  28          HD13      LEU  28  -4.139  10.720  -5.451
  232   1HD2  LEU  28          HD21      LEU  28  -5.837   9.933  -2.299
  233   2HD2  LEU  28          HD22      LEU  28  -5.972  10.688  -3.887
  234   3HD2  LEU  28          HD23      LEU  28  -6.002   8.915  -3.752
  235    H    LEU  29           H        LEU  29  -2.250   7.721   0.701
  236    HA   LEU  29           HA       LEU  29  -1.459   5.054   0.122
  237   1HB   LEU  29          HB2       LEU  29  -0.378   6.435   1.799
  238   2HB   LEU  29          HB3       LEU  29  -1.799   6.489   2.791
  239    HG   LEU  29           HG       LEU  29  -1.673   4.094   3.269
  240   1HD1  LEU  29          HD11      LEU  29  -0.716   3.171   1.231
  241   2HD1  LEU  29          HD12      LEU  29   0.771   4.116   1.452
  242   3HD1  LEU  29          HD13      LEU  29   0.364   2.798   2.579
  243   1HD2  LEU  29          HD21      LEU  29   1.009   5.487   3.644
  244   2HD2  LEU  29          HD22      LEU  29  -0.420   5.678   4.681
  245   3HD2  LEU  29          HD23      LEU  29   0.395   4.109   4.589
  246    HA   PRO  30           HA       PRO  30  -5.589   3.611   2.470
  247   1HB   PRO  30          HB2       PRO  30  -7.264   5.956   1.578
  248   2HB   PRO  30          HB3       PRO  30  -7.390   4.989   3.060
  249   1HG   PRO  30          HG2       PRO  30  -6.280   7.527   2.808
  250   2HG   PRO  30          HG3       PRO  30  -5.881   6.383   4.138
  251   1HD   PRO  30          HD2       PRO  30  -4.210   7.268   1.896
  252   2HD   PRO  30          HD3       PRO  30  -3.753   6.341   3.343
  253    H    ALA  31           H        ALA  31  -5.846   5.804  -0.291
  254    HA   ALA  31           HA       ALA  31  -7.580   4.193  -1.865
  255   1HB   ALA  31          HB1       ALA  31  -7.274   6.676  -1.919
  256   2HB   ALA  31          HB2       ALA  31  -5.726   6.431  -2.760
  257   3HB   ALA  31          HB3       ALA  31  -7.237   5.898  -3.523
  258    H    LEU  32           H        LEU  32  -4.222   3.616  -1.288
  259    HA   LEU  32           HA       LEU  32  -3.967   2.058  -3.821
  260   1HB   LEU  32          HB2       LEU  32  -2.131   3.572  -3.293
  261   2HB   LEU  32          HB3       LEU  32  -2.020   2.871  -1.663
  262    HG   LEU  32           HG       LEU  32  -1.208   0.772  -2.544
  263   1HD1  LEU  32          HD11      LEU  32  -0.702   0.462  -4.943
  264   2HD1  LEU  32          HD12      LEU  32  -2.430   0.659  -4.688
  265   3HD1  LEU  32          HD13      LEU  32  -1.481   2.026  -5.312
  266   1HD2  LEU  32          HD21      LEU  32   0.271   3.109  -3.820
  267   2HD2  LEU  32          HD22      LEU  32   0.353   2.652  -2.107
  268   3HD2  LEU  32          HD23      LEU  32   0.974   1.551  -3.347
  269    H    LEU  33           H        LEU  33  -3.889   1.790  -0.249
  270    HA   LEU  33           HA       LEU  33  -3.705  -1.054  -0.046
  271   1HB   LEU  33          HB2       LEU  33  -5.094   1.037   1.667
  272   2HB   LEU  33          HB3       LEU  33  -4.849  -0.641   2.161
  273    HG   LEU  33           HG       LEU  33  -2.444   1.024   1.339
  274   1HD1  LEU  33          HD11      LEU  33  -2.182   1.721   3.679
  275   2HD1  LEU  33          HD12      LEU  33  -3.625   2.411   2.915
  276   3HD1  LEU  33          HD13      LEU  33  -3.794   1.055   4.059
  277   1HD2  LEU  33          HD21      LEU  33  -2.153  -1.399   1.712
  278   2HD2  LEU  33          HD22      LEU  33  -1.301  -0.439   2.933
  279   3HD2  LEU  33          HD23      LEU  33  -2.837  -1.234   3.345
  280    H    GLN  34           H        GLN  34  -6.574   1.083  -0.474
  281    HA   GLN  34           HA       GLN  34  -8.524  -0.992  -0.675
  282   1HB   GLN  34          HB2       GLN  34  -8.334   1.814  -1.826
  283   2HB   GLN  34          HB3       GLN  34  -9.720   0.784  -2.141
  284   1HG   GLN  34          HG2       GLN  34  -8.774   1.559   0.652
  285   2HG   GLN  34          HG3       GLN  34 -10.058   2.376  -0.233
  286   1HE2  GLN  34          HE21      GLN  34 -10.080   0.761   2.378
  287   2HE2  GLN  34          HE22      GLN  34 -11.355  -0.417   2.096
  288    H    GLN  35           H        GLN  35  -6.187   0.201  -3.136
  289    HA   GLN  35           HA       GLN  35  -7.588  -1.258  -5.283
  290   1HB   GLN  35          HB2       GLN  35  -4.979   0.308  -5.167
  291   2HB   GLN  35          HB3       GLN  35  -5.425  -0.676  -6.566
  292   1HG   GLN  35          HG2       GLN  35  -7.507   0.563  -6.861
  293   2HG   GLN  35          HG3       GLN  35  -7.164   1.542  -5.432
  294   1HE2  GLN  35          HE21      GLN  35  -5.671   3.270  -5.609
  295   2HE2  GLN  35          HE22      GLN  35  -4.953   3.742  -7.154
  296    H    ILE  36           H        ILE  36  -4.751  -1.792  -3.216
  297    HA   ILE  36           HA       ILE  36  -4.033  -4.350  -4.285
  298    HB   ILE  36           HB       ILE  36  -3.758  -3.213  -1.502
  299   1HG1  ILE  36          HG12      ILE  36  -1.614  -3.556  -3.655
  300   2HG1  ILE  36          HG13      ILE  36  -2.540  -2.071  -3.490
  301   1HG2  ILE  36          HG21      ILE  36  -3.641  -5.689  -1.397
  302   2HG2  ILE  36          HG22      ILE  36  -2.584  -5.736  -2.808
  303   3HG2  ILE  36          HG23      ILE  36  -2.003  -5.066  -1.262
  304   1HD1  ILE  36          HD11      ILE  36  -0.693  -3.251  -1.397
  305   2HD1  ILE  36          HD12      ILE  36  -0.477  -1.765  -2.338
  306   3HD1  ILE  36          HD13      ILE  36  -1.772  -1.857  -1.124
  307    H    GLY  37           H        GLY  37  -6.504  -3.440  -1.741
  308   1HA   GLY  37          HA2       GLY  37  -7.513  -6.027  -1.321
  309   2HA   GLY  37          HA3       GLY  37  -8.428  -4.526  -1.171
  310    H    ARG  38           H        ARG  38  -8.021  -4.010  -4.207
  311    HA   ARG  38           HA       ARG  38 -10.163  -5.784  -5.248
  312   1HB   ARG  38          HB2       ARG  38  -8.674  -3.525  -6.641
  313   2HB   ARG  38          HB3       ARG  38 -10.085  -4.392  -7.229
  314   1HG   ARG  38          HG2       ARG  38  -9.911  -2.405  -4.963
  315   2HG   ARG  38          HG3       ARG  38 -10.883  -2.352  -6.435
  316   1HD   ARG  38          HD2       ARG  38 -12.262  -4.240  -5.584
  317   2HD   ARG  38          HD3       ARG  38 -11.341  -4.241  -4.083
  318    HE   ARG  38           HE       ARG  38 -13.461  -2.413  -4.849
  319   1HH1  ARG  38          HH22      ARG  38 -10.541  -2.413  -2.849
  320   2HH1  ARG  38          HH21      ARG  38 -11.325  -1.427  -1.640
  321   1HH2  ARG  38          HH12      ARG  38 -14.261  -1.031  -3.277
  322   2HH2  ARG  38          HH11      ARG  38 -13.255  -0.631  -1.901
  323    H    GLU  39           H        GLU  39  -6.699  -5.171  -5.953
  324    HA   GLU  39           HA       GLU  39  -6.639  -7.091  -8.131
  325   1HB   GLU  39          HB2       GLU  39  -4.643  -5.296  -6.710
  326   2HB   GLU  39          HB3       GLU  39  -4.190  -6.365  -8.033
  327   1HG   GLU  39          HG2       GLU  39  -6.307  -4.177  -8.238
  328   2HG   GLU  39          HG3       GLU  39  -4.624  -4.014  -8.729
  329    H    ASN  40           H        ASN  40  -5.579  -7.091  -4.759
  330    HA   ASN  40           HA       ASN  40  -5.018  -9.952  -4.778
  331   1HB   ASN  40          HB2       ASN  40  -2.854  -8.679  -5.509
  332   2HB   ASN  40          HB3       ASN  40  -2.792  -8.079  -3.876
  333   1HD2  ASN  40          HD21      ASN  40  -0.914  -9.903  -5.261
  334   2HD2  ASN  40          HD22      ASN  40  -0.937 -11.397  -4.325
  335    HA   PRO  41           HA       PRO  41  -6.944  -8.180  -0.871
  336   1HB   PRO  41          HB2       PRO  41  -8.770 -10.219  -0.470
  337   2HB   PRO  41          HB3       PRO  41  -9.063  -8.748  -1.452
  338   1HG   PRO  41          HG2       PRO  41  -8.141 -11.455  -2.423
  339   2HG   PRO  41          HG3       PRO  41  -9.493 -10.453  -3.059
  340   1HD   PRO  41          HD2       PRO  41  -7.097 -10.408  -4.261
  341   2HD   PRO  41          HD3       PRO  41  -7.966  -8.866  -3.993
  342    H    GLN  42           H        GLN  42  -5.364 -11.176  -1.701
  343    HA   GLN  42           HA       GLN  42  -4.976 -12.134   1.037
  344   1HB   GLN  42          HB2       GLN  42  -3.433 -12.821  -1.489
  345   2HB   GLN  42          HB3       GLN  42  -3.493 -13.749   0.017
  346   1HG   GLN  42          HG2       GLN  42  -5.980 -14.036  -0.347
  347   2HG   GLN  42          HG3       GLN  42  -5.790 -13.267  -1.925
  348   1HE2  GLN  42          HE21      GLN  42  -4.561 -14.424  -3.616
  349   2HE2  GLN  42          HE22      GLN  42  -4.304 -16.158  -3.452
  350    H    LEU  43           H        LEU  43  -2.981 -10.327  -1.371
  351    HA   LEU  43           HA       LEU  43  -0.746  -9.818   0.372
  352   1HB   LEU  43          HB2       LEU  43  -0.745  -9.401  -2.122
  353   2HB   LEU  43          HB3       LEU  43  -1.945  -8.134  -1.868
  354    HG   LEU  43           HG       LEU  43  -0.438  -6.744  -0.679
  355   1HD1  LEU  43          HD11      LEU  43   1.896  -7.220  -0.284
  356   2HD1  LEU  43          HD12      LEU  43   0.950  -8.467   0.504
  357   3HD1  LEU  43          HD13      LEU  43   1.750  -8.821  -1.050
  358   1HD2  LEU  43          HD21      LEU  43   1.201  -6.281  -2.470
  359   2HD2  LEU  43          HD22      LEU  43   0.824  -7.860  -3.207
  360   3HD2  LEU  43          HD23      LEU  43  -0.418  -6.599  -3.111
  361    H    LEU  44           H        LEU  44  -3.903  -8.299  -0.074
  362    HA   LEU  44           HA       LEU  44  -3.265  -5.898   1.349
  363   1HB   LEU  44          HB2       LEU  44  -5.270  -6.399  -0.203
  364   2HB   LEU  44          HB3       LEU  44  -6.051  -7.142   1.150
  365    HG   LEU  44           HG       LEU  44  -6.417  -4.624   0.428
  366   1HD1  LEU  44          HD11      LEU  44  -7.696  -5.765   2.108
  367   2HD1  LEU  44          HD12      LEU  44  -6.441  -5.414   3.337
  368   3HD1  LEU  44          HD13      LEU  44  -7.346  -4.091   2.542
  369   1HD2  LEU  44          HD21      LEU  44  -5.337  -2.980   1.843
  370   2HD2  LEU  44          HD22      LEU  44  -4.311  -4.206   2.593
  371   3HD2  LEU  44          HD23      LEU  44  -4.118  -3.807   0.864
  372    H    GLN  45           H        GLN  45  -5.130  -8.673   2.400
  373    HA   GLN  45           HA       GLN  45  -5.170  -8.266   5.205
  374   1HB   GLN  45          HB2       GLN  45  -5.089 -10.813   3.559
  375   2HB   GLN  45          HB3       GLN  45  -5.290 -10.820   5.313
  376   1HG   GLN  45          HG2       GLN  45  -7.344  -9.567   5.198
  377   2HG   GLN  45          HG3       GLN  45  -7.140  -9.252   3.470
  378   1HE2  GLN  45          HE21      GLN  45  -7.324 -11.056   1.973
  379   2HE2  GLN  45          HE22      GLN  45  -8.281 -12.471   2.430
  380    H    GLN  46           H        GLN  46  -2.432  -9.586   3.277
  381    HA   GLN  46           HA       GLN  46  -0.792 -10.191   5.609
  382   1HB   GLN  46          HB2       GLN  46  -0.318  -9.902   2.626
  383   2HB   GLN  46          HB3       GLN  46   1.032 -10.058   3.739
  384   1HG   GLN  46          HG2       GLN  46   0.158 -12.182   4.593
  385   2HG   GLN  46          HG3       GLN  46  -1.300 -12.029   3.622
  386   1HE2  GLN  46          HE21      GLN  46  -1.128 -12.181   1.296
  387   2HE2  GLN  46          HE22      GLN  46   0.240 -13.039   0.563
  388    H    ILE  47           H        ILE  47  -0.917  -7.353   3.388
  389    HA   ILE  47           HA       ILE  47   1.078  -5.805   4.730
  390    HB   ILE  47           HB       ILE  47  -1.261  -5.103   2.956
  391   1HG1  ILE  47          HG12      ILE  47   1.769  -4.862   2.617
  392   2HG1  ILE  47          HG13      ILE  47   0.827  -6.259   2.085
  393   1HG2  ILE  47          HG21      ILE  47   0.712  -3.180   4.269
  394   2HG2  ILE  47          HG22      ILE  47  -0.317  -2.758   2.886
  395   3HG2  ILE  47          HG23      ILE  47  -1.060  -3.162   4.422
  396   1HD1  ILE  47          HD11      ILE  47  -0.523  -4.751   0.617
  397   2HD1  ILE  47          HD12      ILE  47   0.597  -3.426   1.018
  398   3HD1  ILE  47          HD13      ILE  47   1.201  -4.864   0.182
  399    H    SER  48           H        SER  48  -2.415  -6.204   5.384
  400    HA   SER  48           HA       SER  48  -2.588  -4.299   7.512
  401   1HB   SER  48          HB2       SER  48  -4.516  -5.388   6.357
  402   2HB   SER  48          HB3       SER  48  -4.146  -6.896   7.211
  403    HG   SER  48           HG       SER  48  -5.736  -5.605   8.277
  404    H    GLN  49           H        GLN  49  -1.673  -7.748   7.557
  405    HA   GLN  49           HA       GLN  49  -1.205  -7.931  10.405
  406   1HB   GLN  49          HB2       GLN  49  -0.514  -9.623   7.983
  407   2HB   GLN  49          HB3       GLN  49   0.048 -10.065   9.595
  408   1HG   GLN  49          HG2       GLN  49  -2.207 -10.243  10.444
  409   2HG   GLN  49          HG3       GLN  49  -2.890  -9.563   8.968
  410   1HE2  GLN  49          HE21      GLN  49  -2.900 -10.841   7.033
  411   2HE2  GLN  49          HE22      GLN  49  -2.720 -12.602   7.119
  412    H    HIS  50           H        HIS  50   0.728  -6.545   7.895
  413    HA   HIS  50           HA       HIS  50   3.171  -6.541   9.625
  414   1HB   HIS  50          HB2       HIS  50   3.020  -6.953   6.615
  415   2HB   HIS  50          HB3       HIS  50   4.488  -6.948   7.593
  416    HD1  HIS  50           HD1      HIS  50   3.550  -9.003   9.888
  417    HD2  HIS  50           HD2      HIS  50   2.971  -9.409   5.749
  418    HE1  HIS  50           HE1      HIS  50   3.305 -11.493   9.446
  419    H    GLN  51           H        GLN  51   1.080  -4.431   9.174
  420    HA   GLN  51           HA       GLN  51   1.667  -2.771   7.103
  421   1HB   GLN  51          HB2       GLN  51  -0.358  -2.899   8.733
  422   2HB   GLN  51          HB3       GLN  51   0.501  -1.662   9.667
  423   1HG   GLN  51          HG2       GLN  51   0.549  -0.225   7.606
  424   2HG   GLN  51          HG3       GLN  51  -0.278  -1.512   6.720
  425   1HE2  GLN  51          HE21      GLN  51  -2.346  -0.708   6.309
  426   2HE2  GLN  51          HE22      GLN  51  -3.373  -0.010   7.563
  427    H    GLU  52           H        GLU  52   3.154  -2.467  10.333
  428    HA   GLU  52           HA       GLU  52   4.466   0.054   9.843
  429   1HB   GLU  52          HB2       GLU  52   5.174  -2.233  11.723
  430   2HB   GLU  52          HB3       GLU  52   5.949  -0.644  11.724
  431   1HG   GLU  52          HG2       GLU  52   3.733   0.423  12.156
  432   2HG   GLU  52          HG3       GLU  52   2.997  -1.173  12.259
  433    H    HIS  53           H        HIS  53   5.310  -3.233   8.859
  434    HA   HIS  53           HA       HIS  53   8.047  -2.509   8.045
  435   1HB   HIS  53          HB2       HIS  53   6.398  -5.012   7.497
  436   2HB   HIS  53          HB3       HIS  53   8.110  -4.802   7.175
  437    HD1  HIS  53           HD1      HIS  53   6.066  -6.342   9.720
  438    HD2  HIS  53           HD2      HIS  53   9.514  -3.939   9.656
  439    HE1  HIS  53           HE1      HIS  53   7.220  -6.689  11.963
  440    H    PHE  54           H        PHE  54   4.861  -3.051   6.490
  441    HA   PHE  54           HA       PHE  54   5.738  -2.614   3.780
  442   1HB   PHE  54          HB2       PHE  54   3.612  -3.661   4.206
  443   2HB   PHE  54          HB3       PHE  54   3.045  -2.279   5.137
  444    HD1  PHE  54           HD1      PHE  54   4.173  -3.270   1.686
  445    HD2  PHE  54           HD2      PHE  54   1.873  -0.504   4.065
  446    HE1  PHE  54           HE1      PHE  54   3.263  -2.241  -0.382
  447    HE2  PHE  54           HE2      PHE  54   0.971   0.520   1.991
  448    HZ   PHE  54           HZ       PHE  54   1.668  -0.342  -0.232
  449    H    ILE  55           H        ILE  55   4.322  -0.308   6.172
  450    HA   ILE  55           HA       ILE  55   4.341   1.936   4.489
  451    HB   ILE  55           HB       ILE  55   4.278   1.653   7.451
  452   1HG1  ILE  55          HG12      ILE  55   2.316   2.582   5.286
  453   2HG1  ILE  55          HG13      ILE  55   2.356   0.964   5.992
  454   1HG2  ILE  55          HG21      ILE  55   4.093   4.297   5.941
  455   2HG2  ILE  55          HG22      ILE  55   3.781   4.052   7.673
  456   3HG2  ILE  55          HG23      ILE  55   5.403   3.836   7.059
  457   1HD1  ILE  55          HD11      ILE  55   1.615   3.541   7.401
  458   2HD1  ILE  55          HD12      ILE  55   0.569   2.171   6.998
  459   3HD1  ILE  55          HD13      ILE  55   1.847   1.970   8.223
  460    H    GLN  56           H        GLN  56   7.091   0.616   6.354
  461    HA   GLN  56           HA       GLN  56   8.817   2.907   5.851
  462   1HB   GLN  56          HB2       GLN  56   9.350   0.021   6.648
  463   2HB   GLN  56          HB3       GLN  56  10.640   1.206   6.409
  464   1HG   GLN  56          HG2       GLN  56   9.751   2.652   8.151
  465   2HG   GLN  56          HG3       GLN  56   8.332   1.628   8.354
  466   1HE2  GLN  56          HE21      GLN  56   8.512  -0.299   9.571
  467   2HE2  GLN  56          HE22      GLN  56   9.979  -0.704  10.469
  468    H    MET  57           H        MET  57   8.367  -0.236   4.116
  469    HA   MET  57           HA       MET  57  10.352   0.277   2.079
  470   1HB   MET  57          HB2       MET  57   7.879  -1.483   2.099
  471   2HB   MET  57          HB3       MET  57   9.051  -1.430   0.776
  472   1HG   MET  57          HG2       MET  57   9.699  -2.150   3.657
  473   2HG   MET  57          HG3       MET  57   9.423  -3.290   2.344
  474   1HE   MET  57          HE1       MET  57  12.552  -3.151   0.148
  475   2HE   MET  57          HE2       MET  57  11.100  -4.060   0.615
  476   3HE   MET  57          HE3       MET  57  10.945  -2.464  -0.154
  477    H    LEU  58           H        LEU  58   6.895   0.942   2.311
  478    HA   LEU  58           HA       LEU  58   6.276   2.212  -0.128
  479   1HB   LEU  58          HB2       LEU  58   4.827   1.146   1.403
  480   2HB   LEU  58          HB3       LEU  58   5.322   2.193   2.714
  481    HG   LEU  58           HG       LEU  58   3.056   2.404   1.743
  482   1HD1  LEU  58          HD11      LEU  58   4.024   3.948   3.377
  483   2HD1  LEU  58          HD12      LEU  58   4.691   4.949   2.062
  484   3HD1  LEU  58          HD13      LEU  58   2.935   4.780   2.271
  485   1HD2  LEU  58          HD21      LEU  58   3.665   2.487  -0.649
  486   2HD2  LEU  58          HD22      LEU  58   2.654   3.838  -0.135
  487   3HD2  LEU  58          HD23      LEU  58   4.393   4.098  -0.402
  488    H    ASN  59           H        ASN  59   7.730   3.562   2.879
  489    HA   ASN  59           HA       ASN  59   7.624   6.318   1.872
  490   1HB   ASN  59          HB2       ASN  59   8.431   4.929   4.416
  491   2HB   ASN  59          HB3       ASN  59   9.231   6.448   4.059
  492   1HD2  ASN  59          HD21      ASN  59   6.115   4.979   4.732
  493   2HD2  ASN  59          HD22      ASN  59   5.283   6.508   5.055
  494    H    GLU  60           H        GLU  60  10.156   3.803   2.091
  495    HA   GLU  60           HA       GLU  60  12.361   5.513   1.600
  496   1HB   GLU  60          HB2       GLU  60  11.917   2.557   1.229
  497   2HB   GLU  60          HB3       GLU  60  13.448   3.325   0.786
  498   1HG   GLU  60          HG2       GLU  60  12.210   3.609   3.554
  499   2HG   GLU  60          HG3       GLU  60  13.344   2.336   3.106
  500    HA   PRO  61           HA       PRO  61  12.036   6.458  -2.703
  501   1HB   PRO  61          HB2       PRO  61  14.597   7.090  -3.384
  502   2HB   PRO  61          HB3       PRO  61  13.597   8.095  -2.287
  503   1HG   PRO  61          HG2       PRO  61  15.680   6.028  -1.569
  504   2HG   PRO  61          HG3       PRO  61  15.484   7.684  -0.902
  505   1HD   PRO  61          HD2       PRO  61  14.532   5.433   0.340
  506   2HD   PRO  61          HD3       PRO  61  13.687   7.007   0.464
  507    H    VAL  62           H        VAL  62  12.159   5.508  -4.706
  508    HA   VAL  62           HA       VAL  62  13.268   2.760  -4.814
  509    HB   VAL  62           HB       VAL  62  11.380   2.226  -6.109
  510   1HG1  VAL  62          HG11      VAL  62  10.278   4.066  -3.939
  511   2HG1  VAL  62          HG12      VAL  62   9.529   2.619  -4.620
  512   3HG1  VAL  62          HG13      VAL  62  10.997   2.473  -3.624
  513   1HG2  VAL  62          HG21      VAL  62  11.099   4.163  -7.557
  514   2HG2  VAL  62          HG22      VAL  62   9.595   3.827  -6.707
  515   3HG2  VAL  62          HG23      VAL  62  10.626   5.174  -6.166
  516    H    GLN  63           H        GLN  63  13.807   5.739  -6.218
  517    HA   GLN  63           HA       GLN  63  14.775   4.643  -8.821
  518   1HB   GLN  63          HB2       GLN  63  13.648   6.303  -9.994
  519   2HB   GLN  63          HB3       GLN  63  12.472   5.576  -8.924
  520   1HG   GLN  63          HG2       GLN  63  13.849   8.273  -8.478
  521   2HG   GLN  63          HG3       GLN  63  12.265   8.013  -9.179
  522   1HE2  GLN  63          HE21      GLN  63  10.490   8.025  -7.774
  523   2HE2  GLN  63          HE22      GLN  63  10.673   8.017  -6.020
  524    H    GLU  64           H        GLU  64  15.692   6.532  -6.129
  525    HA   GLU  64           HA       GLU  64  18.055   7.614  -7.530
  526   1HB   GLU  64          HB2       GLU  64  16.214   9.286  -7.825
  527   2HB   GLU  64          HB3       GLU  64  16.060   9.402  -6.067
  528   1HG   GLU  64          HG2       GLU  64  18.337  10.308  -5.905
  529   2HG   GLU  64          HG3       GLU  64  18.598  10.037  -7.626
  530    H    ALA  65           H        ALA  65  19.760   8.132  -6.176
  531    HA   ALA  65           HA       ALA  65  19.493   8.212  -3.270
  532   1HB   ALA  65          HB1       ALA  65  19.848   5.794  -3.685
  533   2HB   ALA  65          HB2       ALA  65  21.298   6.164  -4.644
  534   3HB   ALA  65          HB3       ALA  65  21.264   6.515  -2.903
  535    H    GLY  66           H        GLY  66  21.476   9.092  -2.262
  536   1HA   GLY  66          HA2       GLY  66  23.764  10.072  -3.564
  537   2HA   GLY  66          HA3       GLY  66  22.515  11.292  -3.793
  538    H    GLY  67           H        GLY  67  24.052  12.629  -2.621
  539   1HA   GLY  67          HA2       GLY  67  23.350  12.887   0.202
  540   2HA   GLY  67          HA3       GLY  67  25.055  12.529  -0.081
  541    H    GLN  68           H        GLN  68  24.671  14.784   1.174
  542    HA   GLN  68           HA       GLN  68  23.889  17.068  -0.294
  543   1HB   GLN  68          HB2       GLN  68  24.669  18.347   1.591
  544   2HB   GLN  68          HB3       GLN  68  23.836  16.900   2.140
  545   1HG   GLN  68          HG2       GLN  68  26.043  15.812   2.604
  546   2HG   GLN  68          HG3       GLN  68  26.867  17.264   2.035
  547   1HE2  GLN  68          HE21      GLN  68  27.492  18.663   3.684
  548   2HE2  GLN  68          HE22      GLN  68  26.674  18.761   5.238
  549    H    GLY  69           H        GLY  69  26.938  15.466  -0.539
  550   1HA   GLY  69          HA2       GLY  69  27.948  17.124  -2.587
  551   2HA   GLY  69          HA3       GLY  69  28.674  17.674  -1.078
  552    H    GLY  70           H        GLY  70  30.515  16.966  -2.641
  553   1HA   GLY  70          HA2       GLY  70  31.881  14.751  -1.494
  554   2HA   GLY  70          HA3       GLY  70  31.245  14.264  -3.067
  555    H    GLY  71           H        GLY  71  33.830  14.094  -2.952
  556   1HA   GLY  71          HA2       GLY  71  34.882  16.115  -4.791
  557   2HA   GLY  71          HA3       GLY  71  35.596  16.182  -3.178
  558    H    GLY  72           H        GLY  72  34.618  13.124  -4.664
  559   1HA   GLY  72          HA2       GLY  72  37.080  12.319  -5.869
  560   2HA   GLY  72          HA3       GLY  72  37.063  11.768  -4.193
  Start of MODEL   12
    1   1H    GLY   1           H1       GLY   1  14.174  -8.510   5.723
    2   2H    GLY   1           H2       GLY   1  15.073  -8.439   7.096
    3   3H    GLY   1           H3       GLY   1  13.459  -8.753   7.180
    4   1HA   GLY   1          HA2       GLY   1  15.469 -10.507   5.924
    5   2HA   GLY   1          HA3       GLY   1  14.740 -10.777   7.519
    6    H    SER   2           H        SER   2  14.677 -12.385   4.988
    7    HA   SER   2           HA       SER   2  12.294 -12.237   3.577
    8   1HB   SER   2          HB2       SER   2  13.881 -14.753   4.171
    9   2HB   SER   2          HB3       SER   2  12.823 -14.458   2.779
   10    HG   SER   2           HG       SER   2  15.032 -14.096   2.284
   11    H    HIS   3           H        HIS   3  12.443 -13.305   6.848
   12    HA   HIS   3           HA       HIS   3  10.145 -15.040   6.899
   13   1HB   HIS   3          HB2       HIS   3  11.164 -13.121   9.029
   14   2HB   HIS   3          HB3       HIS   3  10.076 -14.481   9.281
   15    HD1  HIS   3           HD1      HIS   3  11.417 -16.957   8.274
   16    HD2  HIS   3           HD2      HIS   3  13.584 -13.678   9.765
   17    HE1  HIS   3           HE1      HIS   3  13.712 -17.848   8.909
   18    H    MET   4           H        MET   4  10.471 -11.548   6.602
   19    HA   MET   4           HA       MET   4   7.672 -10.897   7.116
   20   1HB   MET   4          HB2       MET   4   9.624  -9.344   7.448
   21   2HB   MET   4          HB3       MET   4   9.874  -9.333   5.700
   22   1HG   MET   4          HG2       MET   4   7.453  -8.487   5.511
   23   2HG   MET   4          HG3       MET   4   7.512  -8.245   7.262
   24   1HE   MET   4          HE1       MET   4  10.281  -5.465   7.605
   25   2HE   MET   4          HE2       MET   4   9.209  -6.598   8.455
   26   3HE   MET   4          HE3       MET   4  10.652  -7.201   7.606
   27    HA   PRO   5           HA       PRO   5   6.480 -12.250   2.962
   28   1HB   PRO   5          HB2       PRO   5   3.979 -11.157   2.738
   29   2HB   PRO   5          HB3       PRO   5   4.350 -12.558   3.786
   30   1HG   PRO   5          HG2       PRO   5   4.190  -9.637   4.583
   31   2HG   PRO   5          HG3       PRO   5   3.392 -11.044   5.361
   32   1HD   PRO   5          HD2       PRO   5   5.724 -10.027   6.310
   33   2HD   PRO   5          HD3       PRO   5   5.443 -11.795   6.290
   34    H    LEU   6           H        LEU   6   6.558  -8.866   3.903
   35    HA   LEU   6           HA       LEU   6   6.168  -7.819   1.233
   36   1HB   LEU   6          HB2       LEU   6   7.300  -6.303   3.591
   37   2HB   LEU   6          HB3       LEU   6   6.435  -5.672   2.196
   38    HG   LEU   6           HG       LEU   6   5.259  -7.298   4.491
   39   1HD1  LEU   6          HD11      LEU   6   3.990  -5.235   4.917
   40   2HD1  LEU   6          HD12      LEU   6   5.738  -4.962   5.019
   41   3HD1  LEU   6          HD13      LEU   6   4.838  -4.432   3.577
   42   1HD2  LEU   6          HD21      LEU   6   4.077  -7.907   2.396
   43   2HD2  LEU   6          HD22      LEU   6   3.062  -6.928   3.456
   44   3HD2  LEU   6          HD23      LEU   6   3.842  -6.181   2.039
   45    H    GLU   7           H        GLU   7   8.959  -9.082   2.819
   46    HA   GLU   7           HA       GLU   7  11.051  -7.516   1.686
   47   1HB   GLU   7          HB2       GLU   7  11.214  -9.280   3.511
   48   2HB   GLU   7          HB3       GLU   7  11.029 -10.508   2.262
   49   1HG   GLU   7          HG2       GLU   7  13.351 -10.347   2.730
   50   2HG   GLU   7          HG3       GLU   7  13.129  -9.603   1.160
   51    H    PHE   8           H        PHE   8   9.211 -10.240   0.325
   52    HA   PHE   8           HA       PHE   8  10.773 -10.521  -2.068
   53   1HB   PHE   8          HB2       PHE   8   7.899 -11.323  -1.493
   54   2HB   PHE   8          HB3       PHE   8   8.906 -11.930  -2.810
   55    HD1  PHE   8           HD1      PHE   8  11.085 -13.183  -2.211
   56    HD2  PHE   8           HD2      PHE   8   7.954 -12.400   0.647
   57    HE1  PHE   8           HE1      PHE   8  11.997 -14.949  -0.721
   58    HE2  PHE   8           HE2      PHE   8   8.879 -14.151   2.139
   59    HZ   PHE   8           HZ       PHE   8  10.894 -15.433   1.456
   60    H    LEU   9           H        LEU   9   8.580  -8.027  -1.214
   61    HA   LEU   9           HA       LEU   9   7.585  -7.481  -3.928
   62   1HB   LEU   9          HB2       LEU   9   7.359  -5.790  -1.418
   63   2HB   LEU   9          HB3       LEU   9   6.409  -5.640  -2.884
   64    HG   LEU   9           HG       LEU   9   6.296  -8.042  -1.012
   65   1HD1  LEU   9          HD11      LEU   9   4.321  -5.751  -1.344
   66   2HD1  LEU   9          HD12      LEU   9   4.216  -7.123  -0.210
   67   3HD1  LEU   9          HD13      LEU   9   5.479  -5.905  -0.005
   68   1HD2  LEU   9          HD21      LEU   9   4.513  -7.237  -3.351
   69   2HD2  LEU   9          HD22      LEU   9   5.637  -8.618  -3.316
   70   3HD2  LEU   9          HD23      LEU   9   4.233  -8.599  -2.242
   71    H    ARG  10           H        ARG  10  10.265  -6.505  -2.002
   72    HA   ARG  10           HA       ARG  10  10.523  -3.885  -2.108
   73   1HB   ARG  10          HB2       ARG  10  12.903  -4.144  -1.660
   74   2HB   ARG  10          HB3       ARG  10  11.931  -5.361  -0.843
   75   1HG   ARG  10          HG2       ARG  10  12.518  -6.975  -2.736
   76   2HG   ARG  10          HG3       ARG  10  13.670  -5.776  -3.316
   77   1HD   ARG  10          HD2       ARG  10  13.690  -6.880  -0.472
   78   2HD   ARG  10          HD3       ARG  10  14.544  -7.656  -1.806
   79    HE   ARG  10           HE       ARG  10  15.938  -5.682  -2.072
   80   1HH1  ARG  10          HH12      ARG  10  14.477  -5.910   1.149
   81   2HH1  ARG  10          HH11      ARG  10  15.523  -4.654   1.737
   82   1HH2  ARG  10          HH22      ARG  10  17.199  -4.303  -1.248
   83   2HH2  ARG  10          HH21      ARG  10  17.107  -3.789   0.433
   84    H    ASN  11           H        ASN  11  11.193  -5.600  -5.065
   85    HA   ASN  11           HA       ASN  11  11.385  -2.990  -6.437
   86   1HB   ASN  11          HB2       ASN  11  13.713  -3.698  -5.871
   87   2HB   ASN  11          HB3       ASN  11  13.474  -5.182  -6.801
   88   1HD2  ASN  11          HD21      ASN  11  13.020  -1.573  -7.359
   89   2HD2  ASN  11          HD22      ASN  11  13.813  -1.662  -8.922
   90    H    GLN  12           H        GLN  12   9.365  -5.271  -6.276
   91    HA   GLN  12           HA       GLN  12   9.396  -6.667  -8.798
   92   1HB   GLN  12          HB2       GLN  12   7.171  -6.128  -6.789
   93   2HB   GLN  12          HB3       GLN  12   6.992  -7.202  -8.164
   94   1HG   GLN  12          HG2       GLN  12   9.001  -7.573  -5.911
   95   2HG   GLN  12          HG3       GLN  12   7.451  -8.405  -6.060
   96   1HE2  GLN  12          HE21      GLN  12   9.669  -9.906  -5.740
   97   2HE2  GLN  12          HE22      GLN  12  10.077 -10.733  -7.247
   98    HA   PRO  13           HA       PRO  13   7.256  -3.932 -11.717
   99   1HB   PRO  13          HB2       PRO  13   5.375  -6.290 -11.966
  100   2HB   PRO  13          HB3       PRO  13   6.058  -5.256 -13.260
  101   1HG   PRO  13          HG2       PRO  13   7.141  -7.678 -12.780
  102   2HG   PRO  13          HG3       PRO  13   8.219  -6.262 -13.019
  103   1HD   PRO  13          HD2       PRO  13   7.339  -7.544 -10.429
  104   2HD   PRO  13          HD3       PRO  13   8.978  -7.008 -10.923
  105    H    GLN  14           H        GLN  14   5.464  -2.622 -11.757
  106    HA   GLN  14           HA       GLN  14   4.298  -1.070 -10.760
  107   1HB   GLN  14          HB2       GLN  14   2.070  -1.501 -10.066
  108   2HB   GLN  14          HB3       GLN  14   2.479  -2.376 -11.536
  109   1HG   GLN  14          HG2       GLN  14   2.578  -4.488 -10.342
  110   2HG   GLN  14          HG3       GLN  14   2.454  -3.667  -8.781
  111   1HE2  GLN  14          HE21      GLN  14   0.568  -5.040  -8.304
  112   2HE2  GLN  14          HE22      GLN  14  -0.979  -4.634  -9.028
  113    H    PHE  15           H        PHE  15   5.425  -3.341  -8.331
  114    HA   PHE  15           HA       PHE  15   5.025  -1.499  -6.116
  115   1HB   PHE  15          HB2       PHE  15   5.631  -4.080  -6.178
  116   2HB   PHE  15          HB3       PHE  15   7.285  -3.477  -6.184
  117    HD1  PHE  15           HD1      PHE  15   8.271  -2.754  -4.093
  118    HD2  PHE  15           HD2      PHE  15   4.016  -3.361  -4.367
  119    HE1  PHE  15           HE1      PHE  15   8.083  -2.556  -1.625
  120    HE2  PHE  15           HE2      PHE  15   3.828  -3.165  -1.907
  121    HZ   PHE  15           HZ       PHE  15   5.860  -2.757  -0.526
  122    H    GLN  16           H        GLN  16   7.348  -1.777  -8.714
  123    HA   GLN  16           HA       GLN  16   9.129   0.361  -7.992
  124   1HB   GLN  16          HB2       GLN  16   8.235  -0.918 -10.600
  125   2HB   GLN  16          HB3       GLN  16   9.361   0.440 -10.576
  126   1HG   GLN  16          HG2       GLN  16  10.952  -0.830  -9.201
  127   2HG   GLN  16          HG3       GLN  16   9.850  -2.205  -9.162
  128   1HE2  GLN  16          HE21      GLN  16  11.266  -3.665 -10.291
  129   2HE2  GLN  16          HE22      GLN  16  11.687  -3.407 -11.980
  130    H    GLN  17           H        GLN  17   5.770   0.642  -8.469
  131    HA   GLN  17           HA       GLN  17   6.020   3.449  -9.505
  132   1HB   GLN  17          HB2       GLN  17   3.915   1.383 -10.251
  133   2HB   GLN  17          HB3       GLN  17   3.999   3.060 -10.805
  134   1HG   GLN  17          HG2       GLN  17   6.212   2.566 -11.869
  135   2HG   GLN  17          HG3       GLN  17   6.037   0.872 -11.410
  136   1HE2  GLN  17          HE21      GLN  17   5.221   3.213 -13.834
  137   2HE2  GLN  17          HE22      GLN  17   4.136   2.157 -14.737
  138    H    MET  18           H        MET  18   3.687   1.262  -7.748
  139    HA   MET  18           HA       MET  18   1.914   3.298  -7.026
  140   1HB   MET  18          HB2       MET  18   0.981   1.724  -5.501
  141   2HB   MET  18          HB3       MET  18   1.430   0.919  -7.004
  142   1HG   MET  18          HG2       MET  18   3.514   0.064  -5.873
  143   2HG   MET  18          HG3       MET  18   2.993   0.850  -4.379
  144   1HE   MET  18          HE1       MET  18   2.487  -2.169  -6.823
  145   2HE   MET  18          HE2       MET  18   0.997  -2.912  -6.203
  146   3HE   MET  18          HE3       MET  18   0.922  -1.342  -7.028
  147    H    ARG  19           H        ARG  19   4.841   2.333  -5.303
  148    HA   ARG  19           HA       ARG  19   4.348   3.849  -2.876
  149   1HB   ARG  19          HB2       ARG  19   7.008   3.012  -4.138
  150   2HB   ARG  19          HB3       ARG  19   6.727   3.481  -2.457
  151   1HG   ARG  19          HG2       ARG  19   5.102   1.538  -2.288
  152   2HG   ARG  19          HG3       ARG  19   5.636   0.992  -3.865
  153   1HD   ARG  19          HD2       ARG  19   7.681   1.541  -1.698
  154   2HD   ARG  19          HD3       ARG  19   6.842  -0.022  -1.804
  155    HE   ARG  19           HE       ARG  19   7.694   0.302  -4.353
  156   1HH1  ARG  19          HH22      ARG  19   9.613   0.499  -1.403
  157   2HH1  ARG  19          HH21      ARG  19  10.989  -0.234  -2.197
  158   1HH2  ARG  19          HH12      ARG  19   9.417  -0.619  -5.220
  159   2HH2  ARG  19          HH11      ARG  19  10.799  -1.036  -4.228
  160    H    GLN  20           H        GLN  20   5.786   4.676  -5.959
  161    HA   GLN  20           HA       GLN  20   6.864   7.236  -5.185
  162   1HB   GLN  20          HB2       GLN  20   6.635   5.705  -7.623
  163   2HB   GLN  20          HB3       GLN  20   5.961   7.304  -7.922
  164   1HG   GLN  20          HG2       GLN  20   8.710   6.748  -6.702
  165   2HG   GLN  20          HG3       GLN  20   8.422   7.098  -8.401
  166   1HE2  GLN  20          HE21      GLN  20   8.939   8.542  -5.277
  167   2HE2  GLN  20          HE22      GLN  20   8.704  10.202  -5.819
  168    H    ILE  21           H        ILE  21   3.621   6.187  -6.104
  169    HA   ILE  21           HA       ILE  21   2.490   8.772  -6.441
  170    HB   ILE  21           HB       ILE  21   0.986   6.304  -5.454
  171   1HG1  ILE  21          HG12      ILE  21   1.918   6.948  -8.266
  172   2HG1  ILE  21          HG13      ILE  21   2.329   5.537  -7.299
  173   1HG2  ILE  21          HG21      ILE  21   0.143   8.631  -7.231
  174   2HG2  ILE  21          HG22      ILE  21  -0.905   7.331  -6.615
  175   3HG2  ILE  21          HG23      ILE  21  -0.218   8.500  -5.496
  176   1HD1  ILE  21          HD11      ILE  21  -0.398   6.087  -8.490
  177   2HD1  ILE  21          HD12      ILE  21   0.757   4.812  -8.919
  178   3HD1  ILE  21          HD13      ILE  21  -0.031   4.773  -7.336
  179    H    ILE  22           H        ILE  22   2.870   6.603  -3.676
  180    HA   ILE  22           HA       ILE  22   1.451   8.263  -1.753
  181    HB   ILE  22           HB       ILE  22   3.428   6.020  -1.216
  182   1HG1  ILE  22          HG12      ILE  22   1.835   4.909  -2.522
  183   2HG1  ILE  22          HG13      ILE  22   1.305   4.622  -0.882
  184   1HG2  ILE  22          HG21      ILE  22   1.179   7.162   0.491
  185   2HG2  ILE  22          HG22      ILE  22   2.202   5.772   0.907
  186   3HG2  ILE  22          HG23      ILE  22   2.924   7.377   0.767
  187   1HD1  ILE  22          HD11      ILE  22  -0.318   6.612  -1.216
  188   2HD1  ILE  22          HD12      ILE  22   0.063   6.479  -2.944
  189   3HD1  ILE  22          HD13      ILE  22  -0.666   5.106  -2.098
  190    H    GLN  23           H        GLN  23   4.862   7.866  -2.618
  191    HA   GLN  23           HA       GLN  23   6.082   9.489  -0.659
  192   1HB   GLN  23          HB2       GLN  23   6.744   8.721  -3.504
  193   2HB   GLN  23          HB3       GLN  23   7.841   9.743  -2.571
  194   1HG   GLN  23          HG2       GLN  23   8.240   8.060  -0.933
  195   2HG   GLN  23          HG3       GLN  23   6.893   7.069  -1.486
  196   1HE2  GLN  23          HE21      GLN  23   8.637   5.369  -1.470
  197   2HE2  GLN  23          HE22      GLN  23   9.630   5.215  -2.912
  198    H    GLN  24           H        GLN  24   3.953  10.591  -3.147
  199    HA   GLN  24           HA       GLN  24   4.752  13.418  -2.646
  200   1HB   GLN  24          HB2       GLN  24   4.145  13.885  -4.896
  201   2HB   GLN  24          HB3       GLN  24   5.365  12.593  -4.864
  202   1HG   GLN  24          HG2       GLN  24   3.482  10.951  -5.231
  203   2HG   GLN  24          HG3       GLN  24   2.389  12.324  -5.479
  204   1HE2  GLN  24          HE21      GLN  24   4.939  10.364  -6.854
  205   2HE2  GLN  24          HE22      GLN  24   4.983  11.161  -8.424
  206    H    ASN  25           H        ASN  25   2.112  11.130  -2.959
  207    HA   ASN  25           HA       ASN  25   0.321  13.055  -1.561
  208   1HB   ASN  25          HB2       ASN  25  -0.226  11.501  -4.075
  209   2HB   ASN  25          HB3       ASN  25  -1.526  11.688  -2.893
  210   1HD2  ASN  25          HD21      ASN  25  -1.914  13.916  -2.026
  211   2HD2  ASN  25          HD22      ASN  25  -1.838  15.209  -3.223
  212    HA   PRO  26           HA       PRO  26   0.774   9.227   0.983
  213   1HB   PRO  26          HB2       PRO  26   0.826  10.477   3.424
  214   2HB   PRO  26          HB3       PRO  26   2.273  10.249   2.392
  215   1HG   PRO  26          HG2       PRO  26   0.491  12.694   2.567
  216   2HG   PRO  26          HG3       PRO  26   2.284  12.622   2.687
  217   1HD   PRO  26          HD2       PRO  26   1.031  13.254   0.397
  218   2HD   PRO  26          HD3       PRO  26   2.480  12.197   0.356
  219    H    SER  27           H        SER  27  -1.472  11.907   0.896
  220    HA   SER  27           HA       SER  27  -3.665  10.903   2.389
  221   1HB   SER  27          HB2       SER  27  -4.992  12.331   0.799
  222   2HB   SER  27          HB3       SER  27  -3.660  13.157   1.617
  223    HG   SER  27           HG       SER  27  -3.835  13.535  -0.688
  224    H    LEU  28           H        LEU  28  -2.318   9.689  -0.598
  225    HA   LEU  28           HA       LEU  28  -4.765   8.098  -1.172
  226   1HB   LEU  28          HB2       LEU  28  -2.251   8.532  -2.820
  227   2HB   LEU  28          HB3       LEU  28  -3.664   7.598  -3.310
  228    HG   LEU  28           HG       LEU  28  -3.535  10.605  -2.881
  229   1HD1  LEU  28          HD11      LEU  28  -4.075  10.641  -5.284
  230   2HD1  LEU  28          HD12      LEU  28  -2.598   9.701  -4.994
  231   3HD1  LEU  28          HD13      LEU  28  -4.135   8.862  -5.305
  232   1HD2  LEU  28          HD21      LEU  28  -5.746   9.891  -2.111
  233   2HD2  LEU  28          HD22      LEU  28  -5.885  10.648  -3.696
  234   3HD2  LEU  28          HD23      LEU  28  -5.955   8.875  -3.560
  235    H    LEU  29           H        LEU  29  -2.230   7.598   0.858
  236    HA   LEU  29           HA       LEU  29  -1.449   4.918   0.303
  237   1HB   LEU  29          HB2       LEU  29  -0.348   6.252   1.957
  238   2HB   LEU  29          HB3       LEU  29  -1.779   6.456   2.909
  239    HG   LEU  29           HG       LEU  29  -1.812   4.078   3.523
  240   1HD1  LEU  29          HD11      LEU  29   0.162   2.643   2.942
  241   2HD1  LEU  29          HD12      LEU  29  -0.863   3.005   1.549
  242   3HD1  LEU  29          HD13      LEU  29   0.666   3.886   1.766
  243   1HD2  LEU  29          HD21      LEU  29   0.229   4.046   4.886
  244   2HD2  LEU  29          HD22      LEU  29   0.947   5.322   3.878
  245   3HD2  LEU  29          HD23      LEU  29  -0.484   5.667   4.875
  246    HA   PRO  30           HA       PRO  30  -5.605   3.524   2.610
  247   1HB   PRO  30          HB2       PRO  30  -7.254   5.886   1.702
  248   2HB   PRO  30          HB3       PRO  30  -7.403   4.926   3.186
  249   1HG   PRO  30          HG2       PRO  30  -6.255   7.449   2.921
  250   2HG   PRO  30          HG3       PRO  30  -5.892   6.315   4.271
  251   1HD   PRO  30          HD2       PRO  30  -4.168   7.162   2.062
  252   2HD   PRO  30          HD3       PRO  30  -3.750   6.206   3.501
  253    H    ALA  31           H        ALA  31  -5.842   5.695  -0.167
  254    HA   ALA  31           HA       ALA  31  -7.607   4.113  -1.721
  255   1HB   ALA  31          HB1       ALA  31  -5.665   6.270  -2.637
  256   2HB   ALA  31          HB2       ALA  31  -7.188   5.782  -3.409
  257   3HB   ALA  31          HB3       ALA  31  -7.207   6.577  -1.814
  258    H    LEU  32           H        LEU  32  -4.209   3.559  -1.172
  259    HA   LEU  32           HA       LEU  32  -3.927   1.970  -3.670
  260   1HB   LEU  32          HB2       LEU  32  -2.090   3.456  -3.070
  261   2HB   LEU  32          HB3       LEU  32  -2.027   2.732  -1.447
  262    HG   LEU  32           HG       LEU  32  -1.214   0.639  -2.328
  263   1HD1  LEU  32          HD11      LEU  32  -1.434   1.909  -5.093
  264   2HD1  LEU  32          HD12      LEU  32  -0.673   0.336  -4.720
  265   3HD1  LEU  32          HD13      LEU  32  -2.401   0.542  -4.490
  266   1HD2  LEU  32          HD21      LEU  32   0.989   1.394  -3.118
  267   2HD2  LEU  32          HD22      LEU  32   0.308   2.966  -3.573
  268   3HD2  LEU  32          HD23      LEU  32   0.375   2.485  -1.864
  269    H    LEU  33           H        LEU  33  -3.917   1.655  -0.101
  270    HA   LEU  33           HA       LEU  33  -3.773  -1.192   0.088
  271   1HB   LEU  33          HB2       LEU  33  -5.194   0.906   1.769
  272   2HB   LEU  33          HB3       LEU  33  -5.004  -0.781   2.251
  273    HG   LEU  33           HG       LEU  33  -2.516   0.792   1.528
  274   1HD1  LEU  33          HD11      LEU  33  -2.331   1.566   3.848
  275   2HD1  LEU  33          HD12      LEU  33  -3.716   2.281   3.008
  276   3HD1  LEU  33          HD13      LEU  33  -3.978   0.968   4.187
  277   1HD2  LEU  33          HD21      LEU  33  -3.122  -1.373   3.587
  278   2HD2  LEU  33          HD22      LEU  33  -2.363  -1.628   1.999
  279   3HD2  LEU  33          HD23      LEU  33  -1.530  -0.671   3.239
  280    H    GLN  34           H        GLN  34  -6.622   0.977  -0.295
  281    HA   GLN  34           HA       GLN  34  -8.598  -1.048  -0.582
  282   1HB   GLN  34          HB2       GLN  34  -8.336   1.782  -1.659
  283   2HB   GLN  34          HB3       GLN  34  -9.740   0.794  -2.021
  284   1HG   GLN  34          HG2       GLN  34  -8.817   1.457   0.809
  285   2HG   GLN  34          HG3       GLN  34 -10.058   2.343  -0.069
  286   1HE2  GLN  34          HE21      GLN  34 -10.110   0.553   2.473
  287   2HE2  GLN  34          HE22      GLN  34 -11.448  -0.537   2.127
  288    H    GLN  35           H        GLN  35  -6.198   0.143  -3.011
  289    HA   GLN  35           HA       GLN  35  -7.684  -1.110  -5.195
  290   1HB   GLN  35          HB2       GLN  35  -6.488   0.975  -5.598
  291   2HB   GLN  35          HB3       GLN  35  -4.978   0.276  -5.011
  292   1HG   GLN  35          HG2       GLN  35  -4.980   0.372  -7.439
  293   2HG   GLN  35          HG3       GLN  35  -4.907  -1.291  -6.859
  294   1HE2  GLN  35          HE21      GLN  35  -5.860  -2.406  -8.575
  295   2HE2  GLN  35          HE22      GLN  35  -7.479  -2.057  -9.181
  296    H    ILE  36           H        ILE  36  -4.776  -1.842  -3.241
  297    HA   ILE  36           HA       ILE  36  -4.079  -4.302  -4.506
  298    HB   ILE  36           HB       ILE  36  -3.833  -3.430  -1.630
  299   1HG1  ILE  36          HG12      ILE  36  -1.598  -3.600  -3.692
  300   2HG1  ILE  36          HG13      ILE  36  -2.593  -2.151  -3.582
  301   1HG2  ILE  36          HG21      ILE  36  -2.562  -5.801  -3.134
  302   2HG2  ILE  36          HG22      ILE  36  -2.068  -5.273  -1.511
  303   3HG2  ILE  36          HG23      ILE  36  -3.679  -5.922  -1.778
  304   1HD1  ILE  36          HD11      ILE  36  -2.014  -1.901  -1.187
  305   2HD1  ILE  36          HD12      ILE  36  -0.928  -3.305  -1.325
  306   3HD1  ILE  36          HD13      ILE  36  -0.600  -1.835  -2.265
  307    H    GLY  37           H        GLY  37  -6.528  -3.606  -1.898
  308   1HA   GLY  37          HA2       GLY  37  -7.538  -6.219  -1.650
  309   2HA   GLY  37          HA3       GLY  37  -8.437  -4.730  -1.359
  310    H    ARG  38           H        ARG  38  -8.014  -4.047  -4.407
  311    HA   ARG  38           HA       ARG  38 -10.338  -5.529  -5.466
  312   1HB   ARG  38          HB2       ARG  38  -8.632  -3.377  -6.781
  313   2HB   ARG  38          HB3       ARG  38 -10.123  -4.059  -7.400
  314   1HG   ARG  38          HG2       ARG  38  -9.776  -2.233  -5.024
  315   2HG   ARG  38          HG3       ARG  38 -10.700  -1.992  -6.510
  316   1HD   ARG  38          HD2       ARG  38 -12.254  -3.828  -5.794
  317   2HD   ARG  38          HD3       ARG  38 -11.402  -3.920  -4.254
  318    HE   ARG  38           HE       ARG  38 -13.321  -1.898  -5.120
  319   1HH1  ARG  38          HH12      ARG  38 -10.615  -2.245  -2.872
  320   2HH1  ARG  38          HH11      ARG  38 -11.433  -1.271  -1.674
  321   1HH2  ARG  38          HH22      ARG  38 -14.152  -0.529  -3.554
  322   2HH2  ARG  38          HH21      ARG  38 -13.256  -0.286  -2.072
  323    H    GLU  39           H        GLU  39  -6.930  -6.001  -5.609
  324    HA   GLU  39           HA       GLU  39  -7.245  -7.822  -7.984
  325   1HB   GLU  39          HB2       GLU  39  -5.306  -6.931  -9.001
  326   2HB   GLU  39          HB3       GLU  39  -6.395  -5.593  -8.598
  327   1HG   GLU  39          HG2       GLU  39  -4.992  -5.155  -6.553
  328   2HG   GLU  39          HG3       GLU  39  -3.891  -6.424  -7.101
  329    H    ASN  40           H        ASN  40  -5.636  -7.320  -4.944
  330    HA   ASN  40           HA       ASN  40  -5.047 -10.175  -4.815
  331   1HB   ASN  40          HB2       ASN  40  -2.923  -8.911  -5.676
  332   2HB   ASN  40          HB3       ASN  40  -2.796  -8.279  -4.054
  333   1HD2  ASN  40          HD21      ASN  40  -1.029 -10.197  -5.533
  334   2HD2  ASN  40          HD22      ASN  40  -1.016 -11.651  -4.537
  335    HA   PRO  41           HA       PRO  41  -6.872  -8.220  -0.971
  336   1HB   PRO  41          HB2       PRO  41  -8.773 -10.139  -0.460
  337   2HB   PRO  41          HB3       PRO  41  -9.011  -8.743  -1.560
  338   1HG   PRO  41          HG2       PRO  41  -8.169 -11.547  -2.306
  339   2HG   PRO  41          HG3       PRO  41  -9.498 -10.567  -3.019
  340   1HD   PRO  41          HD2       PRO  41  -7.086 -10.686  -4.201
  341   2HD   PRO  41          HD3       PRO  41  -7.944  -9.117  -4.100
  342    H    GLN  42           H        GLN  42  -5.357 -11.262  -1.724
  343    HA   GLN  42           HA       GLN  42  -4.952 -12.123   1.050
  344   1HB   GLN  42          HB2       GLN  42  -3.524 -12.954  -1.501
  345   2HB   GLN  42          HB3       GLN  42  -3.502 -13.804   0.055
  346   1HG   GLN  42          HG2       GLN  42  -6.009 -14.050  -0.135
  347   2HG   GLN  42          HG3       GLN  42  -5.909 -13.402  -1.772
  348   1HE2  GLN  42          HE21      GLN  42  -6.694 -16.186  -0.684
  349   2HE2  GLN  42          HE22      GLN  42  -5.680 -17.269  -1.630
  350    H    LEU  43           H        LEU  43  -2.973 -10.458  -1.475
  351    HA   LEU  43           HA       LEU  43  -0.709  -9.943   0.221
  352   1HB   LEU  43          HB2       LEU  43  -0.807  -9.677  -2.320
  353   2HB   LEU  43          HB3       LEU  43  -1.823  -8.257  -2.062
  354    HG   LEU  43           HG       LEU  43  -0.056  -7.055  -0.993
  355   1HD1  LEU  43          HD11      LEU  43   1.612  -9.595  -1.259
  356   2HD1  LEU  43          HD12      LEU  43   2.261  -7.987  -0.858
  357   3HD1  LEU  43          HD13      LEU  43   1.139  -8.771   0.251
  358   1HD2  LEU  43          HD21      LEU  43  -0.130  -7.058  -3.456
  359   2HD2  LEU  43          HD22      LEU  43   1.525  -6.873  -2.857
  360   3HD2  LEU  43          HD23      LEU  43   0.987  -8.442  -3.494
  361    H    LEU  44           H        LEU  44  -3.832  -8.383  -0.227
  362    HA   LEU  44           HA       LEU  44  -3.187  -5.932   1.119
  363   1HB   LEU  44          HB2       LEU  44  -5.206  -6.467  -0.383
  364   2HB   LEU  44          HB3       LEU  44  -5.940  -7.254   0.976
  365    HG   LEU  44           HG       LEU  44  -6.383  -4.725   0.262
  366   1HD1  LEU  44          HD11      LEU  44  -7.368  -4.289   2.389
  367   2HD1  LEU  44          HD12      LEU  44  -7.667  -5.951   1.882
  368   3HD1  LEU  44          HD13      LEU  44  -6.443  -5.619   3.146
  369   1HD2  LEU  44          HD21      LEU  44  -5.386  -3.100   1.765
  370   2HD2  LEU  44          HD22      LEU  44  -4.333  -4.319   2.484
  371   3HD2  LEU  44          HD23      LEU  44  -4.127  -3.851   0.773
  372    H    GLN  45           H        GLN  45  -5.028  -8.702   2.257
  373    HA   GLN  45           HA       GLN  45  -5.021  -8.217   5.047
  374   1HB   GLN  45          HB2       GLN  45  -5.064 -10.801   3.460
  375   2HB   GLN  45          HB3       GLN  45  -5.221 -10.766   5.219
  376   1HG   GLN  45          HG2       GLN  45  -7.225  -9.433   5.129
  377   2HG   GLN  45          HG3       GLN  45  -7.060  -9.169   3.389
  378   1HE2  GLN  45          HE21      GLN  45  -7.340 -11.012   1.948
  379   2HE2  GLN  45          HE22      GLN  45  -8.346 -12.372   2.466
  380    H    GLN  46           H        GLN  46  -2.303  -9.553   3.118
  381    HA   GLN  46           HA       GLN  46  -0.665 -10.154   5.447
  382   1HB   GLN  46          HB2       GLN  46  -0.265  -9.968   2.477
  383   2HB   GLN  46          HB3       GLN  46   1.128 -10.007   3.560
  384   1HG   GLN  46          HG2       GLN  46   0.326 -12.068   4.620
  385   2HG   GLN  46          HG3       GLN  46  -1.188 -12.005   3.721
  386   1HE2  GLN  46          HE22      GLN  46  -1.113 -12.179   1.388
  387   2HE2  GLN  46          HE21      GLN  46   0.200 -13.113   0.641
  388    H    ILE  47           H        ILE  47  -0.814  -7.356   3.178
  389    HA   ILE  47           HA       ILE  47   1.236  -5.798   4.397
  390    HB   ILE  47           HB       ILE  47  -1.117  -5.207   2.598
  391   1HG1  ILE  47          HG12      ILE  47   1.903  -4.892   2.295
  392   2HG1  ILE  47          HG13      ILE  47   1.020  -6.352   1.832
  393   1HG2  ILE  47          HG21      ILE  47   0.773  -3.152   3.809
  394   2HG2  ILE  47          HG22      ILE  47  -0.254  -2.853   2.388
  395   3HG2  ILE  47          HG23      ILE  47  -0.999  -3.187   3.945
  396   1HD1  ILE  47          HD11      ILE  47  -0.327  -4.983   0.232
  397   2HD1  ILE  47          HD12      ILE  47   0.760  -3.606   0.571
  398   3HD1  ILE  47          HD13      ILE  47   1.409  -5.088  -0.145
  399    H    SER  48           H        SER  48  -2.263  -6.021   5.168
  400    HA   SER  48           HA       SER  48  -2.166  -3.878   7.109
  401   1HB   SER  48          HB2       SER  48  -4.349  -4.600   7.831
  402   2HB   SER  48          HB3       SER  48  -4.266  -4.573   6.064
  403    HG   SER  48           HG       SER  48  -5.265  -6.471   6.955
  404    H    GLN  49           H        GLN  49  -1.613  -7.356   7.371
  405    HA   GLN  49           HA       GLN  49  -1.207  -7.459  10.226
  406   1HB   GLN  49          HB2       GLN  49  -0.556  -9.225   7.856
  407   2HB   GLN  49          HB3       GLN  49   0.114  -9.612   9.437
  408   1HG   GLN  49          HG2       GLN  49  -2.136  -9.681  10.428
  409   2HG   GLN  49          HG3       GLN  49  -2.857  -9.226   8.882
  410   1HE2  GLN  49          HE21      GLN  49  -2.741 -10.767   7.106
  411   2HE2  GLN  49          HE22      GLN  49  -2.521 -12.492   7.449
  412    H    HIS  50           H        HIS  50   0.731  -5.976   7.832
  413    HA   HIS  50           HA       HIS  50   3.101  -5.870   9.641
  414   1HB   HIS  50          HB2       HIS  50   3.103  -6.500   6.664
  415   2HB   HIS  50          HB3       HIS  50   4.546  -6.239   7.653
  416    HD1  HIS  50           HD1      HIS  50   1.911  -8.865   6.932
  417    HD2  HIS  50           HD2      HIS  50   5.260  -8.226   9.374
  418    HE1  HIS  50           HE1      HIS  50   2.507 -11.142   7.939
  419    H    GLN  51           H        GLN  51   0.933  -3.888   9.039
  420    HA   GLN  51           HA       GLN  51   1.493  -2.207   6.978
  421   1HB   GLN  51          HB2       GLN  51  -0.554  -2.417   8.479
  422   2HB   GLN  51          HB3       GLN  51   0.239  -1.277   9.583
  423   1HG   GLN  51          HG2       GLN  51   0.351   0.385   7.733
  424   2HG   GLN  51          HG3       GLN  51  -0.391  -0.790   6.639
  425   1HE2  GLN  51          HE21      GLN  51  -1.092   1.835   8.690
  426   2HE2  GLN  51          HE22      GLN  51  -2.816   1.511   8.872
  427    H    GLU  52           H        GLU  52   2.995  -1.919  10.206
  428    HA   GLU  52           HA       GLU  52   4.244   0.650   9.754
  429   1HB   GLU  52          HB2       GLU  52   5.048  -1.678  11.541
  430   2HB   GLU  52          HB3       GLU  52   5.808  -0.082  11.556
  431   1HG   GLU  52          HG2       GLU  52   3.604   0.950  12.103
  432   2HG   GLU  52          HG3       GLU  52   2.881  -0.653  12.181
  433    H    HIS  53           H        HIS  53   5.213  -2.669   8.885
  434    HA   HIS  53           HA       HIS  53   7.827  -1.824   7.857
  435   1HB   HIS  53          HB2       HIS  53   6.351  -4.463   7.564
  436   2HB   HIS  53          HB3       HIS  53   8.026  -4.131   7.121
  437    HD1  HIS  53           HD1      HIS  53   9.278  -2.848   9.594
  438    HD2  HIS  53           HD2      HIS  53   6.346  -5.853   9.767
  439    HE1  HIS  53           HE1      HIS  53   9.521  -3.948  11.875
  440    H    PHE  54           H        PHE  54   4.568  -2.383   6.507
  441    HA   PHE  54           HA       PHE  54   5.338  -1.888   3.741
  442   1HB   PHE  54          HB2       PHE  54   3.125  -2.833   4.441
  443   2HB   PHE  54          HB3       PHE  54   2.720  -1.278   5.166
  444    HD1  PHE  54           HD1      PHE  54   4.211  -2.315   1.831
  445    HD2  PHE  54           HD2      PHE  54   1.068  -0.207   3.904
  446    HE1  PHE  54           HE1      PHE  54   3.263  -1.579  -0.337
  447    HE2  PHE  54           HE2      PHE  54   0.093   0.465   1.723
  448    HZ   PHE  54           HZ       PHE  54   1.194  -0.209  -0.397
  449    H    ILE  55           H        ILE  55   4.377   0.383   6.350
  450    HA   ILE  55           HA       ILE  55   4.835   2.754   4.856
  451    HB   ILE  55           HB       ILE  55   4.795   2.096   7.757
  452   1HG1  ILE  55          HG12      ILE  55   3.105   3.882   5.941
  453   2HG1  ILE  55          HG13      ILE  55   2.748   2.185   6.276
  454   1HG2  ILE  55          HG21      ILE  55   6.481   3.913   7.592
  455   2HG2  ILE  55          HG22      ILE  55   5.361   4.864   6.587
  456   3HG2  ILE  55          HG23      ILE  55   4.988   4.516   8.288
  457   1HD1  ILE  55          HD11      ILE  55   2.571   2.717   8.699
  458   2HD1  ILE  55          HD12      ILE  55   2.742   4.448   8.284
  459   3HD1  ILE  55          HD13      ILE  55   1.360   3.520   7.670
  460    H    GLN  56           H        GLN  56   7.263   0.714   6.590
  461    HA   GLN  56           HA       GLN  56   9.488   2.438   5.920
  462   1HB   GLN  56          HB2       GLN  56   9.353  -0.525   6.597
  463   2HB   GLN  56          HB3       GLN  56  10.859   0.352   6.325
  464   1HG   GLN  56          HG2       GLN  56  10.393   1.870   8.175
  465   2HG   GLN  56          HG3       GLN  56   8.830   1.116   8.473
  466   1HE2  GLN  56          HE21      GLN  56  11.781   1.257   9.847
  467   2HE2  GLN  56          HE22      GLN  56  11.890  -0.387  10.464
  468    H    MET  57           H        MET  57   8.225  -0.511   4.232
  469    HA   MET  57           HA       MET  57  10.027  -0.456   2.027
  470   1HB   MET  57          HB2       MET  57   7.200  -1.501   2.350
  471   2HB   MET  57          HB3       MET  57   8.095  -1.655   0.833
  472   1HG   MET  57          HG2       MET  57   9.135  -2.678   3.495
  473   2HG   MET  57          HG3       MET  57   8.226  -3.644   2.333
  474   1HE   MET  57          HE1       MET  57  11.068  -4.486   3.504
  475   2HE   MET  57          HE2       MET  57  10.089  -5.454   2.380
  476   3HE   MET  57          HE3       MET  57  11.804  -5.145   2.027
  477    H    LEU  58           H        LEU  58   6.995   1.253   2.533
  478    HA   LEU  58           HA       LEU  58   6.681   2.570   0.025
  479   1HB   LEU  58          HB2       LEU  58   5.738   2.768   2.873
  480   2HB   LEU  58          HB3       LEU  58   5.461   4.192   1.859
  481    HG   LEU  58           HG       LEU  58   4.535   1.385   1.116
  482   1HD1  LEU  58          HD11      LEU  58   2.311   2.182   1.907
  483   2HD1  LEU  58          HD12      LEU  58   3.469   2.046   3.236
  484   3HD1  LEU  58          HD13      LEU  58   3.076   3.645   2.576
  485   1HD2  LEU  58          HD21      LEU  58   3.683   4.166   0.215
  486   2HD2  LEU  58          HD22      LEU  58   4.743   3.100  -0.711
  487   3HD2  LEU  58          HD23      LEU  58   3.056   2.613  -0.413
  488    H    ASN  59           H        ASN  59   8.331   3.556   3.002
  489    HA   ASN  59           HA       ASN  59   9.196   6.156   2.023
  490   1HB   ASN  59          HB2       ASN  59   9.682   4.453   4.468
  491   2HB   ASN  59          HB3       ASN  59  10.850   5.712   4.103
  492   1HD2  ASN  59          HD21      ASN  59   7.497   5.119   4.999
  493   2HD2  ASN  59          HD22      ASN  59   7.153   6.801   5.422
  494    H    GLU  60           H        GLU  60  10.706   2.930   2.035
  495    HA   GLU  60           HA       GLU  60  13.264   3.711   1.013
  496   1HB   GLU  60          HB2       GLU  60  11.673   1.150   0.919
  497   2HB   GLU  60          HB3       GLU  60  13.257   1.287   0.155
  498   1HG   GLU  60          HG2       GLU  60  12.793   1.974   3.088
  499   2HG   GLU  60          HG3       GLU  60  13.193   0.360   2.512
  500    HA   PRO  61           HA       PRO  61  12.292   4.954  -3.058
  501   1HB   PRO  61          HB2       PRO  61  14.579   4.453  -4.484
  502   2HB   PRO  61          HB3       PRO  61  14.454   5.705  -3.207
  503   1HG   PRO  61          HG2       PRO  61  15.509   2.884  -2.983
  504   2HG   PRO  61          HG3       PRO  61  16.276   4.401  -2.393
  505   1HD   PRO  61          HD2       PRO  61  14.839   2.756  -0.770
  506   2HD   PRO  61          HD3       PRO  61  14.781   4.537  -0.568
  507    H    VAL  62           H        VAL  62  11.618   4.316  -5.147
  508    HA   VAL  62           HA       VAL  62  10.745   1.636  -5.519
  509    HB   VAL  62           HB       VAL  62  10.229   2.412  -7.830
  510   1HG1  VAL  62          HG11      VAL  62   8.612   2.583  -5.981
  511   2HG1  VAL  62          HG12      VAL  62   9.239   4.192  -5.553
  512   3HG1  VAL  62          HG13      VAL  62   8.430   3.933  -7.111
  513   1HG2  VAL  62          HG21      VAL  62  10.351   4.768  -8.407
  514   2HG2  VAL  62          HG22      VAL  62  11.200   5.152  -6.903
  515   3HG2  VAL  62          HG23      VAL  62  11.978   4.139  -8.144
  516    H    GLN  63           H        GLN  63  13.714   3.212  -6.490
  517    HA   GLN  63           HA       GLN  63  14.683   1.014  -8.165
  518   1HB   GLN  63          HB2       GLN  63  16.073   3.442  -6.955
  519   2HB   GLN  63          HB3       GLN  63  16.810   2.312  -8.097
  520   1HG   GLN  63          HG2       GLN  63  14.987   2.872  -9.743
  521   2HG   GLN  63          HG3       GLN  63  14.481   4.179  -8.668
  522   1HE2  GLN  63          HE21      GLN  63  15.756   4.172 -11.483
  523   2HE2  GLN  63          HE22      GLN  63  17.158   5.219 -11.281
  524    H    GLU  64           H        GLU  64  13.988   0.771  -5.084
  525    HA   GLU  64           HA       GLU  64  14.463  -0.658  -3.447
  526   1HB   GLU  64          HB2       GLU  64  15.286  -2.096  -5.465
  527   2HB   GLU  64          HB3       GLU  64  16.905  -1.740  -4.840
  528   1HG   GLU  64          HG2       GLU  64  16.052  -2.579  -2.572
  529   2HG   GLU  64          HG3       GLU  64  14.626  -3.166  -3.423
  530    H    ALA  65           H        ALA  65  17.466   0.812  -4.663
  531    HA   ALA  65           HA       ALA  65  18.090   1.799  -1.916
  532   1HB   ALA  65          HB1       ALA  65  20.431   1.090  -2.202
  533   2HB   ALA  65          HB2       ALA  65  19.338  -0.300  -2.303
  534   3HB   ALA  65          HB3       ALA  65  20.041   0.385  -3.785
  535    H    GLY  66           H        GLY  66  17.768   2.613  -5.219
  536   1HA   GLY  66          HA2       GLY  66  18.074   4.597  -6.340
  537   2HA   GLY  66          HA3       GLY  66  18.379   5.362  -4.781
  538    H    GLY  67           H        GLY  67  20.439   2.759  -5.976
  539   1HA   GLY  67          HA2       GLY  67  22.796   4.353  -5.510
  540   2HA   GLY  67          HA3       GLY  67  22.734   2.663  -5.993
  541    H    GLN  68           H        GLN  68  21.065   4.687  -8.215
  542    HA   GLN  68           HA       GLN  68  22.892   4.218 -10.373
  543   1HB   GLN  68          HB2       GLN  68  21.434   5.663 -11.667
  544   2HB   GLN  68          HB3       GLN  68  20.496   4.521 -10.712
  545   1HG   GLN  68          HG2       GLN  68  19.935   6.299  -9.082
  546   2HG   GLN  68          HG3       GLN  68  20.972   7.437  -9.942
  547   1HE2  GLN  68          HE21      GLN  68  19.046   8.837 -10.113
  548   2HE2  GLN  68          HE22      GLN  68  17.881   8.490 -11.384
  549    H    GLY  69           H        GLY  69  24.049   5.765 -11.675
  550   1HA   GLY  69          HA2       GLY  69  25.505   7.508 -12.082
  551   2HA   GLY  69          HA3       GLY  69  24.520   8.472 -10.990
  552    H    GLY  70           H        GLY  70  26.371   9.569 -10.269
  553   1HA   GLY  70          HA2       GLY  70  27.565   8.543  -7.874
  554   2HA   GLY  70          HA3       GLY  70  28.758   8.584  -9.174
  555    H    GLY  71           H        GLY  71  29.323  10.075  -7.045
  556   1HA   GLY  71          HA2       GLY  71  29.723  12.715  -7.947
  557   2HA   GLY  71          HA3       GLY  71  28.275  12.734  -6.940
  558    H    GLY  72           H        GLY  72  29.957  14.283  -5.915
  559   1HA   GLY  72          HA2       GLY  72  30.732  13.281  -3.350
  560   2HA   GLY  72          HA3       GLY  72  32.169  13.433  -4.361
  Start of MODEL   13
    1   1H    GLY   1           H1       GLY   1  17.015 -13.448  -0.397
    2   2H    GLY   1           H2       GLY   1  16.382 -12.431  -1.520
    3   3H    GLY   1           H3       GLY   1  15.577 -12.702  -0.116
    4   1HA   GLY   1          HA2       GLY   1  18.176 -11.330  -0.371
    5   2HA   GLY   1          HA3       GLY   1  16.624 -10.541  -0.032
    6    H    SER   2           H        SER   2  15.642 -10.833   1.988
    7    HA   SER   2           HA       SER   2  17.335 -11.974   4.188
    8   1HB   SER   2          HB2       SER   2  15.727  -9.397   4.225
    9   2HB   SER   2          HB3       SER   2  16.663 -10.068   5.570
   10    HG   SER   2           HG       SER   2  17.831  -8.474   4.415
   11    H    HIS   3           H        HIS   3  14.473 -12.440   2.644
   12    HA   HIS   3           HA       HIS   3  12.460 -13.316   3.090
   13   1HB   HIS   3          HB2       HIS   3  14.123 -14.872   5.083
   14   2HB   HIS   3          HB3       HIS   3  12.531 -15.345   4.497
   15    HD1  HIS   3           HD1      HIS   3  13.833 -14.210   1.384
   16    HD2  HIS   3           HD2      HIS   3  14.703 -17.406   3.973
   17    HE1  HIS   3           HE1      HIS   3  14.889 -16.020  -0.049
   18    H    MET   4           H        MET   4  12.785 -10.859   4.438
   19    HA   MET   4           HA       MET   4  11.255 -10.778   6.887
   20   1HB   MET   4          HB2       MET   4  11.604  -8.833   4.558
   21   2HB   MET   4          HB3       MET   4  10.735  -8.436   6.039
   22   1HG   MET   4          HG2       MET   4  13.639  -9.258   5.932
   23   2HG   MET   4          HG3       MET   4  13.059  -7.592   6.014
   24   1HE   MET   4          HE1       MET   4  11.733  -7.167   9.609
   25   2HE   MET   4          HE2       MET   4  12.222  -6.374   8.098
   26   3HE   MET   4          HE3       MET   4  10.790  -7.426   8.127
   27    HA   PRO   5           HA       PRO   5   7.340 -12.106   5.578
   28   1HB   PRO   5          HB2       PRO   5   5.477 -10.469   6.790
   29   2HB   PRO   5          HB3       PRO   5   6.471 -11.689   7.643
   30   1HG   PRO   5          HG2       PRO   5   7.009  -8.728   7.333
   31   2HG   PRO   5          HG3       PRO   5   7.054  -9.703   8.841
   32   1HD   PRO   5          HD2       PRO   5   9.331  -9.145   7.528
   33   2HD   PRO   5          HD3       PRO   5   9.070 -10.788   8.182
   34    H    LEU   6           H        LEU   6   8.127  -8.862   4.639
   35    HA   LEU   6           HA       LEU   6   6.127  -8.973   2.425
   36   1HB   LEU   6          HB2       LEU   6   7.364  -6.514   3.682
   37   2HB   LEU   6          HB3       LEU   6   6.154  -6.549   2.400
   38    HG   LEU   6           HG       LEU   6   5.708  -7.455   5.276
   39   1HD1  LEU   6          HD11      LEU   6   5.979  -5.026   4.971
   40   2HD1  LEU   6          HD12      LEU   6   4.711  -5.035   3.725
   41   3HD1  LEU   6          HD13      LEU   6   4.314  -5.441   5.413
   42   1HD2  LEU   6          HD21      LEU   6   4.229  -8.707   3.671
   43   2HD2  LEU   6          HD22      LEU   6   3.331  -7.605   4.715
   44   3HD2  LEU   6          HD23      LEU   6   3.651  -7.151   3.035
   45    H    GLU   7           H        GLU   7   9.103  -9.977   2.701
   46    HA   GLU   7           HA       GLU   7  10.363  -8.795   0.352
   47   1HB   GLU   7          HB2       GLU   7  11.610 -10.100   2.004
   48   2HB   GLU   7          HB3       GLU   7  10.674 -11.547   1.626
   49   1HG   GLU   7          HG2       GLU   7  11.696 -11.834  -0.467
   50   2HG   GLU   7          HG3       GLU   7  12.149 -10.136  -0.598
   51    H    PHE   8           H        PHE   8   7.759 -11.047   0.893
   52    HA   PHE   8           HA       PHE   8   7.535 -12.474  -1.475
   53   1HB   PHE   8          HB2       PHE   8   6.230 -12.870   0.536
   54   2HB   PHE   8          HB3       PHE   8   5.413 -11.318   0.365
   55    HD1  PHE   8           HD1      PHE   8   3.449 -11.097  -0.972
   56    HD2  PHE   8           HD2      PHE   8   5.816 -14.690  -1.209
   57    HE1  PHE   8           HE1      PHE   8   1.663 -12.186  -2.311
   58    HE2  PHE   8           HE2      PHE   8   4.027 -15.777  -2.549
   59    HZ   PHE   8           HZ       PHE   8   1.951 -14.526  -3.100
   60    H    LEU   9           H        LEU   9   6.535  -9.067  -1.005
   61    HA   LEU   9           HA       LEU   9   5.550  -9.022  -3.813
   62   1HB   LEU   9          HB2       LEU   9   4.081  -7.290  -3.289
   63   2HB   LEU   9          HB3       LEU   9   3.791  -8.688  -2.294
   64    HG   LEU   9           HG       LEU   9   3.432  -6.528  -1.184
   65   1HD1  LEU   9          HD11      LEU   9   4.377  -7.023   0.919
   66   2HD1  LEU   9          HD12      LEU   9   4.039  -8.589   0.152
   67   3HD1  LEU   9          HD13      LEU   9   5.700  -7.973   0.211
   68   1HD2  LEU   9          HD21      LEU   9   5.334  -5.334  -2.281
   69   2HD2  LEU   9          HD22      LEU   9   5.151  -5.048  -0.533
   70   3HD2  LEU   9          HD23      LEU   9   6.429  -6.134  -1.127
   71    H    ARG  10           H        ARG  10   8.240  -8.099  -2.142
   72    HA   ARG  10           HA       ARG  10   8.756  -5.496  -3.166
   73   1HB   ARG  10          HB2       ARG  10   9.814  -6.917  -1.208
   74   2HB   ARG  10          HB3       ARG  10  10.953  -7.456  -2.446
   75   1HG   ARG  10          HG2       ARG  10  11.560  -5.055  -2.863
   76   2HG   ARG  10          HG3       ARG  10  10.320  -4.570  -1.694
   77   1HD   ARG  10          HD2       ARG  10  12.470  -4.430  -0.637
   78   2HD   ARG  10          HD3       ARG  10  11.533  -5.730   0.105
   79    HE   ARG  10           HE       ARG  10  13.653  -6.187  -1.989
   80   1HH1  ARG  10          HH22      ARG  10  12.420  -7.099   1.205
   81   2HH1  ARG  10          HH21      ARG  10  13.444  -8.539   1.195
   82   1HH2  ARG  10          HH12      ARG  10  14.946  -8.017  -1.750
   83   2HH2  ARG  10          HH11      ARG  10  14.698  -9.006  -0.310
   84    H    ASN  11           H        ASN  11   8.682  -8.350  -4.905
   85    HA   ASN  11           HA       ASN  11  10.233  -7.182  -7.187
   86   1HB   ASN  11          HB2       ASN  11  10.083 -10.090  -6.271
   87   2HB   ASN  11          HB3       ASN  11  10.888  -9.523  -7.736
   88   1HD2  ASN  11          HD21      ASN  11  11.302 -10.073  -4.359
   89   2HD2  ASN  11          HD22      ASN  11  12.908  -9.352  -4.270
   90    H    GLN  12           H        GLN  12   7.138  -7.628  -6.315
   91    HA   GLN  12           HA       GLN  12   6.137  -9.069  -8.697
   92   1HB   GLN  12          HB2       GLN  12   4.727  -7.780  -6.324
   93   2HB   GLN  12          HB3       GLN  12   3.912  -8.693  -7.580
   94   1HG   GLN  12          HG2       GLN  12   6.036  -9.823  -5.714
   95   2HG   GLN  12          HG3       GLN  12   4.289  -9.996  -5.503
   96   1HE2  GLN  12          HE21      GLN  12   5.858 -12.225  -5.501
   97   2HE2  GLN  12          HE22      GLN  12   5.593 -13.133  -6.989
   98    HA   PRO  13           HA       PRO  13   5.046  -5.516 -11.188
   99   1HB   PRO  13          HB2       PRO  13   2.192  -6.497 -11.080
  100   2HB   PRO  13          HB3       PRO  13   3.144  -5.957 -12.499
  101   1HG   PRO  13          HG2       PRO  13   2.800  -8.590 -12.047
  102   2HG   PRO  13          HG3       PRO  13   4.423  -7.974 -12.501
  103   1HD   PRO  13          HD2       PRO  13   3.367  -8.654  -9.755
  104   2HD   PRO  13          HD3       PRO  13   4.941  -9.083 -10.495
  105    H    GLN  14           H        GLN  14   3.867  -3.534 -11.281
  106    HA   GLN  14           HA       GLN  14   3.243  -1.543 -10.506
  107   1HB   GLN  14          HB2       GLN  14   1.291  -3.186  -8.859
  108   2HB   GLN  14          HB3       GLN  14   1.312  -1.433  -8.886
  109   1HG   GLN  14          HG2       GLN  14  -0.363  -2.059 -10.394
  110   2HG   GLN  14          HG3       GLN  14   0.975  -1.463 -11.365
  111   1HE2  GLN  14          HE21      GLN  14  -0.907  -4.375 -10.464
  112   2HE2  GLN  14          HE22      GLN  14  -0.255  -5.361 -11.758
  113    H    PHE  15           H        PHE  15   4.788  -3.536  -8.200
  114    HA   PHE  15           HA       PHE  15   4.794  -1.823  -5.881
  115   1HB   PHE  15          HB2       PHE  15   5.359  -4.201  -5.796
  116   2HB   PHE  15          HB3       PHE  15   6.728  -3.947  -6.882
  117    HD1  PHE  15           HD1      PHE  15   5.424  -3.216  -3.465
  118    HD2  PHE  15           HD2      PHE  15   8.854  -3.180  -6.077
  119    HE1  PHE  15           HE1      PHE  15   6.902  -2.729  -1.529
  120    HE2  PHE  15           HE2      PHE  15  10.318  -2.648  -4.148
  121    HZ   PHE  15           HZ       PHE  15   9.342  -2.392  -1.880
  122    H    GLN  16           H        GLN  16   6.606  -1.926  -8.806
  123    HA   GLN  16           HA       GLN  16   8.815  -0.199  -8.307
  124   1HB   GLN  16          HB2       GLN  16   7.230  -0.868 -10.825
  125   2HB   GLN  16          HB3       GLN  16   8.811  -0.079 -10.808
  126   1HG   GLN  16          HG2       GLN  16   9.263  -2.331 -11.341
  127   2HG   GLN  16          HG3       GLN  16   9.722  -2.162  -9.649
  128   1HE2  GLN  16          HE21      GLN  16   9.426  -4.468  -9.186
  129   2HE2  GLN  16          HE22      GLN  16   7.774  -5.102  -9.111
  130    H    GLN  17           H        GLN  17   5.430   0.514  -8.774
  131    HA   GLN  17           HA       GLN  17   5.990   3.365  -9.528
  132   1HB   GLN  17          HB2       GLN  17   3.695   1.528 -10.309
  133   2HB   GLN  17          HB3       GLN  17   3.853   3.235 -10.751
  134   1HG   GLN  17          HG2       GLN  17   5.960   2.717 -11.967
  135   2HG   GLN  17          HG3       GLN  17   5.756   1.004 -11.596
  136   1HE2  GLN  17          HE21      GLN  17   5.232   3.231 -14.043
  137   2HE2  GLN  17          HE22      GLN  17   3.916   2.383 -14.854
  138    H    MET  18           H        MET  18   3.652   1.278  -7.666
  139    HA   MET  18           HA       MET  18   1.975   3.349  -6.890
  140   1HB   MET  18          HB2       MET  18   1.131   1.837  -5.257
  141   2HB   MET  18          HB3       MET  18   1.474   0.976  -6.755
  142   1HG   MET  18          HG2       MET  18   3.571   0.070  -5.763
  143   2HG   MET  18          HG3       MET  18   3.275   0.994  -4.289
  144   1HE   MET  18          HE1       MET  18   2.154  -2.171  -6.409
  145   2HE   MET  18          HE2       MET  18   0.742  -2.708  -5.479
  146   3HE   MET  18          HE3       MET  18   0.664  -1.191  -6.396
  147    H    ARG  19           H        ARG  19   5.029   2.449  -5.340
  148    HA   ARG  19           HA       ARG  19   4.586   4.094  -2.970
  149   1HB   ARG  19          HB2       ARG  19   7.298   3.157  -3.955
  150   2HB   ARG  19          HB3       ARG  19   6.760   3.468  -2.301
  151   1HG   ARG  19          HG2       ARG  19   5.051   1.511  -2.760
  152   2HG   ARG  19          HG3       ARG  19   6.081   1.142  -4.130
  153   1HD   ARG  19          HD2       ARG  19   6.592   0.797  -1.211
  154   2HD   ARG  19          HD3       ARG  19   6.877  -0.308  -2.547
  155    HE   ARG  19           HE       ARG  19   8.763   1.436  -1.341
  156   1HH1  ARG  19          HH22      ARG  19   8.068   0.246  -4.609
  157   2HH1  ARG  19          HH21      ARG  19   9.722   0.488  -5.088
  158   1HH2  ARG  19          HH12      ARG  19  10.763   1.731  -2.056
  159   2HH2  ARG  19          HH11      ARG  19  11.217   1.279  -3.683
  160    H    GLN  20           H        GLN  20   5.829   4.759  -6.154
  161    HA   GLN  20           HA       GLN  20   7.100   7.306  -5.596
  162   1HB   GLN  20          HB2       GLN  20   5.656   6.495  -8.152
  163   2HB   GLN  20          HB3       GLN  20   6.832   7.774  -7.937
  164   1HG   GLN  20          HG2       GLN  20   8.575   6.012  -7.382
  165   2HG   GLN  20          HG3       GLN  20   7.378   4.778  -7.774
  166   1HE2  GLN  20          HE21      GLN  20   8.376   3.903  -9.662
  167   2HE2  GLN  20          HE22      GLN  20   8.687   4.890 -11.086
  168    H    ILE  21           H        ILE  21   3.749   6.246  -6.108
  169    HA   ILE  21           HA       ILE  21   2.612   8.841  -6.441
  170    HB   ILE  21           HB       ILE  21   1.168   6.388  -5.334
  171   1HG1  ILE  21          HG12      ILE  21   1.852   7.033  -8.218
  172   2HG1  ILE  21          HG13      ILE  21   2.397   5.637  -7.290
  173   1HG2  ILE  21          HG21      ILE  21  -0.026   8.586  -5.293
  174   2HG2  ILE  21          HG22      ILE  21   0.214   8.716  -7.049
  175   3HG2  ILE  21          HG23      ILE  21  -0.793   7.421  -6.361
  176   1HD1  ILE  21          HD11      ILE  21  -0.445   6.113  -8.213
  177   2HD1  ILE  21          HD12      ILE  21   0.692   4.860  -8.742
  178   3HD1  ILE  21          HD13      ILE  21   0.060   4.820  -7.090
  179    H    ILE  22           H        ILE  22   3.015   6.667  -3.671
  180    HA   ILE  22           HA       ILE  22   1.575   8.291  -1.761
  181    HB   ILE  22           HB       ILE  22   3.589   6.073  -1.245
  182   1HG1  ILE  22          HG12      ILE  22   1.955   4.993  -2.532
  183   2HG1  ILE  22          HG13      ILE  22   1.466   4.671  -0.888
  184   1HG2  ILE  22          HG21      ILE  22   3.139   7.357   0.802
  185   2HG2  ILE  22          HG22      ILE  22   1.386   7.157   0.562
  186   3HG2  ILE  22          HG23      ILE  22   2.417   5.756   0.899
  187   1HD1  ILE  22          HD11      ILE  22  -0.525   5.185  -2.081
  188   2HD1  ILE  22          HD12      ILE  22  -0.175   6.640  -1.117
  189   3HD1  ILE  22          HD13      ILE  22   0.187   6.607  -2.856
  190    H    GLN  23           H        GLN  23   4.970   8.120  -2.665
  191    HA   GLN  23           HA       GLN  23   5.973   9.955  -0.692
  192   1HB   GLN  23          HB2       GLN  23   6.931   8.806  -3.320
  193   2HB   GLN  23          HB3       GLN  23   7.882  10.053  -2.478
  194   1HG   GLN  23          HG2       GLN  23   7.877   8.657  -0.413
  195   2HG   GLN  23          HG3       GLN  23   6.983   7.402  -1.272
  196   1HE2  GLN  23          HE21      GLN  23   8.597   5.857  -0.921
  197   2HE2  GLN  23          HE22      GLN  23  10.204   5.961  -1.624
  198    H    GLN  24           H        GLN  24   3.750  10.703  -3.017
  199    HA   GLN  24           HA       GLN  24   4.534  13.606  -3.011
  200   1HB   GLN  24          HB2       GLN  24   3.079  12.138  -5.249
  201   2HB   GLN  24          HB3       GLN  24   3.554  13.842  -5.226
  202   1HG   GLN  24          HG2       GLN  24   5.934  13.168  -5.221
  203   2HG   GLN  24          HG3       GLN  24   5.436  11.465  -5.157
  204   1HE2  GLN  24          HE21      GLN  24   5.172  10.402  -7.075
  205   2HE2  GLN  24          HE22      GLN  24   5.064  11.195  -8.651
  206    H    ASN  25           H        ASN  25   1.965  11.218  -3.115
  207    HA   ASN  25           HA       ASN  25   0.146  13.029  -1.591
  208   1HB   ASN  25          HB2       ASN  25  -0.417  11.478  -4.105
  209   2HB   ASN  25          HB3       ASN  25  -1.689  11.632  -2.887
  210   1HD2  ASN  25          HD21      ASN  25  -2.130  13.838  -2.020
  211   2HD2  ASN  25          HD22      ASN  25  -2.095  15.145  -3.204
  212    HA   PRO  26           HA       PRO  26   0.725   9.193   0.914
  213   1HB   PRO  26          HB2       PRO  26   0.760  10.446   3.357
  214   2HB   PRO  26          HB3       PRO  26   2.211  10.237   2.326
  215   1HG   PRO  26          HG2       PRO  26   0.397  12.657   2.511
  216   2HG   PRO  26          HG3       PRO  26   2.191  12.609   2.618
  217   1HD   PRO  26          HD2       PRO  26   0.906  13.229   0.339
  218   2HD   PRO  26          HD3       PRO  26   2.378  12.207   0.285
  219    H    SER  27           H        SER  27  -1.548  11.859   0.851
  220    HA   SER  27           HA       SER  27  -3.726  10.818   2.340
  221   1HB   SER  27          HB2       SER  27  -5.074  12.263   0.791
  222   2HB   SER  27          HB3       SER  27  -3.735  13.086   1.599
  223    HG   SER  27           HG       SER  27  -3.964  13.480  -0.705
  224    H    LEU  28           H        LEU  28  -2.387   9.643  -0.661
  225    HA   LEU  28           HA       LEU  28  -4.825   8.029  -1.218
  226   1HB   LEU  28          HB2       LEU  28  -2.369   8.555  -2.923
  227   2HB   LEU  28          HB3       LEU  28  -3.757   7.572  -3.386
  228    HG   LEU  28           HG       LEU  28  -3.733  10.578  -2.938
  229   1HD1  LEU  28          HD11      LEU  28  -2.820   9.714  -5.083
  230   2HD1  LEU  28          HD12      LEU  28  -4.337   8.825  -5.353
  231   3HD1  LEU  28          HD13      LEU  28  -4.335  10.605  -5.325
  232   1HD2  LEU  28          HD21      LEU  28  -6.103   8.761  -3.562
  233   2HD2  LEU  28          HD22      LEU  28  -5.896   9.781  -2.115
  234   3HD2  LEU  28          HD23      LEU  28  -6.104  10.535  -3.694
  235    H    LEU  29           H        LEU  29  -2.239   7.548   0.748
  236    HA   LEU  29           HA       LEU  29  -1.501   4.853   0.145
  237   1HB   LEU  29          HB2       LEU  29  -0.302   6.177   1.748
  238   2HB   LEU  29          HB3       LEU  29  -1.686   6.378   2.774
  239    HG   LEU  29           HG       LEU  29  -1.715   3.995   3.352
  240   1HD1  LEU  29          HD11      LEU  29  -0.862   2.946   1.313
  241   2HD1  LEU  29          HD12      LEU  29   0.691   3.791   1.495
  242   3HD1  LEU  29          HD13      LEU  29   0.197   2.534   2.662
  243   1HD2  LEU  29          HD21      LEU  29  -0.310   5.556   4.658
  244   2HD2  LEU  29          HD22      LEU  29   0.365   3.920   4.627
  245   3HD2  LEU  29          HD23      LEU  29   1.075   5.190   3.604
  246    HA   PRO  30           HA       PRO  30  -5.576   3.555   2.645
  247   1HB   PRO  30          HB2       PRO  30  -7.214   5.928   1.740
  248   2HB   PRO  30          HB3       PRO  30  -7.340   4.997   3.243
  249   1HG   PRO  30          HG2       PRO  30  -6.158   7.494   2.897
  250   2HG   PRO  30          HG3       PRO  30  -5.772   6.382   4.260
  251   1HD   PRO  30          HD2       PRO  30  -4.102   7.163   1.990
  252   2HD   PRO  30          HD3       PRO  30  -3.655   6.214   3.425
  253    H    ALA  31           H        ALA  31  -5.804   5.639  -0.181
  254    HA   ALA  31           HA       ALA  31  -7.661   4.039  -1.659
  255   1HB   ALA  31          HB1       ALA  31  -5.757   6.201  -2.645
  256   2HB   ALA  31          HB2       ALA  31  -7.294   5.692  -3.375
  257   3HB   ALA  31          HB3       ALA  31  -7.282   6.511  -1.791
  258    H    LEU  32           H        LEU  32  -4.267   3.535  -1.158
  259    HA   LEU  32           HA       LEU  32  -3.947   1.952  -3.661
  260   1HB   LEU  32          HB2       LEU  32  -2.150   3.499  -3.106
  261   2HB   LEU  32          HB3       LEU  32  -2.062   2.836  -1.462
  262    HG   LEU  32           HG       LEU  32  -1.211   0.720  -2.288
  263   1HD1  LEU  32          HD11      LEU  32  -0.599   0.405  -4.658
  264   2HD1  LEU  32          HD12      LEU  32  -2.336   0.591  -4.486
  265   3HD1  LEU  32          HD13      LEU  32  -1.366   1.964  -5.070
  266   1HD2  LEU  32          HD21      LEU  32   0.312   2.595  -1.774
  267   2HD2  LEU  32          HD22      LEU  32   0.986   1.518  -3.011
  268   3HD2  LEU  32          HD23      LEU  32   0.290   3.081  -3.484
  269    H    LEU  33           H        LEU  33  -3.920   1.674  -0.092
  270    HA   LEU  33           HA       LEU  33  -3.698  -1.173   0.096
  271   1HB   LEU  33          HB2       LEU  33  -5.112   0.917   1.790
  272   2HB   LEU  33          HB3       LEU  33  -4.900  -0.763   2.289
  273    HG   LEU  33           HG       LEU  33  -2.450   0.848   1.497
  274   1HD1  LEU  33          HD11      LEU  33  -2.220   1.584   3.829
  275   2HD1  LEU  33          HD12      LEU  33  -3.633   2.285   3.022
  276   3HD1  LEU  33          HD13      LEU  33  -3.853   0.955   4.189
  277   1HD2  LEU  33          HD21      LEU  33  -2.917  -1.369   3.535
  278   2HD2  LEU  33          HD22      LEU  33  -2.217  -1.578   1.917
  279   3HD2  LEU  33          HD23      LEU  33  -1.358  -0.614   3.127
  280    H    GLN  34           H        GLN  34  -6.625   0.926  -0.249
  281    HA   GLN  34           HA       GLN  34  -8.459  -1.264  -0.571
  282   1HB   GLN  34          HB2       GLN  34  -8.556   1.664  -1.355
  283   2HB   GLN  34          HB3       GLN  34  -9.899   0.557  -1.653
  284   1HG   GLN  34          HG2       GLN  34 -10.177   0.072   0.692
  285   2HG   GLN  34          HG3       GLN  34  -8.702   0.938   1.121
  286   1HE2  GLN  34          HE21      GLN  34  -8.653   3.277   0.807
  287   2HE2  GLN  34          HE22      GLN  34 -10.168   4.190   0.898
  288    H    GLN  35           H        GLN  35  -6.109   0.026  -2.850
  289    HA   GLN  35           HA       GLN  35  -7.513  -1.113  -5.185
  290   1HB   GLN  35          HB2       GLN  35  -6.362   0.936  -5.575
  291   2HB   GLN  35          HB3       GLN  35  -4.885   0.364  -4.782
  292   1HG   GLN  35          HG2       GLN  35  -4.461  -1.230  -6.506
  293   2HG   GLN  35          HG3       GLN  35  -5.980  -0.840  -7.342
  294   1HE2  GLN  35          HE21      GLN  35  -3.396  -0.777  -8.532
  295   2HE2  GLN  35          HE22      GLN  35  -3.038   0.900  -8.971
  296    H    ILE  36           H        ILE  36  -4.652  -1.868  -3.144
  297    HA   ILE  36           HA       ILE  36  -4.027  -4.381  -4.362
  298    HB   ILE  36           HB       ILE  36  -3.698  -3.500  -1.499
  299   1HG1  ILE  36          HG12      ILE  36  -1.504  -3.658  -3.606
  300   2HG1  ILE  36          HG13      ILE  36  -2.485  -2.204  -3.458
  301   1HG2  ILE  36          HG21      ILE  36  -1.935  -5.368  -1.474
  302   2HG2  ILE  36          HG22      ILE  36  -3.573  -5.977  -1.651
  303   3HG2  ILE  36          HG23      ILE  36  -2.530  -5.884  -3.065
  304   1HD1  ILE  36          HD11      ILE  36  -0.478  -1.917  -2.164
  305   2HD1  ILE  36          HD12      ILE  36  -1.876  -2.000  -1.069
  306   3HD1  ILE  36          HD13      ILE  36  -0.794  -3.403  -1.244
  307    H    GLY  37           H        GLY  37  -6.433  -3.500  -1.796
  308   1HA   GLY  37          HA2       GLY  37  -7.580  -6.030  -1.419
  309   2HA   GLY  37          HA3       GLY  37  -8.398  -4.485  -1.223
  310    H    ARG  38           H        ARG  38  -7.551  -4.512  -4.452
  311    HA   ARG  38           HA       ARG  38  -9.799  -6.257  -5.400
  312   1HB   ARG  38          HB2       ARG  38  -8.801  -3.632  -6.538
  313   2HB   ARG  38          HB3       ARG  38 -10.060  -4.645  -7.240
  314   1HG   ARG  38          HG2       ARG  38 -10.213  -3.379  -4.458
  315   2HG   ARG  38          HG3       ARG  38 -10.891  -2.710  -5.937
  316   1HD   ARG  38          HD2       ARG  38 -12.376  -4.654  -6.186
  317   2HD   ARG  38          HD3       ARG  38 -11.673  -5.428  -4.770
  318    HE   ARG  38           HE       ARG  38 -13.537  -3.138  -4.827
  319   1HH1  ARG  38          HH22      ARG  38 -11.481  -5.107  -2.736
  320   2HH1  ARG  38          HH21      ARG  38 -12.333  -4.593  -1.302
  321   1HH2  ARG  38          HH12      ARG  38 -14.532  -2.532  -2.951
  322   2HH2  ARG  38          HH11      ARG  38 -13.992  -3.170  -1.421
  323    H    GLU  39           H        GLU  39  -6.471  -5.078  -6.152
  324    HA   GLU  39           HA       GLU  39  -6.076  -6.860  -8.395
  325   1HB   GLU  39          HB2       GLU  39  -4.317  -5.168  -6.577
  326   2HB   GLU  39          HB3       GLU  39  -3.635  -6.273  -7.771
  327   1HG   GLU  39          HG2       GLU  39  -4.966  -5.108  -9.549
  328   2HG   GLU  39          HG3       GLU  39  -5.495  -3.935  -8.339
  329    H    ASN  40           H        ASN  40  -5.429  -7.090  -4.906
  330    HA   ASN  40           HA       ASN  40  -5.166  -9.979  -4.976
  331   1HB   ASN  40          HB2       ASN  40  -2.852  -9.005  -5.625
  332   2HB   ASN  40          HB3       ASN  40  -2.753  -8.399  -3.997
  333   1HD2  ASN  40          HD21      ASN  40  -1.141 -10.508  -5.400
  334   2HD2  ASN  40          HD22      ASN  40  -1.343 -11.955  -4.411
  335    HA   PRO  41           HA       PRO  41  -7.006  -8.033  -1.136
  336   1HB   PRO  41          HB2       PRO  41  -9.013  -9.908  -0.748
  337   2HB   PRO  41          HB3       PRO  41  -9.147  -8.431  -1.756
  338   1HG   PRO  41          HG2       PRO  41  -8.441 -11.220  -2.666
  339   2HG   PRO  41          HG3       PRO  41  -9.678 -10.112  -3.354
  340   1HD   PRO  41          HD2       PRO  41  -7.259 -10.289  -4.490
  341   2HD   PRO  41          HD3       PRO  41  -7.984  -8.672  -4.247
  342    H    GLN  42           H        GLN  42  -5.696 -11.220  -1.787
  343    HA   GLN  42           HA       GLN  42  -5.443 -12.035   1.006
  344   1HB   GLN  42          HB2       GLN  42  -3.819 -12.943  -1.399
  345   2HB   GLN  42          HB3       GLN  42  -4.006 -13.775   0.154
  346   1HG   GLN  42          HG2       GLN  42  -6.488 -13.909  -0.322
  347   2HG   GLN  42          HG3       GLN  42  -6.164 -13.288  -1.942
  348   1HE2  GLN  42          HE21      GLN  42  -7.311 -15.945  -1.163
  349   2HE2  GLN  42          HE22      GLN  42  -6.211 -17.124  -1.869
  350    H    LEU  43           H        LEU  43  -3.195 -10.594  -1.432
  351    HA   LEU  43           HA       LEU  43  -0.997 -10.162   0.302
  352   1HB   LEU  43          HB2       LEU  43  -1.003  -9.890  -2.205
  353   2HB   LEU  43          HB3       LEU  43  -1.987  -8.429  -1.996
  354    HG   LEU  43           HG       LEU  43  -0.223  -7.263  -0.909
  355   1HD1  LEU  43          HD11      LEU  43   0.874  -9.054   0.373
  356   2HD1  LEU  43          HD12      LEU  43   1.425  -9.818  -1.145
  357   3HD1  LEU  43          HD13      LEU  43   2.027  -8.210  -0.649
  358   1HD2  LEU  43          HD21      LEU  43   0.857  -8.710  -3.361
  359   2HD2  LEU  43          HD22      LEU  43  -0.240  -7.310  -3.379
  360   3HD2  LEU  43          HD23      LEU  43   1.398  -7.136  -2.734
  361    H    LEU  44           H        LEU  44  -3.979  -8.370  -0.165
  362    HA   LEU  44           HA       LEU  44  -3.187  -5.960   1.175
  363   1HB   LEU  44          HB2       LEU  44  -5.223  -6.391  -0.312
  364   2HB   LEU  44          HB3       LEU  44  -6.006  -7.136   1.037
  365    HG   LEU  44           HG       LEU  44  -6.343  -4.593   0.365
  366   1HD1  LEU  44          HD11      LEU  44  -7.642  -5.768   2.005
  367   2HD1  LEU  44          HD12      LEU  44  -6.383  -5.489   3.246
  368   3HD1  LEU  44          HD13      LEU  44  -7.263  -4.120   2.510
  369   1HD2  LEU  44          HD21      LEU  44  -4.028  -3.825   0.837
  370   2HD2  LEU  44          HD22      LEU  44  -5.245  -3.013   1.836
  371   3HD2  LEU  44          HD23      LEU  44  -4.239  -4.270   2.552
  372    H    GLN  45           H        GLN  45  -5.158  -8.637   2.338
  373    HA   GLN  45           HA       GLN  45  -5.142  -8.065   5.118
  374   1HB   GLN  45          HB2       GLN  45  -5.174 -10.755   3.694
  375   2HB   GLN  45          HB3       GLN  45  -5.416 -10.569   5.426
  376   1HG   GLN  45          HG2       GLN  45  -7.168  -9.331   3.262
  377   2HG   GLN  45          HG3       GLN  45  -7.559 -10.768   4.209
  378   1HE2  GLN  45          HE21      GLN  45  -8.844  -7.955   3.974
  379   2HE2  GLN  45          HE22      GLN  45  -9.009  -7.476   5.660
  380    H    GLN  46           H        GLN  46  -2.533  -9.770   3.258
  381    HA   GLN  46           HA       GLN  46  -0.940 -10.304   5.594
  382   1HB   GLN  46          HB2       GLN  46  -0.633 -10.372   2.585
  383   2HB   GLN  46          HB3       GLN  46   0.809 -10.394   3.584
  384   1HG   GLN  46          HG2       GLN  46   0.172 -12.634   3.054
  385   2HG   GLN  46          HG3       GLN  46   0.026 -12.351   4.798
  386   1HE2  GLN  46          HE21      GLN  46  -1.509 -13.776   2.126
  387   2HE2  GLN  46          HE22      GLN  46  -3.097 -13.937   2.883
  388    H    ILE  47           H        ILE  47  -0.866  -7.587   3.243
  389    HA   ILE  47           HA       ILE  47   1.298  -6.149   4.462
  390    HB   ILE  47           HB       ILE  47  -1.020  -5.423   2.667
  391   1HG1  ILE  47          HG12      ILE  47   2.018  -5.338   2.335
  392   2HG1  ILE  47          HG13      ILE  47   1.009  -6.709   1.866
  393   1HG2  ILE  47          HG21      ILE  47  -0.753  -3.413   4.028
  394   2HG2  ILE  47          HG22      ILE  47   1.013  -3.474   3.827
  395   3HG2  ILE  47          HG23      ILE  47  -0.056  -3.125   2.448
  396   1HD1  ILE  47          HD11      ILE  47   1.470  -5.450  -0.103
  397   2HD1  ILE  47          HD12      ILE  47  -0.246  -5.210   0.305
  398   3HD1  ILE  47          HD13      ILE  47   0.949  -3.932   0.646
  399    H    SER  48           H        SER  48  -2.213  -6.176   5.108
  400    HA   SER  48           HA       SER  48  -2.236  -4.094   7.067
  401   1HB   SER  48          HB2       SER  48  -4.089  -6.498   6.840
  402   2HB   SER  48          HB3       SER  48  -4.387  -5.037   7.793
  403    HG   SER  48           HG       SER  48  -4.101  -5.221   4.979
  404    H    GLN  49           H        GLN  49  -1.597  -7.562   7.398
  405    HA   GLN  49           HA       GLN  49  -1.343  -7.630  10.271
  406   1HB   GLN  49          HB2       GLN  49  -0.591  -9.414   7.946
  407   2HB   GLN  49          HB3       GLN  49  -0.027  -9.818   9.564
  408   1HG   GLN  49          HG2       GLN  49  -2.268  -9.984  10.426
  409   2HG   GLN  49          HG3       GLN  49  -2.961  -9.281   8.964
  410   1HE2  GLN  49          HE21      GLN  49  -2.998 -10.520   7.022
  411   2HE2  GLN  49          HE22      GLN  49  -2.815 -12.270   7.034
  412    H    HIS  50           H        HIS  50   0.751  -6.216   7.954
  413    HA   HIS  50           HA       HIS  50   3.031  -6.132   9.874
  414   1HB   HIS  50          HB2       HIS  50   3.193  -6.834   6.922
  415   2HB   HIS  50          HB3       HIS  50   4.567  -6.679   8.026
  416    HD1  HIS  50           HD1      HIS  50   1.963  -9.153   6.914
  417    HD2  HIS  50           HD2      HIS  50   4.777  -8.654   9.986
  418    HE1  HIS  50           HE1      HIS  50   2.263 -11.452   7.986
  419    H    GLN  51           H        GLN  51   0.986  -4.107   9.076
  420    HA   GLN  51           HA       GLN  51   1.643  -2.585   6.937
  421   1HB   GLN  51          HB2       GLN  51  -0.432  -2.606   8.429
  422   2HB   GLN  51          HB3       GLN  51   0.403  -1.418   9.449
  423   1HG   GLN  51          HG2       GLN  51   0.583   0.091   7.455
  424   2HG   GLN  51          HG3       GLN  51  -0.208  -1.151   6.475
  425   1HE2  GLN  51          HE21      GLN  51  -2.344  -0.561   6.080
  426   2HE2  GLN  51          HE22      GLN  51  -3.378   0.222   7.274
  427    H    GLU  52           H        GLU  52   3.181  -2.161  10.124
  428    HA   GLU  52           HA       GLU  52   4.388   0.398   9.591
  429   1HB   GLU  52          HB2       GLU  52   5.269  -1.875  11.412
  430   2HB   GLU  52          HB3       GLU  52   5.989  -0.261  11.386
  431   1HG   GLU  52          HG2       GLU  52   3.765   0.727  11.939
  432   2HG   GLU  52          HG3       GLU  52   3.087  -0.892  12.062
  433    H    HIS  53           H        HIS  53   5.472  -2.918   8.805
  434    HA   HIS  53           HA       HIS  53   8.070  -2.126   7.764
  435   1HB   HIS  53          HB2       HIS  53   7.630  -4.393   8.548
  436   2HB   HIS  53          HB3       HIS  53   6.353  -4.604   7.361
  437    HD1  HIS  53           HD1      HIS  53   8.918  -3.103   5.310
  438    HD2  HIS  53           HD2      HIS  53   8.269  -6.820   7.138
  439    HE1  HIS  53           HE1      HIS  53  10.314  -4.787   4.008
  440    H    PHE  54           H        PHE  54   4.808  -2.620   6.319
  441    HA   PHE  54           HA       PHE  54   5.627  -2.006   3.611
  442   1HB   PHE  54          HB2       PHE  54   3.452  -3.126   4.336
  443   2HB   PHE  54          HB3       PHE  54   2.896  -1.546   4.881
  444    HD1  PHE  54           HD1      PHE  54   1.455  -0.448   3.376
  445    HD2  PHE  54           HD2      PHE  54   4.501  -3.066   1.808
  446    HE1  PHE  54           HE1      PHE  54   0.628  -0.041   1.072
  447    HE2  PHE  54           HE2      PHE  54   3.699  -2.615  -0.497
  448    HZ   PHE  54           HZ       PHE  54   1.762  -1.103  -0.868
  449    H    ILE  55           H        ILE  55   4.325   0.157   6.158
  450    HA   ILE  55           HA       ILE  55   4.517   2.555   4.646
  451    HB   ILE  55           HB       ILE  55   4.414   1.947   7.564
  452   1HG1  ILE  55          HG12      ILE  55   2.545   3.325   5.572
  453   2HG1  ILE  55          HG13      ILE  55   2.453   1.616   6.010
  454   1HG2  ILE  55          HG21      ILE  55   4.555   4.728   6.296
  455   2HG2  ILE  55          HG22      ILE  55   4.130   4.393   7.990
  456   3HG2  ILE  55          HG23      ILE  55   5.747   4.034   7.417
  457   1HD1  ILE  55          HD11      ILE  55   1.937   3.976   7.832
  458   2HD1  ILE  55          HD12      ILE  55   0.781   2.771   7.235
  459   3HD1  ILE  55          HD13      ILE  55   2.050   2.279   8.382
  460    H    GLN  56           H        GLN  56   7.109   0.912   6.600
  461    HA   GLN  56           HA       GLN  56   9.060   2.957   6.200
  462   1HB   GLN  56          HB2       GLN  56   9.101   1.282   7.988
  463   2HB   GLN  56          HB3       GLN  56   9.178  -0.035   6.809
  464   1HG   GLN  56          HG2       GLN  56  11.348   0.726   6.042
  465   2HG   GLN  56          HG3       GLN  56  11.270   2.133   7.125
  466   1HE2  GLN  56          HE21      GLN  56  12.694   1.789   8.856
  467   2HE2  GLN  56          HE22      GLN  56  12.878   0.243   9.674
  468    H    MET  57           H        MET  57   8.336  -0.088   4.283
  469    HA   MET  57           HA       MET  57  10.438   0.253   2.415
  470   1HB   MET  57          HB2       MET  57   9.432  -1.850   3.093
  471   2HB   MET  57          HB3       MET  57   7.818  -1.304   2.597
  472   1HG   MET  57          HG2       MET  57   8.337  -1.306   0.383
  473   2HG   MET  57          HG3       MET  57  10.096  -1.398   0.663
  474   1HE   MET  57          HE1       MET  57   7.271  -3.729   2.406
  475   2HE   MET  57          HE2       MET  57   6.688  -3.319   0.773
  476   3HE   MET  57          HE3       MET  57   7.176  -4.984   1.150
  477    H    LEU  58           H        LEU  58   7.056   1.285   2.505
  478    HA   LEU  58           HA       LEU  58   6.727   2.550  -0.011
  479   1HB   LEU  58          HB2       LEU  58   5.607   2.637   2.770
  480   2HB   LEU  58          HB3       LEU  58   5.270   4.059   1.785
  481    HG   LEU  58           HG       LEU  58   4.608   1.215   0.913
  482   1HD1  LEU  58          HD11      LEU  58   2.274   1.885   1.563
  483   2HD1  LEU  58          HD12      LEU  58   3.358   1.717   2.954
  484   3HD1  LEU  58          HD13      LEU  58   2.942   3.334   2.355
  485   1HD2  LEU  58          HD21      LEU  58   3.136   2.422  -0.672
  486   2HD2  LEU  58          HD22      LEU  58   3.691   3.979   0.012
  487   3HD2  LEU  58          HD23      LEU  58   4.828   2.951  -0.864
  488    H    ASN  59           H        ASN  59   8.490   3.549   2.784
  489    HA   ASN  59           HA       ASN  59   8.940   6.309   1.784
  490   1HB   ASN  59          HB2       ASN  59   9.051   4.910   4.449
  491   2HB   ASN  59          HB3       ASN  59  10.115   6.281   4.221
  492   1HD2  ASN  59          HD21      ASN  59   6.807   5.307   4.643
  493   2HD2  ASN  59          HD22      ASN  59   6.145   6.946   4.683
  494    H    GLU  60           H        GLU  60  10.532   3.394   1.319
  495    HA   GLU  60           HA       GLU  60  13.282   4.244   1.514
  496   1HB   GLU  60          HB2       GLU  60  11.873   2.065  -0.022
  497   2HB   GLU  60          HB3       GLU  60  13.603   2.356  -0.199
  498   1HG   GLU  60          HG2       GLU  60  12.260   1.831   2.483
  499   2HG   GLU  60          HG3       GLU  60  12.994   0.593   1.468
  500    HA   PRO  61           HA       PRO  61  13.522   6.988  -1.906
  501   1HB   PRO  61          HB2       PRO  61  16.163   6.922  -2.611
  502   2HB   PRO  61          HB3       PRO  61  15.551   7.616  -1.077
  503   1HG   PRO  61          HG2       PRO  61  16.703   4.862  -1.566
  504   2HG   PRO  61          HG3       PRO  61  17.105   6.017  -0.251
  505   1HD   PRO  61          HD2       PRO  61  15.357   3.947   0.074
  506   2HD   PRO  61          HD3       PRO  61  15.118   5.513   0.910
  507    H    VAL  62           H        VAL  62  12.227   6.173  -3.540
  508    HA   VAL  62           HA       VAL  62  12.624   3.945  -5.160
  509    HB   VAL  62           HB       VAL  62  11.042   5.061  -6.719
  510   1HG1  VAL  62          HG11      VAL  62  10.272   5.226  -3.779
  511   2HG1  VAL  62          HG12      VAL  62   9.154   5.141  -5.151
  512   3HG1  VAL  62          HG13      VAL  62  10.223   3.775  -4.802
  513   1HG2  VAL  62          HG21      VAL  62  10.032   7.230  -6.111
  514   2HG2  VAL  62          HG22      VAL  62  11.199   7.436  -4.803
  515   3HG2  VAL  62          HG23      VAL  62  11.745   7.416  -6.496
  516    H    GLN  63           H        GLN  63  14.244   6.999  -5.452
  517    HA   GLN  63           HA       GLN  63  15.207   6.733  -8.154
  518   1HB   GLN  63          HB2       GLN  63  16.797   8.495  -7.477
  519   2HB   GLN  63          HB3       GLN  63  15.128   8.881  -7.078
  520   1HG   GLN  63          HG2       GLN  63  15.510   8.377  -4.706
  521   2HG   GLN  63          HG3       GLN  63  17.125   7.768  -5.058
  522   1HE2  GLN  63          HE21      GLN  63  18.538   9.252  -4.109
  523   2HE2  GLN  63          HE22      GLN  63  18.417  10.987  -4.349
  524    H    GLU  64           H        GLU  64  16.110   4.992  -5.329
  525    HA   GLU  64           HA       GLU  64  18.708   4.081  -6.541
  526   1HB   GLU  64          HB2       GLU  64  18.127   5.182  -3.774
  527   2HB   GLU  64          HB3       GLU  64  19.509   4.127  -4.077
  528   1HG   GLU  64          HG2       GLU  64  20.498   5.684  -5.621
  529   2HG   GLU  64          HG3       GLU  64  19.060   6.689  -5.650
  530    H    ALA  65           H        ALA  65  16.130   3.373  -4.177
  531    HA   ALA  65           HA       ALA  65  15.418   1.526  -3.143
  532   1HB   ALA  65          HB1       ALA  65  14.483   1.418  -5.421
  533   2HB   ALA  65          HB2       ALA  65  15.823   0.362  -5.918
  534   3HB   ALA  65          HB3       ALA  65  14.656  -0.189  -4.698
  535    H    GLY  66           H        GLY  66  18.460   1.705  -3.060
  536   1HA   GLY  66          HA2       GLY  66  19.243  -0.178  -1.330
  537   2HA   GLY  66          HA3       GLY  66  19.305  -1.122  -2.821
  538    H    GLY  67           H        GLY  67  20.218   1.364  -4.383
  539   1HA   GLY  67          HA2       GLY  67  22.736   2.254  -3.301
  540   2HA   GLY  67          HA3       GLY  67  22.980   0.884  -4.380
  541    H    GLN  68           H        GLN  68  24.302   2.791  -5.299
  542    HA   GLN  68           HA       GLN  68  23.047   4.968  -6.634
  543   1HB   GLN  68          HB2       GLN  68  25.762   3.667  -7.072
  544   2HB   GLN  68          HB3       GLN  68  25.264   5.214  -7.761
  545   1HG   GLN  68          HG2       GLN  68  24.888   6.113  -5.471
  546   2HG   GLN  68          HG3       GLN  68  25.516   4.616  -4.780
  547   1HE2  GLN  68          HE21      GLN  68  26.571   7.446  -4.591
  548   2HE2  GLN  68          HE22      GLN  68  28.226   7.314  -5.174
  549    H    GLY  69           H        GLY  69  23.130   1.685  -7.668
  550   1HA   GLY  69          HA2       GLY  69  22.047   0.740  -9.476
  551   2HA   GLY  69          HA3       GLY  69  21.688   2.347 -10.104
  552    H    GLY  70           H        GLY  70  25.049   1.877  -9.537
  553   1HA   GLY  70          HA2       GLY  70  25.888   0.493 -11.886
  554   2HA   GLY  70          HA3       GLY  70  25.863   2.225 -12.220
  555    H    GLY  71           H        GLY  71  28.224   1.242 -12.524
  556   1HA   GLY  71          HA2       GLY  71  29.974   2.528 -10.705
  557   2HA   GLY  71          HA3       GLY  71  29.941   0.812 -10.301
  558    H    GLY  72           H        GLY  72  32.307   1.474 -10.905
  559   1HA   GLY  72          HA2       GLY  72  33.095   0.062 -13.273
  560   2HA   GLY  72          HA3       GLY  72  33.234   1.798 -13.557
  Start of MODEL   14
    1   1H    GLY   1           H1       GLY   1  16.357 -11.134   6.341
    2   2H    GLY   1           H2       GLY   1  15.784 -10.746   4.852
    3   3H    GLY   1           H3       GLY   1  17.223 -11.517   4.998
    4   1HA   GLY   1          HA2       GLY   1  15.533 -13.056   4.262
    5   2HA   GLY   1          HA3       GLY   1  16.161 -13.488   5.864
    6    H    SER   2           H        SER   2  14.024 -14.679   5.798
    7    HA   SER   2           HA       SER   2  11.521 -13.536   5.659
    8   1HB   SER   2          HB2       SER   2  12.289 -15.932   7.355
    9   2HB   SER   2          HB3       SER   2  10.692 -15.577   6.675
   10    HG   SER   2           HG       SER   2  11.869 -17.054   5.381
   11    H    HIS   3           H        HIS   3  13.606 -13.184   8.408
   12    HA   HIS   3           HA       HIS   3  11.729 -12.571  10.465
   13   1HB   HIS   3          HB2       HIS   3  13.580 -11.280  11.441
   14   2HB   HIS   3          HB3       HIS   3  14.098 -12.869  10.901
   15    HD1  HIS   3           HD1      HIS   3  14.481  -9.154   9.907
   16    HD2  HIS   3           HD2      HIS   3  15.998 -12.974   9.029
   17    HE1  HIS   3           HE1      HIS   3  16.471  -8.793   8.368
   18    H    MET   4           H        MET   4  12.611 -10.757   7.594
   19    HA   MET   4           HA       MET   4  10.954  -8.423   8.386
   20   1HB   MET   4          HB2       MET   4  13.115  -7.962   7.338
   21   2HB   MET   4          HB3       MET   4  12.702  -8.970   5.955
   22   1HG   MET   4          HG2       MET   4  12.434  -6.593   5.450
   23   2HG   MET   4          HG3       MET   4  10.902  -7.458   5.340
   24   1HE   MET   4          HE1       MET   4  12.802  -5.996   8.591
   25   2HE   MET   4          HE2       MET   4  13.068  -4.844   7.261
   26   3HE   MET   4          HE3       MET   4  12.044  -4.393   8.640
   27    HA   PRO   5           HA       PRO   5   7.938 -11.284   6.801
   28   1HB   PRO   5          HB2       PRO   5   5.583  -9.993   7.357
   29   2HB   PRO   5          HB3       PRO   5   6.655 -10.695   8.606
   30   1HG   PRO   5          HG2       PRO   5   6.567  -7.820   7.640
   31   2HG   PRO   5          HG3       PRO   5   6.497  -8.417   9.334
   32   1HD   PRO   5          HD2       PRO   5   8.822  -7.579   8.249
   33   2HD   PRO   5          HD3       PRO   5   8.788  -9.032   9.296
   34    H    LEU   6           H        LEU   6   8.359  -8.270   5.239
   35    HA   LEU   6           HA       LEU   6   6.663  -9.088   2.903
   36   1HB   LEU   6          HB2       LEU   6   7.030  -6.342   4.162
   37   2HB   LEU   6          HB3       LEU   6   6.210  -6.629   2.629
   38    HG   LEU   6           HG       LEU   6   5.248  -7.684   5.318
   39   1HD1  LEU   6          HD11      LEU   6   5.111  -5.250   5.157
   40   2HD1  LEU   6          HD12      LEU   6   4.338  -5.370   3.559
   41   3HD1  LEU   6          HD13      LEU   6   3.489  -5.944   5.008
   42   1HD2  LEU   6          HD21      LEU   6   3.137  -8.138   4.088
   43   2HD2  LEU   6          HD22      LEU   6   3.925  -7.681   2.563
   44   3HD2  LEU   6          HD23      LEU   6   4.468  -9.117   3.461
   45    H    GLU   7           H        GLU   7   9.741  -9.120   3.586
   46    HA   GLU   7           HA       GLU   7  11.110  -7.079   2.317
   47   1HB   GLU   7          HB2       GLU   7  11.919  -9.144   3.749
   48   2HB   GLU   7          HB3       GLU   7  12.131  -9.918   2.183
   49   1HG   GLU   7          HG2       GLU   7  13.471  -7.637   1.651
   50   2HG   GLU   7          HG3       GLU   7  13.575  -7.560   3.398
   51    H    PHE   8           H        PHE   8   9.669  -9.843   0.622
   52    HA   PHE   8           HA       PHE   8  11.056  -9.666  -1.838
   53   1HB   PHE   8          HB2       PHE   8   9.600 -11.522  -1.186
   54   2HB   PHE   8          HB3       PHE   8   8.187 -10.468  -1.243
   55    HD1  PHE   8           HD1      PHE   8  10.877 -12.015  -3.336
   56    HD2  PHE   8           HD2      PHE   8   7.037 -10.054  -3.312
   57    HE1  PHE   8           HE1      PHE   8  10.593 -12.533  -5.748
   58    HE2  PHE   8           HE2      PHE   8   6.761 -10.572  -5.725
   59    HZ   PHE   8           HZ       PHE   8   8.540 -11.808  -6.945
   60    H    LEU   9           H        LEU   9   8.547  -7.500  -0.614
   61    HA   LEU   9           HA       LEU   9   7.597  -6.552  -3.169
   62   1HB   LEU   9          HB2       LEU   9   7.513  -5.202  -0.440
   63   2HB   LEU   9          HB3       LEU   9   6.550  -4.757  -1.840
   64    HG   LEU   9           HG       LEU   9   6.307  -7.348  -0.254
   65   1HD1  LEU   9          HD11      LEU   9   4.143  -6.428   0.423
   66   2HD1  LEU   9          HD12      LEU   9   5.437  -5.293   0.854
   67   3HD1  LEU   9          HD13      LEU   9   4.416  -4.975  -0.563
   68   1HD2  LEU   9          HD21      LEU   9   5.760  -7.756  -2.628
   69   2HD2  LEU   9          HD22      LEU   9   4.323  -7.814  -1.608
   70   3HD2  LEU   9          HD23      LEU   9   4.635  -6.372  -2.599
   71    H    ARG  10           H        ARG  10  10.439  -5.857  -1.433
   72    HA   ARG  10           HA       ARG  10  10.627  -3.190  -1.350
   73   1HB   ARG  10          HB2       ARG  10  12.830  -3.433  -0.678
   74   2HB   ARG  10          HB3       ARG  10  12.034  -4.914  -0.233
   75   1HG   ARG  10          HG2       ARG  10  14.129  -4.435  -2.353
   76   2HG   ARG  10          HG3       ARG  10  14.163  -5.497  -0.955
   77   1HD   ARG  10          HD2       ARG  10  12.326  -6.879  -2.249
   78   2HD   ARG  10          HD3       ARG  10  12.855  -5.951  -3.646
   79    HE   ARG  10           HE       ARG  10  14.854  -7.126  -3.705
   80   1HH1  ARG  10          HH22      ARG  10  13.252  -7.908  -0.694
   81   2HH1  ARG  10          HH21      ARG  10  14.499  -9.026  -0.207
   82   1HH2  ARG  10          HH12      ARG  10  16.353  -8.687  -3.081
   83   2HH2  ARG  10          HH11      ARG  10  16.114  -9.536  -1.570
   84    H    ASN  11           H        ASN  11  11.358  -4.810  -4.355
   85    HA   ASN  11           HA       ASN  11  11.884  -2.184  -5.659
   86   1HB   ASN  11          HB2       ASN  11  13.856  -4.476  -5.398
   87   2HB   ASN  11          HB3       ASN  11  13.928  -3.411  -6.796
   88   1HD2  ASN  11          HD21      ASN  11  15.706  -3.811  -4.267
   89   2HD2  ASN  11          HD22      ASN  11  15.996  -2.133  -3.814
   90    H    GLN  12           H        GLN  12   9.892  -4.757  -5.887
   91    HA   GLN  12           HA       GLN  12  10.351  -5.681  -8.568
   92   1HB   GLN  12          HB2       GLN  12   7.657  -5.596  -7.187
   93   2HB   GLN  12          HB3       GLN  12   8.158  -6.657  -8.487
   94   1HG   GLN  12          HG2       GLN  12   9.143  -6.728  -5.610
   95   2HG   GLN  12          HG3       GLN  12   8.064  -7.884  -6.386
   96   1HE2  GLN  12          HE21      GLN  12  10.589  -8.473  -5.056
   97   2HE2  GLN  12          HE22      GLN  12  11.628  -9.198  -6.284
   98    HA   PRO  13           HA       PRO  13   8.958  -2.193 -11.024
   99   1HB   PRO  13          HB2       PRO  13   7.732  -4.340 -12.768
  100   2HB   PRO  13          HB3       PRO  13   8.679  -2.900 -13.255
  101   1HG   PRO  13          HG2       PRO  13   9.873  -5.314 -13.155
  102   2HG   PRO  13          HG3       PRO  13  10.711  -3.883 -12.469
  103   1HD   PRO  13          HD2       PRO  13   9.155  -6.027 -11.018
  104   2HD   PRO  13          HD3       PRO  13  10.735  -5.288 -10.601
  105    H    GLN  14           H        GLN  14   6.548  -4.738 -10.321
  106    HA   GLN  14           HA       GLN  14   4.192  -3.203 -10.789
  107   1HB   GLN  14          HB2       GLN  14   4.306  -5.669 -10.629
  108   2HB   GLN  14          HB3       GLN  14   4.707  -5.552  -8.918
  109   1HG   GLN  14          HG2       GLN  14   2.370  -6.172  -9.238
  110   2HG   GLN  14          HG3       GLN  14   2.480  -4.626  -8.422
  111   1HE2  GLN  14          HE21      GLN  14   1.850  -2.682  -9.616
  112   2HE2  GLN  14          HE22      GLN  14   0.845  -2.832 -11.059
  113    H    PHE  15           H        PHE  15   6.421  -3.142  -8.087
  114    HA   PHE  15           HA       PHE  15   4.515  -1.611  -6.380
  115   1HB   PHE  15          HB2       PHE  15   6.971  -3.218  -5.638
  116   2HB   PHE  15          HB3       PHE  15   5.834  -2.472  -4.521
  117    HD1  PHE  15           HD1      PHE  15   6.819  -5.505  -5.121
  118    HD2  PHE  15           HD2      PHE  15   3.177  -3.287  -5.755
  119    HE1  PHE  15           HE1      PHE  15   5.533  -7.627  -5.208
  120    HE2  PHE  15           HE2      PHE  15   1.895  -5.400  -5.767
  121    HZ   PHE  15           HZ       PHE  15   3.068  -7.577  -5.519
  122    H    GLN  16           H        GLN  16   7.517  -1.223  -8.143
  123    HA   GLN  16           HA       GLN  16   8.443   1.179  -6.805
  124   1HB   GLN  16          HB2       GLN  16   8.565   0.268  -9.713
  125   2HB   GLN  16          HB3       GLN  16   9.312   1.746  -9.105
  126   1HG   GLN  16          HG2       GLN  16  10.741   0.418  -7.572
  127   2HG   GLN  16          HG3       GLN  16   9.999  -1.068  -8.167
  128   1HE2  GLN  16          HE21      GLN  16  11.859  -2.004  -9.181
  129   2HE2  GLN  16          HE22      GLN  16  12.663  -1.216 -10.530
  130    H    GLN  17           H        GLN  17   6.095   0.616  -9.437
  131    HA   GLN  17           HA       GLN  17   5.614   3.289 -10.114
  132   1HB   GLN  17          HB2       GLN  17   3.892   0.803 -10.402
  133   2HB   GLN  17          HB3       GLN  17   3.487   2.361 -11.141
  134   1HG   GLN  17          HG2       GLN  17   5.547   2.353 -12.449
  135   2HG   GLN  17          HG3       GLN  17   6.115   0.892 -11.644
  136   1HE2  GLN  17          HE21      GLN  17   5.335  -1.128 -12.332
  137   2HE2  GLN  17          HE22      GLN  17   4.249  -1.302 -13.717
  138    H    MET  18           H        MET  18   4.186   1.563  -7.410
  139    HA   MET  18           HA       MET  18   1.983   3.529  -7.108
  140   1HB   MET  18          HB2       MET  18   1.125   2.022  -5.489
  141   2HB   MET  18          HB3       MET  18   1.493   1.179  -6.993
  142   1HG   MET  18          HG2       MET  18   3.626   0.338  -5.948
  143   2HG   MET  18          HG3       MET  18   3.157   1.122  -4.434
  144   1HE   MET  18          HE1       MET  18   2.568  -2.310  -3.027
  145   2HE   MET  18          HE2       MET  18   3.963  -1.477  -3.750
  146   3HE   MET  18          HE3       MET  18   2.884  -0.604  -2.642
  147    H    ARG  19           H        ARG  19   4.898   2.544  -5.265
  148    HA   ARG  19           HA       ARG  19   4.517   4.347  -3.058
  149   1HB   ARG  19          HB2       ARG  19   7.073   3.207  -4.301
  150   2HB   ARG  19          HB3       ARG  19   6.936   3.933  -2.690
  151   1HG   ARG  19          HG2       ARG  19   5.221   2.220  -2.104
  152   2HG   ARG  19          HG3       ARG  19   5.464   1.409  -3.629
  153   1HD   ARG  19          HD2       ARG  19   7.797   1.926  -1.768
  154   2HD   ARG  19          HD3       ARG  19   6.797   0.459  -1.659
  155    HE   ARG  19           HE       ARG  19   7.437   0.488  -4.288
  156   1HH1  ARG  19          HH22      ARG  19   9.547   0.656  -1.457
  157   2HH1  ARG  19          HH21      ARG  19  10.792  -0.273  -2.273
  158   1HH2  ARG  19          HH12      ARG  19   9.148  -0.621  -5.222
  159   2HH2  ARG  19          HH11      ARG  19  10.595  -0.889  -4.254
  160    H    GLN  20           H        GLN  20   5.918   4.775  -6.211
  161    HA   GLN  20           HA       GLN  20   7.040   7.392  -6.058
  162   1HB   GLN  20          HB2       GLN  20   5.543   5.885  -8.231
  163   2HB   GLN  20          HB3       GLN  20   6.163   7.508  -8.497
  164   1HG   GLN  20          HG2       GLN  20   8.444   6.830  -8.156
  165   2HG   GLN  20          HG3       GLN  20   7.967   5.243  -7.561
  166   1HE2  GLN  20          HE21      GLN  20   9.586   4.563  -9.294
  167   2HE2  GLN  20          HE22      GLN  20   8.950   4.379 -10.928
  168    H    ILE  21           H        ILE  21   3.648   6.369  -6.170
  169    HA   ILE  21           HA       ILE  21   2.610   9.006  -6.736
  170    HB   ILE  21           HB       ILE  21   1.045   6.606  -5.685
  171   1HG1  ILE  21          HG12      ILE  21   2.038   7.116  -8.506
  172   2HG1  ILE  21          HG13      ILE  21   2.390   5.745  -7.470
  173   1HG2  ILE  21          HG21      ILE  21   0.283   8.893  -7.549
  174   2HG2  ILE  21          HG22      ILE  21  -0.804   7.641  -6.899
  175   3HG2  ILE  21          HG23      ILE  21  -0.093   8.831  -5.813
  176   1HD1  ILE  21          HD11      ILE  21   0.038   5.006  -7.536
  177   2HD1  ILE  21          HD12      ILE  21  -0.301   6.292  -8.733
  178   3HD1  ILE  21          HD13      ILE  21   0.850   4.992  -9.107
  179    H    ILE  22           H        ILE  22   2.917   6.871  -3.919
  180    HA   ILE  22           HA       ILE  22   1.407   8.537  -2.087
  181    HB   ILE  22           HB       ILE  22   3.357   6.292  -1.446
  182   1HG1  ILE  22          HG12      ILE  22   1.801   5.204  -2.818
  183   2HG1  ILE  22          HG13      ILE  22   1.194   4.922  -1.202
  184   1HG2  ILE  22          HG21      ILE  22   2.773   7.643   0.539
  185   2HG2  ILE  22          HG22      ILE  22   1.042   7.420   0.183
  186   3HG2  ILE  22          HG23      ILE  22   2.061   6.038   0.624
  187   1HD1  ILE  22          HD11      ILE  22  -0.699   5.416  -2.514
  188   2HD1  ILE  22          HD12      ILE  22  -0.398   6.898  -1.577
  189   3HD1  ILE  22          HD13      ILE  22   0.068   6.810  -3.290
  190    H    GLN  23           H        GLN  23   4.837   8.218  -2.836
  191    HA   GLN  23           HA       GLN  23   5.793  10.048  -0.825
  192   1HB   GLN  23          HB2       GLN  23   6.907   8.813  -3.352
  193   2HB   GLN  23          HB3       GLN  23   7.858   9.957  -2.374
  194   1HG   GLN  23          HG2       GLN  23   7.519   8.529  -0.363
  195   2HG   GLN  23          HG3       GLN  23   6.606   7.374  -1.331
  196   1HE2  GLN  23          HE21      GLN  23   8.028   5.654  -0.841
  197   2HE2  GLN  23          HE22      GLN  23   9.704   5.647  -1.368
  198    H    GLN  24           H        GLN  24   3.760  10.814  -3.255
  199    HA   GLN  24           HA       GLN  24   4.624  13.690  -3.228
  200   1HB   GLN  24          HB2       GLN  24   3.081  12.320  -5.466
  201   2HB   GLN  24          HB3       GLN  24   3.646  13.995  -5.422
  202   1HG   GLN  24          HG2       GLN  24   5.994  13.166  -5.429
  203   2HG   GLN  24          HG3       GLN  24   5.372  11.504  -5.455
  204   1HE2  GLN  24          HE21      GLN  24   5.155  10.577  -7.454
  205   2HE2  GLN  24          HE22      GLN  24   5.057  11.472  -8.971
  206    H    ASN  25           H        ASN  25   1.965  11.380  -3.315
  207    HA   ASN  25           HA       ASN  25   0.220  13.273  -1.796
  208   1HB   ASN  25          HB2       ASN  25  -0.377  11.717  -4.289
  209   2HB   ASN  25          HB3       ASN  25  -1.643  11.840  -3.064
  210   1HD2  ASN  25          HD21      ASN  25  -2.141  14.022  -2.183
  211   2HD2  ASN  25          HD22      ASN  25  -2.120  15.341  -3.353
  212    HA   PRO  26           HA       PRO  26   0.816   9.487   0.769
  213   1HB   PRO  26          HB2       PRO  26   0.842  10.743   3.207
  214   2HB   PRO  26          HB3       PRO  26   2.283  10.577   2.154
  215   1HG   PRO  26          HG2       PRO  26   0.402  12.942   2.360
  216   2HG   PRO  26          HG3       PRO  26   2.198  12.948   2.440
  217   1HD   PRO  26          HD2       PRO  26   0.866  13.520   0.176
  218   2HD   PRO  26          HD3       PRO  26   2.363  12.534   0.106
  219    H    SER  27           H        SER  27  -1.555  12.055   0.721
  220    HA   SER  27           HA       SER  27  -3.666  10.972   2.272
  221   1HB   SER  27          HB2       SER  27  -5.090  12.333   0.708
  222   2HB   SER  27          HB3       SER  27  -3.769  13.220   1.480
  223    HG   SER  27           HG       SER  27  -4.028  13.563  -0.826
  224    H    LEU  28           H        LEU  28  -2.349   9.791  -0.742
  225    HA   LEU  28           HA       LEU  28  -4.756   8.129  -1.266
  226   1HB   LEU  28          HB2       LEU  28  -2.259   8.594  -2.932
  227   2HB   LEU  28          HB3       LEU  28  -3.648   7.614  -3.400
  228    HG   LEU  28           HG       LEU  28  -3.598  10.629  -3.025
  229   1HD1  LEU  28          HD11      LEU  28  -2.653   9.706  -5.129
  230   2HD1  LEU  28          HD12      LEU  28  -4.172   8.825  -5.409
  231   3HD1  LEU  28          HD13      LEU  28  -4.153  10.604  -5.423
  232   1HD2  LEU  28          HD21      LEU  28  -5.955  10.596  -3.825
  233   2HD2  LEU  28          HD22      LEU  28  -5.977   8.825  -3.651
  234   3HD2  LEU  28          HD23      LEU  28  -5.785   9.877  -2.225
  235    H    LEU  29           H        LEU  29  -2.166   7.689   0.743
  236    HA   LEU  29           HA       LEU  29  -1.365   5.026   0.170
  237   1HB   LEU  29          HB2       LEU  29  -0.275   6.424   1.820
  238   2HB   LEU  29          HB3       LEU  29  -1.682   6.480   2.831
  239    HG   LEU  29           HG       LEU  29  -1.534   4.076   3.313
  240   1HD1  LEU  29          HD11      LEU  29   0.517   2.809   2.626
  241   2HD1  LEU  29          HD12      LEU  29  -0.550   3.181   1.267
  242   3HD1  LEU  29          HD13      LEU  29   0.923   4.142   1.516
  243   1HD2  LEU  29          HD21      LEU  29  -0.311   5.678   4.728
  244   2HD2  LEU  29          HD22      LEU  29   0.540   4.129   4.631
  245   3HD2  LEU  29          HD23      LEU  29   1.121   5.521   3.688
  246    HA   PRO  30           HA       PRO  30  -5.445   3.552   2.580
  247   1HB   PRO  30          HB2       PRO  30  -7.163   5.867   1.685
  248   2HB   PRO  30          HB3       PRO  30  -7.262   4.913   3.177
  249   1HG   PRO  30          HG2       PRO  30  -6.184   7.461   2.881
  250   2HG   PRO  30          HG3       PRO  30  -5.758   6.340   4.223
  251   1HD   PRO  30          HD2       PRO  30  -4.117   7.220   1.960
  252   2HD   PRO  30          HD3       PRO  30  -3.636   6.302   3.404
  253    H    ALA  31           H        ALA  31  -5.773   5.697  -0.205
  254    HA   ALA  31           HA       ALA  31  -7.532   4.072  -1.731
  255   1HB   ALA  31          HB1       ALA  31  -5.657   6.275  -2.678
  256   2HB   ALA  31          HB2       ALA  31  -7.178   5.750  -3.425
  257   3HB   ALA  31          HB3       ALA  31  -7.194   6.549  -1.832
  258    H    LEU  32           H        LEU  32  -4.125   3.613  -1.211
  259    HA   LEU  32           HA       LEU  32  -3.801   2.045  -3.717
  260   1HB   LEU  32          HB2       LEU  32  -2.020   3.600  -3.151
  261   2HB   LEU  32          HB3       LEU  32  -1.918   2.918  -1.515
  262    HG   LEU  32           HG       LEU  32  -1.040   0.826  -2.369
  263   1HD1  LEU  32          HD11      LEU  32  -0.482   0.538  -4.761
  264   2HD1  LEU  32          HD12      LEU  32  -2.212   0.688  -4.536
  265   3HD1  LEU  32          HD13      LEU  32  -1.290   2.086  -5.138
  266   1HD2  LEU  32          HD21      LEU  32   0.423   3.198  -3.600
  267   2HD2  LEU  32          HD22      LEU  32   0.471   2.732  -1.885
  268   3HD2  LEU  32          HD23      LEU  32   1.144   1.650  -3.109
  269    H    LEU  33           H        LEU  33  -3.716   1.733  -0.150
  270    HA   LEU  33           HA       LEU  33  -3.471  -1.108   0.028
  271   1HB   LEU  33          HB2       LEU  33  -4.926   0.939   1.741
  272   2HB   LEU  33          HB3       LEU  33  -4.656  -0.735   2.228
  273    HG   LEU  33           HG       LEU  33  -2.263   0.960   1.434
  274   1HD1  LEU  33          HD11      LEU  33  -3.661   1.016   4.129
  275   2HD1  LEU  33          HD12      LEU  33  -2.049   1.698   3.765
  276   3HD1  LEU  33          HD13      LEU  33  -3.486   2.356   2.968
  277   1HD2  LEU  33          HD21      LEU  33  -1.967  -1.460   1.849
  278   2HD2  LEU  33          HD22      LEU  33  -1.121  -0.473   3.051
  279   3HD2  LEU  33          HD23      LEU  33  -2.658  -1.268   3.474
  280    H    GLN  34           H        GLN  34  -6.395   0.971  -0.354
  281    HA   GLN  34           HA       GLN  34  -8.278  -1.140  -0.653
  282   1HB   GLN  34          HB2       GLN  34  -8.152   1.733  -1.635
  283   2HB   GLN  34          HB3       GLN  34  -9.419   0.659  -2.187
  284   1HG   GLN  34          HG2       GLN  34  -9.737   0.151   0.419
  285   2HG   GLN  34          HG3       GLN  34  -8.938   1.711   0.600
  286   1HE2  GLN  34          HE21      GLN  34 -10.411   3.464   0.607
  287   2HE2  GLN  34          HE22      GLN  34 -12.000   3.391  -0.146
  288    H    GLN  35           H        GLN  35  -5.920   0.104  -3.084
  289    HA   GLN  35           HA       GLN  35  -7.338  -1.205  -5.264
  290   1HB   GLN  35          HB2       GLN  35  -6.093   0.961  -5.477
  291   2HB   GLN  35          HB3       GLN  35  -4.589   0.112  -5.114
  292   1HG   GLN  35          HG2       GLN  35  -4.793   0.448  -7.492
  293   2HG   GLN  35          HG3       GLN  35  -4.858  -1.273  -7.112
  294   1HE2  GLN  35          HE21      GLN  35  -6.120  -2.041  -8.871
  295   2HE2  GLN  35          HE22      GLN  35  -7.741  -1.438  -9.212
  296    H    ILE  36           H        ILE  36  -4.470  -1.849  -3.248
  297    HA   ILE  36           HA       ILE  36  -3.738  -4.386  -4.365
  298    HB   ILE  36           HB       ILE  36  -3.578  -3.377  -1.522
  299   1HG1  ILE  36          HG12      ILE  36  -1.379  -3.536  -3.641
  300   2HG1  ILE  36          HG13      ILE  36  -2.306  -2.074  -3.334
  301   1HG2  ILE  36          HG21      ILE  36  -1.944  -5.184  -1.123
  302   2HG2  ILE  36          HG22      ILE  36  -3.411  -5.936  -1.725
  303   3HG2  ILE  36          HG23      ILE  36  -2.044  -5.710  -2.813
  304   1HD1  ILE  36          HD11      ILE  36  -0.263  -1.873  -2.142
  305   2HD1  ILE  36          HD12      ILE  36  -1.554  -2.119  -0.945
  306   3HD1  ILE  36          HD13      ILE  36  -0.460  -3.461  -1.380
  307    H    GLY  37           H        GLY  37  -6.229  -3.512  -1.835
  308   1HA   GLY  37          HA2       GLY  37  -7.327  -6.060  -1.478
  309   2HA   GLY  37          HA3       GLY  37  -8.200  -4.531  -1.324
  310    H    ARG  38           H        ARG  38  -7.995  -3.825  -4.215
  311    HA   ARG  38           HA       ARG  38 -10.250  -5.342  -5.253
  312   1HB   ARG  38          HB2       ARG  38  -8.418  -3.409  -6.725
  313   2HB   ARG  38          HB3       ARG  38  -9.931  -4.070  -7.318
  314   1HG   ARG  38          HG2       ARG  38  -9.532  -2.025  -5.140
  315   2HG   ARG  38          HG3       ARG  38 -10.451  -1.923  -6.644
  316   1HD   ARG  38          HD2       ARG  38 -12.069  -3.602  -5.725
  317   2HD   ARG  38          HD3       ARG  38 -11.218  -3.548  -4.183
  318    HE   ARG  38           HE       ARG  38 -13.013  -1.525  -5.325
  319   1HH1  ARG  38          HH22      ARG  38 -10.475  -1.899  -2.886
  320   2HH1  ARG  38          HH21      ARG  38 -11.219  -0.650  -1.893
  321   1HH2  ARG  38          HH12      ARG  38 -13.710   0.157  -4.005
  322   2HH2  ARG  38          HH11      ARG  38 -12.810   0.503  -2.541
  323    H    GLU  39           H        GLU  39  -6.760  -5.605  -5.854
  324    HA   GLU  39           HA       GLU  39  -7.233  -7.617  -7.991
  325   1HB   GLU  39          HB2       GLU  39  -5.036  -5.642  -7.265
  326   2HB   GLU  39          HB3       GLU  39  -4.852  -6.887  -8.502
  327   1HG   GLU  39          HG2       GLU  39  -6.809  -5.954  -9.719
  328   2HG   GLU  39          HG3       GLU  39  -6.957  -4.679  -8.505
  329    H    ASN  40           H        ASN  40  -5.690  -7.243  -4.883
  330    HA   ASN  40           HA       ASN  40  -4.749 -10.046  -4.790
  331   1HB   ASN  40          HB2       ASN  40  -3.056  -7.546  -4.289
  332   2HB   ASN  40          HB3       ASN  40  -2.638  -9.177  -3.752
  333   1HD2  ASN  40          HD21      ASN  40  -1.431 -10.421  -4.950
  334   2HD2  ASN  40          HD22      ASN  40  -0.938  -9.980  -6.580
  335    HA   PRO  41           HA       PRO  41  -6.900  -8.223  -0.948
  336   1HB   PRO  41          HB2       PRO  41  -8.694 -10.269  -0.499
  337   2HB   PRO  41          HB3       PRO  41  -9.006  -8.841  -1.539
  338   1HG   PRO  41          HG2       PRO  41  -8.033 -11.565  -2.404
  339   2HG   PRO  41          HG3       PRO  41  -9.401 -10.614  -3.079
  340   1HD   PRO  41          HD2       PRO  41  -6.988 -10.571  -4.264
  341   2HD   PRO  41          HD3       PRO  41  -7.907  -9.045  -4.084
  342    H    GLN  42           H        GLN  42  -5.488 -11.345  -1.743
  343    HA   GLN  42           HA       GLN  42  -4.919 -12.243   0.939
  344   1HB   GLN  42          HB2       GLN  42  -3.455 -12.862  -1.657
  345   2HB   GLN  42          HB3       GLN  42  -3.423 -13.815  -0.163
  346   1HG   GLN  42          HG2       GLN  42  -5.925 -14.102  -0.397
  347   2HG   GLN  42          HG3       GLN  42  -5.816 -13.342  -1.986
  348   1HE2  GLN  42          HE21      GLN  42  -6.391 -16.280  -0.910
  349   2HE2  GLN  42          HE22      GLN  42  -5.395 -17.238  -1.998
  350    H    LEU  43           H        LEU  43  -2.981 -10.356  -1.451
  351    HA   LEU  43           HA       LEU  43  -0.707 -10.004   0.332
  352   1HB   LEU  43          HB2       LEU  43  -0.607  -9.773  -2.170
  353   2HB   LEU  43          HB3       LEU  43  -1.625  -8.348  -2.079
  354    HG   LEU  43           HG       LEU  43   0.039  -7.101  -0.891
  355   1HD1  LEU  43          HD11      LEU  43   2.323  -7.973  -0.482
  356   2HD1  LEU  43          HD12      LEU  43   1.129  -8.818   0.492
  357   3HD1  LEU  43          HD13      LEU  43   1.786  -9.602  -0.967
  358   1HD2  LEU  43          HD21      LEU  43   1.766  -6.970  -2.623
  359   2HD2  LEU  43          HD22      LEU  43   1.286  -8.561  -3.251
  360   3HD2  LEU  43          HD23      LEU  43   0.165  -7.183  -3.348
  361    H    LEU  44           H        LEU  44  -3.756  -8.367  -0.218
  362    HA   LEU  44           HA       LEU  44  -3.073  -5.954   1.198
  363   1HB   LEU  44          HB2       LEU  44  -5.046  -6.354  -0.383
  364   2HB   LEU  44          HB3       LEU  44  -5.870  -7.153   0.919
  365    HG   LEU  44           HG       LEU  44  -6.204  -4.591   0.316
  366   1HD1  LEU  44          HD11      LEU  44  -7.177  -4.184   2.451
  367   2HD1  LEU  44          HD12      LEU  44  -7.533  -5.819   1.892
  368   3HD1  LEU  44          HD13      LEU  44  -6.305  -5.570   3.168
  369   1HD2  LEU  44          HD21      LEU  44  -5.149  -3.041   1.842
  370   2HD2  LEU  44          HD22      LEU  44  -4.159  -4.311   2.561
  371   3HD2  LEU  44          HD23      LEU  44  -3.904  -3.828   0.862
  372    H    GLN  45           H        GLN  45  -5.067  -8.673   2.215
  373    HA   GLN  45           HA       GLN  45  -5.158  -8.164   4.999
  374   1HB   GLN  45          HB2       GLN  45  -5.260 -10.786   3.469
  375   2HB   GLN  45          HB3       GLN  45  -5.532 -10.682   5.205
  376   1HG   GLN  45          HG2       GLN  45  -7.188  -9.166   3.138
  377   2HG   GLN  45          HG3       GLN  45  -7.637 -10.712   3.864
  378   1HE2  GLN  45          HE21      GLN  45  -8.129 -10.754   6.218
  379   2HE2  GLN  45          HE22      GLN  45  -8.600  -9.249   6.999
  380    H    GLN  46           H        GLN  46  -2.422  -9.570   3.204
  381    HA   GLN  46           HA       GLN  46  -0.899 -10.203   5.626
  382   1HB   GLN  46          HB2       GLN  46  -0.353  -9.992   2.644
  383   2HB   GLN  46          HB3       GLN  46   0.977 -10.121   3.782
  384   1HG   GLN  46          HG2       GLN  46   0.043 -12.214   4.695
  385   2HG   GLN  46          HG3       GLN  46  -1.374 -12.076   3.662
  386   1HE2  GLN  46          HE21      GLN  46  -1.120 -12.325   1.355
  387   2HE2  GLN  46          HE22      GLN  46   0.261 -13.228   0.705
  388    H    ILE  47           H        ILE  47  -0.832  -7.462   3.271
  389    HA   ILE  47           HA       ILE  47   1.172  -5.955   4.607
  390    HB   ILE  47           HB       ILE  47  -1.016  -5.281   2.644
  391   1HG1  ILE  47          HG12      ILE  47   2.038  -5.149   2.535
  392   2HG1  ILE  47          HG13      ILE  47   1.096  -6.555   2.034
  393   1HG2  ILE  47          HG21      ILE  47  -0.026  -2.974   2.457
  394   2HG2  ILE  47          HG22      ILE  47  -0.881  -3.243   3.965
  395   3HG2  ILE  47          HG23      ILE  47   0.895  -3.295   3.943
  396   1HD1  ILE  47          HD11      ILE  47   1.667  -5.338   0.066
  397   2HD1  ILE  47          HD12      ILE  47  -0.077  -5.122   0.350
  398   3HD1  ILE  47          HD13      ILE  47   1.066  -3.812   0.733
  399    H    SER  48           H        SER  48  -2.366  -6.065   5.207
  400    HA   SER  48           HA       SER  48  -2.298  -3.906   7.136
  401   1HB   SER  48          HB2       SER  48  -4.527  -4.581   7.760
  402   2HB   SER  48          HB3       SER  48  -4.365  -4.562   5.997
  403    HG   SER  48           HG       SER  48  -5.440  -6.434   6.815
  404    H    GLN  49           H        GLN  49  -1.912  -7.423   7.448
  405    HA   GLN  49           HA       GLN  49  -1.669  -7.487  10.325
  406   1HB   GLN  49          HB2       GLN  49  -1.020  -9.365   8.039
  407   2HB   GLN  49          HB3       GLN  49  -0.471  -9.747   9.668
  408   1HG   GLN  49          HG2       GLN  49  -2.780  -9.597  10.527
  409   2HG   GLN  49          HG3       GLN  49  -3.371  -9.184   8.916
  410   1HE2  GLN  49          HE21      GLN  49  -3.197 -10.837   7.224
  411   2HE2  GLN  49          HE22      GLN  49  -3.143 -12.548   7.680
  412    H    HIS  50           H        HIS  50   0.541  -6.375   7.930
  413    HA   HIS  50           HA       HIS  50   2.813  -6.396   9.877
  414   1HB   HIS  50          HB2       HIS  50   2.878  -7.000   6.899
  415   2HB   HIS  50          HB3       HIS  50   4.283  -6.956   7.973
  416    HD1  HIS  50           HD1      HIS  50   3.341  -8.832  10.319
  417    HD2  HIS  50           HD2      HIS  50   2.592  -9.478   6.237
  418    HE1  HIS  50           HE1      HIS  50   2.952 -11.329  10.052
  419    H    GLN  51           H        GLN  51   0.844  -4.231   9.010
  420    HA   GLN  51           HA       GLN  51   1.794  -2.633   7.037
  421   1HB   GLN  51          HB2       GLN  51  -0.434  -2.635   8.317
  422   2HB   GLN  51          HB3       GLN  51   0.341  -1.519   9.454
  423   1HG   GLN  51          HG2       GLN  51   0.779   0.049   7.553
  424   2HG   GLN  51          HG3       GLN  51   0.070  -1.132   6.444
  425   1HE2  GLN  51          HE21      GLN  51  -1.849  -0.154   5.748
  426   2HE2  GLN  51          HE22      GLN  51  -3.053   0.493   6.863
  427    H    GLU  52           H        GLU  52   2.922  -2.484  10.389
  428    HA   GLU  52           HA       GLU  52   4.328   0.001  10.265
  429   1HB   GLU  52          HB2       GLU  52   4.891  -2.511  11.891
  430   2HB   GLU  52          HB3       GLU  52   5.673  -0.944  12.142
  431   1HG   GLU  52          HG2       GLU  52   3.444   0.092  12.561
  432   2HG   GLU  52          HG3       GLU  52   2.684  -1.486  12.397
  433    H    HIS  53           H        HIS  53   5.220  -3.183   9.018
  434    HA   HIS  53           HA       HIS  53   7.966  -2.349   8.266
  435   1HB   HIS  53          HB2       HIS  53   6.413  -4.897   7.640
  436   2HB   HIS  53          HB3       HIS  53   8.123  -4.613   7.356
  437    HD1  HIS  53           HD1      HIS  53   5.761  -5.731  10.071
  438    HD2  HIS  53           HD2      HIS  53   9.727  -4.417   9.625
  439    HE1  HIS  53           HE1      HIS  53   6.971  -6.369  12.220
  440    H    PHE  54           H        PHE  54   4.762  -2.861   6.736
  441    HA   PHE  54           HA       PHE  54   5.634  -2.565   4.017
  442   1HB   PHE  54          HB2       PHE  54   3.364  -3.359   4.592
  443   2HB   PHE  54          HB3       PHE  54   2.987  -1.789   5.303
  444    HD1  PHE  54           HD1      PHE  54   1.849  -0.215   3.981
  445    HD2  PHE  54           HD2      PHE  54   4.242  -3.236   2.046
  446    HE1  PHE  54           HE1      PHE  54   1.107   0.612   1.761
  447    HE2  PHE  54           HE2      PHE  54   3.515  -2.388  -0.169
  448    HZ   PHE  54           HZ       PHE  54   1.939  -0.467  -0.312
  449    H    ILE  55           H        ILE  55   4.497  -0.094   6.382
  450    HA   ILE  55           HA       ILE  55   4.759   2.141   4.695
  451    HB   ILE  55           HB       ILE  55   4.820   1.907   7.653
  452   1HG1  ILE  55          HG12      ILE  55   2.837   3.036   5.610
  453   2HG1  ILE  55          HG13      ILE  55   2.749   1.412   6.298
  454   1HG2  ILE  55          HG21      ILE  55   4.923   4.494   6.013
  455   2HG2  ILE  55          HG22      ILE  55   4.605   4.398   7.756
  456   3HG2  ILE  55          HG23      ILE  55   6.171   3.928   7.135
  457   1HD1  ILE  55          HD11      ILE  55   2.516   2.420   8.568
  458   2HD1  ILE  55          HD12      ILE  55   2.396   4.024   7.784
  459   3HD1  ILE  55          HD13      ILE  55   1.182   2.777   7.444
  460    H    GLN  56           H        GLN  56   7.359   0.414   6.487
  461    HA   GLN  56           HA       GLN  56   9.389   2.408   6.026
  462   1HB   GLN  56          HB2       GLN  56   9.832  -0.604   6.181
  463   2HB   GLN  56          HB3       GLN  56  11.017   0.674   6.434
  464   1HG   GLN  56          HG2       GLN  56   8.757  -0.235   8.193
  465   2HG   GLN  56          HG3       GLN  56  10.465  -0.168   8.576
  466   1HE2  GLN  56          HE21      GLN  56   7.702   1.170   9.521
  467   2HE2  GLN  56          HE22      GLN  56   8.237   2.811   9.886
  468    H    MET  57           H        MET  57   8.419  -0.459   4.099
  469    HA   MET  57           HA       MET  57  10.339  -0.049   1.983
  470   1HB   MET  57          HB2       MET  57   7.716  -1.612   2.080
  471   2HB   MET  57          HB3       MET  57   8.927  -1.749   0.797
  472   1HG   MET  57          HG2       MET  57  10.597  -2.538   2.418
  473   2HG   MET  57          HG3       MET  57   9.448  -2.320   3.739
  474   1HE   MET  57          HE1       MET  57   9.436  -4.467   4.827
  475   2HE   MET  57          HE2       MET  57   9.497  -6.043   4.015
  476   3HE   MET  57          HE3       MET  57  10.842  -4.894   3.826
  477    H    LEU  58           H        LEU  58   6.960   0.861   2.396
  478    HA   LEU  58           HA       LEU  58   6.305   2.101  -0.052
  479   1HB   LEU  58          HB2       LEU  58   4.863   1.142   1.556
  480   2HB   LEU  58          HB3       LEU  58   5.459   2.208   2.820
  481    HG   LEU  58           HG       LEU  58   3.166   2.476   1.924
  482   1HD1  LEU  58          HD11      LEU  58   4.249   4.023   3.475
  483   2HD1  LEU  58          HD12      LEU  58   4.903   4.964   2.111
  484   3HD1  LEU  58          HD13      LEU  58   3.151   4.866   2.382
  485   1HD2  LEU  58          HD21      LEU  58   4.484   4.017  -0.347
  486   2HD2  LEU  58          HD22      LEU  58   3.649   2.450  -0.485
  487   3HD2  LEU  58          HD23      LEU  58   2.751   3.884   0.011
  488    H    ASN  59           H        ASN  59   7.993   3.390   2.820
  489    HA   ASN  59           HA       ASN  59   7.874   6.143   1.726
  490   1HB   ASN  59          HB2       ASN  59   6.932   5.433   3.974
  491   2HB   ASN  59          HB3       ASN  59   8.601   5.171   4.502
  492   1HD2  ASN  59          HD21      ASN  59   8.091   6.687   6.185
  493   2HD2  ASN  59          HD22      ASN  59   8.010   8.411   5.842
  494    H    GLU  60           H        GLU  60  10.257   3.623   2.195
  495    HA   GLU  60           HA       GLU  60  12.628   5.209   2.190
  496   1HB   GLU  60          HB2       GLU  60  11.948   2.413   1.320
  497   2HB   GLU  60          HB3       GLU  60  13.516   3.095   0.896
  498   1HG   GLU  60          HG2       GLU  60  12.493   3.113   3.757
  499   2HG   GLU  60          HG3       GLU  60  13.389   1.765   3.060
  500    HA   PRO  61           HA       PRO  61  12.661   7.232  -1.711
  501   1HB   PRO  61          HB2       PRO  61  15.533   6.373  -2.010
  502   2HB   PRO  61          HB3       PRO  61  14.795   8.010  -2.147
  503   1HG   PRO  61          HG2       PRO  61  16.173   7.254   0.064
  504   2HG   PRO  61          HG3       PRO  61  14.726   8.308   0.140
  505   1HD   PRO  61          HD2       PRO  61  14.956   5.398   0.815
  506   2HD   PRO  61          HD3       PRO  61  13.926   6.707   1.501
  507    H    VAL  62           H        VAL  62  11.858   6.665  -3.632
  508    HA   VAL  62           HA       VAL  62  12.127   4.048  -4.829
  509    HB   VAL  62           HB       VAL  62  10.785   5.110  -6.657
  510   1HG1  VAL  62          HG11      VAL  62   9.708   3.973  -4.774
  511   2HG1  VAL  62          HG12      VAL  62   9.706   5.481  -3.836
  512   3HG1  VAL  62          HG13      VAL  62   8.741   5.355  -5.318
  513   1HG2  VAL  62          HG21      VAL  62  10.743   7.593  -4.878
  514   2HG2  VAL  62          HG22      VAL  62  11.586   7.458  -6.439
  515   3HG2  VAL  62          HG23      VAL  62   9.824   7.328  -6.361
  516    H    GLN  63           H        GLN  63  14.281   6.605  -4.849
  517    HA   GLN  63           HA       GLN  63  15.744   5.603  -7.207
  518   1HB   GLN  63          HB2       GLN  63  14.237   7.453  -7.963
  519   2HB   GLN  63          HB3       GLN  63  14.982   8.533  -6.780
  520   1HG   GLN  63          HG2       GLN  63  17.136   8.386  -7.953
  521   2HG   GLN  63          HG3       GLN  63  16.492   7.122  -9.010
  522   1HE2  GLN  63          HE21      GLN  63  17.219   8.580 -10.801
  523   2HE2  GLN  63          HE22      GLN  63  16.163   9.913 -11.254
  524    H    GLU  64           H        GLU  64  18.016   6.243  -7.144
  525    HA   GLU  64           HA       GLU  64  19.046   7.372  -4.606
  526   1HB   GLU  64          HB2       GLU  64  20.603   5.506  -4.299
  527   2HB   GLU  64          HB3       GLU  64  18.917   5.049  -4.139
  528   1HG   GLU  64          HG2       GLU  64  19.931   3.268  -5.253
  529   2HG   GLU  64          HG3       GLU  64  18.978   4.088  -6.466
  530    H    ALA  65           H        ALA  65  21.438   7.615  -4.672
  531    HA   ALA  65           HA       ALA  65  23.147   8.859  -5.303
  532   1HB   ALA  65          HB1       ALA  65  22.825   7.537  -8.010
  533   2HB   ALA  65          HB2       ALA  65  24.282   8.335  -7.384
  534   3HB   ALA  65          HB3       ALA  65  23.678   6.863  -6.602
  535    H    GLY  66           H        GLY  66  20.400   9.432  -7.449
  536   1HA   GLY  66          HA2       GLY  66  21.191  11.692  -8.848
  537   2HA   GLY  66          HA3       GLY  66  19.537  11.375  -8.317
  538    H    GLY  67           H        GLY  67  20.299  11.605  -5.422
  539   1HA   GLY  67          HA2       GLY  67  19.803  14.314  -4.856
  540   2HA   GLY  67          HA3       GLY  67  20.529  13.151  -3.743
  541    H    GLN  68           H        GLN  68  22.919  12.813  -5.613
  542    HA   GLN  68           HA       GLN  68  24.636  14.862  -4.547
  543   1HB   GLN  68          HB2       GLN  68  25.071  12.831  -6.772
  544   2HB   GLN  68          HB3       GLN  68  26.332  13.840  -6.055
  545   1HG   GLN  68          HG2       GLN  68  25.889  12.833  -3.828
  546   2HG   GLN  68          HG3       GLN  68  24.676  11.772  -4.542
  547   1HE2  GLN  68          HE21      GLN  68  26.547  10.422  -3.229
  548   2HE2  GLN  68          HE22      GLN  68  27.726   9.720  -4.333
  549    H    GLY  69           H        GLY  69  22.570  14.938  -7.312
  550   1HA   GLY  69          HA2       GLY  69  23.707  17.559  -8.148
  551   2HA   GLY  69          HA3       GLY  69  23.529  16.282  -9.356
  552    H    GLY  70           H        GLY  70  21.133  16.449  -6.846
  553   1HA   GLY  70          HA2       GLY  70  19.191  18.170  -8.151
  554   2HA   GLY  70          HA3       GLY  70  18.925  16.459  -8.511
  555    H    GLY  71           H        GLY  71  20.178  17.672  -5.407
  556   1HA   GLY  71          HA2       GLY  71  17.721  17.652  -3.923
  557   2HA   GLY  71          HA3       GLY  71  18.544  16.101  -3.766
  558    H    GLY  72           H        GLY  72  18.444  16.903  -1.471
  559   1HA   GLY  72          HA2       GLY  72  21.015  17.564  -0.464
  560   2HA   GLY  72          HA3       GLY  72  20.037  19.031  -0.426
  Start of MODEL   15
    1   1H    GLY   1           H1       GLY   1   8.136  -7.503  16.575
    2   2H    GLY   1           H2       GLY   1   8.029  -5.918  16.988
    3   3H    GLY   1           H3       GLY   1   9.492  -6.584  16.648
    4   1HA   GLY   1          HA2       GLY   1   7.290  -6.230  14.718
    5   2HA   GLY   1          HA3       GLY   1   8.744  -5.220  14.805
    6    H    SER   2           H        SER   2   7.803  -6.781  12.554
    7    HA   SER   2           HA       SER   2   9.458  -9.134  12.153
    8   1HB   SER   2          HB2       SER   2   8.184  -7.343  10.063
    9   2HB   SER   2          HB3       SER   2   8.625  -9.051   9.900
   10    HG   SER   2           HG       SER   2   7.010  -9.471  11.534
   11    H    HIS   3           H        HIS   3  11.089  -9.247  10.371
   12    HA   HIS   3           HA       HIS   3  12.625  -6.721   9.913
   13   1HB   HIS   3          HB2       HIS   3  14.682  -7.794  10.487
   14   2HB   HIS   3          HB3       HIS   3  13.566  -7.975  11.826
   15    HD1  HIS   3           HD1      HIS   3  15.503 -10.046   9.297
   16    HD2  HIS   3           HD2      HIS   3  12.629 -10.508  12.328
   17    HE1  HIS   3           HE1      HIS   3  15.392 -12.540   9.801
   18    H    MET   4           H        MET   4  11.136  -9.272   8.353
   19    HA   MET   4           HA       MET   4  12.448  -8.604   5.824
   20   1HB   MET   4          HB2       MET   4  12.890 -11.065   5.314
   21   2HB   MET   4          HB3       MET   4  13.929 -10.314   6.500
   22   1HG   MET   4          HG2       MET   4  13.310 -12.580   7.133
   23   2HG   MET   4          HG3       MET   4  12.810 -11.381   8.323
   24   1HE   MET   4          HE1       MET   4  11.385 -13.109   9.612
   25   2HE   MET   4          HE2       MET   4  10.174 -14.170   8.859
   26   3HE   MET   4          HE3       MET   4  11.894 -14.367   8.464
   27    HA   PRO   5           HA       PRO   5   8.045 -10.583   5.751
   28   1HB   PRO   5          HB2       PRO   5   6.156  -8.747   6.313
   29   2HB   PRO   5          HB3       PRO   5   7.146  -9.466   7.616
   30   1HG   PRO   5          HG2       PRO   5   7.637  -6.830   6.180
   31   2HG   PRO   5          HG3       PRO   5   7.496  -7.101   7.943
   32   1HD   PRO   5          HD2       PRO   5   9.923  -7.073   6.666
   33   2HD   PRO   5          HD3       PRO   5   9.589  -8.158   8.049
   34    H    LEU   6           H        LEU   6   6.119 -10.093   4.274
   35    HA   LEU   6           HA       LEU   6   5.218  -9.601   2.263
   36   1HB   LEU   6          HB2       LEU   6   6.588  -6.912   2.569
   37   2HB   LEU   6          HB3       LEU   6   5.146  -7.278   1.621
   38    HG   LEU   6           HG       LEU   6   5.305  -7.408   4.663
   39   1HD1  LEU   6          HD11      LEU   6   3.896  -5.392   4.584
   40   2HD1  LEU   6          HD12      LEU   6   5.488  -5.121   3.860
   41   3HD1  LEU   6          HD13      LEU   6   4.075  -5.341   2.810
   42   1HD2  LEU   6          HD21      LEU   6   2.930  -7.655   2.764
   43   2HD2  LEU   6          HD22      LEU   6   3.606  -8.959   3.770
   44   3HD2  LEU   6          HD23      LEU   6   2.847  -7.564   4.540
   45    H    GLU   7           H        GLU   7   7.722 -10.993   2.047
   46    HA   GLU   7           HA       GLU   7   9.459  -9.997   0.074
   47   1HB   GLU   7          HB2       GLU   7   9.682 -12.030   1.648
   48   2HB   GLU   7          HB3       GLU   7   8.807 -12.938   0.422
   49   1HG   GLU   7          HG2       GLU   7  11.214 -13.266   0.193
   50   2HG   GLU   7          HG3       GLU   7  10.601 -12.437  -1.225
   51    H    PHE   8           H        PHE   8   6.276 -11.290  -0.487
   52    HA   PHE   8           HA       PHE   8   6.424 -11.867  -3.261
   53   1HB   PHE   8          HB2       PHE   8   4.510 -12.329  -1.748
   54   2HB   PHE   8          HB3       PHE   8   4.162 -10.602  -1.672
   55    HD1  PHE   8           HD1      PHE   8   2.976  -9.492  -3.482
   56    HD2  PHE   8           HD2      PHE   8   4.227 -13.598  -3.885
   57    HE1  PHE   8           HE1      PHE   8   1.529  -9.741  -5.486
   58    HE2  PHE   8           HE2      PHE   8   2.798 -13.833  -5.902
   59    HZ   PHE   8           HZ       PHE   8   1.442 -11.907  -6.699
   60    H    LEU   9           H        LEU   9   6.398  -8.690  -1.626
   61    HA   LEU   9           HA       LEU   9   5.558  -7.122  -3.885
   62   1HB   LEU   9          HB2       LEU   9   7.196  -6.460  -1.396
   63   2HB   LEU   9          HB3       LEU   9   6.684  -5.257  -2.564
   64    HG   LEU   9           HG       LEU   9   4.767  -6.996  -0.952
   65   1HD1  LEU   9          HD11      LEU   9   6.031  -5.351   0.430
   66   2HD1  LEU   9          HD12      LEU   9   5.484  -4.049  -0.645
   67   3HD1  LEU   9          HD13      LEU   9   4.303  -4.964   0.318
   68   1HD2  LEU   9          HD21      LEU   9   3.735  -6.281  -3.058
   69   2HD2  LEU   9          HD22      LEU   9   3.079  -5.313  -1.733
   70   3HD2  LEU   9          HD23      LEU   9   4.307  -4.615  -2.809
   71    H    ARG  10           H        ARG  10   8.709  -8.338  -2.898
   72    HA   ARG  10           HA       ARG  10  10.271  -6.656  -4.659
   73   1HB   ARG  10          HB2       ARG  10  10.865  -9.058  -2.896
   74   2HB   ARG  10          HB3       ARG  10  12.062  -8.467  -4.037
   75   1HG   ARG  10          HG2       ARG  10  12.664  -7.327  -2.136
   76   2HG   ARG  10          HG3       ARG  10  11.736  -6.140  -3.036
   77   1HD   ARG  10          HD2       ARG  10  11.055  -5.844  -0.846
   78   2HD   ARG  10          HD3       ARG  10   9.735  -6.803  -1.528
   79    HE   ARG  10           HE       ARG  10  11.595  -8.624  -0.426
   80   1HH1  ARG  10          HH22      ARG  10   9.328  -6.213   0.774
   81   2HH1  ARG  10          HH21      ARG  10   9.190  -7.064   2.307
   82   1HH2  ARG  10          HH12      ARG  10  11.478  -9.458   1.674
   83   2HH2  ARG  10          HH11      ARG  10  10.324  -8.751   2.778
   84    H    ASN  11           H        ASN  11   8.198  -8.991  -5.646
   85    HA   ASN  11           HA       ASN  11   9.770  -9.314  -8.169
   86   1HB   ASN  11          HB2       ASN  11   8.835 -11.469  -8.537
   87   2HB   ASN  11          HB3       ASN  11   9.546 -11.441  -6.927
   88   1HD2  ASN  11          HD21      ASN  11   8.305 -12.716  -5.590
   89   2HD2  ASN  11          HD22      ASN  11   6.538 -12.754  -5.639
   90    H    GLN  12           H        GLN  12   7.182  -7.596  -6.964
   91    HA   GLN  12           HA       GLN  12   5.428  -7.946  -9.316
   92   1HB   GLN  12          HB2       GLN  12   5.153  -6.398  -6.718
   93   2HB   GLN  12          HB3       GLN  12   3.943  -6.398  -8.000
   94   1HG   GLN  12          HG2       GLN  12   4.916  -8.903  -6.557
   95   2HG   GLN  12          HG3       GLN  12   3.456  -8.001  -6.150
   96   1HE2  GLN  12          HE21      GLN  12   4.695 -10.558  -8.068
   97   2HE2  GLN  12          HE22      GLN  12   3.301 -10.730  -9.129
   98    HA   PRO  13           HA       PRO  13   7.265  -4.284 -11.341
   99   1HB   PRO  13          HB2       PRO  13   4.671  -4.548 -12.867
  100   2HB   PRO  13          HB3       PRO  13   6.315  -4.214 -13.490
  101   1HG   PRO  13          HG2       PRO  13   5.278  -6.696 -13.696
  102   2HG   PRO  13          HG3       PRO  13   6.979  -6.487 -13.161
  103   1HD   PRO  13          HD2       PRO  13   4.521  -6.972 -11.468
  104   2HD   PRO  13          HD3       PRO  13   6.134  -7.750 -11.375
  105    H    GLN  14           H        GLN  14   4.020  -4.470  -9.935
  106    HA   GLN  14           HA       GLN  14   3.394  -1.657 -10.050
  107   1HB   GLN  14          HB2       GLN  14   2.399  -3.863  -8.202
  108   2HB   GLN  14          HB3       GLN  14   1.710  -2.239  -8.312
  109   1HG   GLN  14          HG2       GLN  14   1.234  -2.615 -10.730
  110   2HG   GLN  14          HG3       GLN  14   1.803  -4.278 -10.583
  111   1HE2  GLN  14          HE21      GLN  14  -0.899  -3.350 -11.366
  112   2HE2  GLN  14          HE22      GLN  14  -1.984  -4.038 -10.171
  113    H    PHE  15           H        PHE  15   5.406  -3.518  -7.813
  114    HA   PHE  15           HA       PHE  15   5.234  -1.639  -5.585
  115   1HB   PHE  15          HB2       PHE  15   5.642  -4.030  -5.261
  116   2HB   PHE  15          HB3       PHE  15   7.091  -3.948  -6.255
  117    HD1  PHE  15           HD1      PHE  15   9.136  -3.932  -5.167
  118    HD2  PHE  15           HD2      PHE  15   5.684  -2.353  -3.120
  119    HE1  PHE  15           HE1      PHE  15  10.483  -3.653  -3.105
  120    HE2  PHE  15           HE2      PHE  15   7.035  -2.101  -1.054
  121    HZ   PHE  15           HZ       PHE  15   9.433  -2.749  -1.043
  122    H    GLN  16           H        GLN  16   7.040  -1.757  -8.504
  123    HA   GLN  16           HA       GLN  16   9.115   0.171  -7.719
  124   1HB   GLN  16          HB2       GLN  16   8.173  -1.112 -10.305
  125   2HB   GLN  16          HB3       GLN  16   9.472   0.097 -10.259
  126   1HG   GLN  16          HG2       GLN  16  10.813  -1.351  -8.789
  127   2HG   GLN  16          HG3       GLN  16   9.505  -2.530  -8.708
  128   1HE2  GLN  16          HE21      GLN  16  10.081  -4.327  -9.910
  129   2HE2  GLN  16          HE22      GLN  16  10.845  -4.237 -11.493
  130    H    GLN  17           H        GLN  17   5.788   0.474  -8.363
  131    HA   GLN  17           HA       GLN  17   6.045   3.241  -9.497
  132   1HB   GLN  17          HB2       GLN  17   4.019   1.049 -10.109
  133   2HB   GLN  17          HB3       GLN  17   3.997   2.693 -10.761
  134   1HG   GLN  17          HG2       GLN  17   6.190   2.285 -11.855
  135   2HG   GLN  17          HG3       GLN  17   6.233   0.651 -11.198
  136   1HE2  GLN  17          HE21      GLN  17   5.176  -0.999 -12.277
  137   2HE2  GLN  17          HE22      GLN  17   4.196  -0.729 -13.722
  138    H    MET  18           H        MET  18   3.737   1.136  -7.616
  139    HA   MET  18           HA       MET  18   1.952   3.225  -7.021
  140   1HB   MET  18          HB2       MET  18   0.986   1.734  -5.456
  141   2HB   MET  18          HB3       MET  18   1.442   0.854  -6.911
  142   1HG   MET  18          HG2       MET  18   3.487  -0.002  -5.694
  143   2HG   MET  18          HG3       MET  18   2.918   0.805  -4.236
  144   1HE   MET  18          HE1       MET  18   3.084  -1.348  -2.854
  145   2HE   MET  18          HE2       MET  18   2.229  -2.866  -3.202
  146   3HE   MET  18          HE3       MET  18   3.596  -2.374  -4.220
  147    H    ARG  19           H        ARG  19   4.890   2.338  -5.293
  148    HA   ARG  19           HA       ARG  19   4.434   4.021  -2.967
  149   1HB   ARG  19          HB2       ARG  19   7.074   3.056  -4.176
  150   2HB   ARG  19          HB3       ARG  19   6.804   3.654  -2.533
  151   1HG   ARG  19          HG2       ARG  19   5.095   1.753  -2.282
  152   2HG   ARG  19          HG3       ARG  19   5.723   1.076  -3.767
  153   1HD   ARG  19          HD2       ARG  19   7.665   1.785  -1.550
  154   2HD   ARG  19          HD3       ARG  19   6.783   0.246  -1.528
  155    HE   ARG  19           HE       ARG  19   7.712   0.018  -3.947
  156   1HH1  ARG  19          HH22      ARG  19   9.728   1.352  -1.356
  157   2HH1  ARG  19          HH21      ARG  19  11.157   1.079  -2.327
  158   1HH2  ARG  19          HH12      ARG  19   9.525  -0.575  -4.827
  159   2HH2  ARG  19          HH11      ARG  19  11.072  -0.225  -4.061
  160    H    GLN  20           H        GLN  20   5.735   4.661  -6.152
  161    HA   GLN  20           HA       GLN  20   6.907   7.255  -5.624
  162   1HB   GLN  20          HB2       GLN  20   5.529   6.386  -8.200
  163   2HB   GLN  20          HB3       GLN  20   6.616   7.740  -7.972
  164   1HG   GLN  20          HG2       GLN  20   8.452   6.100  -7.369
  165   2HG   GLN  20          HG3       GLN  20   7.340   4.793  -7.801
  166   1HE2  GLN  20          HE21      GLN  20   8.329   3.985  -9.718
  167   2HE2  GLN  20          HE22      GLN  20   8.615   5.015 -11.117
  168    H    ILE  21           H        ILE  21   3.593   6.172  -6.180
  169    HA   ILE  21           HA       ILE  21   2.425   8.748  -6.574
  170    HB   ILE  21           HB       ILE  21   1.016   6.259  -5.499
  171   1HG1  ILE  21          HG12      ILE  21   1.812   6.917  -8.353
  172   2HG1  ILE  21          HG13      ILE  21   2.329   5.531  -7.399
  173   1HG2  ILE  21          HG21      ILE  21  -0.941   7.224  -6.601
  174   2HG2  ILE  21          HG22      ILE  21  -0.250   8.415  -5.503
  175   3HG2  ILE  21          HG23      ILE  21   0.045   8.555  -7.251
  176   1HD1  ILE  21          HD11      ILE  21   0.749   4.724  -8.946
  177   2HD1  ILE  21          HD12      ILE  21   0.008   4.662  -7.340
  178   3HD1  ILE  21          HD13      ILE  21  -0.456   5.947  -8.492
  179    H    ILE  22           H        ILE  22   2.783   6.609  -3.773
  180    HA   ILE  22           HA       ILE  22   1.438   8.317  -1.862
  181    HB   ILE  22           HB       ILE  22   3.398   6.067  -1.296
  182   1HG1  ILE  22          HG12      ILE  22   1.801   4.968  -2.617
  183   2HG1  ILE  22          HG13      ILE  22   1.282   4.667  -0.977
  184   1HG2  ILE  22          HG21      ILE  22   2.880   7.406   0.701
  185   2HG2  ILE  22          HG22      ILE  22   1.134   7.213   0.397
  186   3HG2  ILE  22          HG23      ILE  22   2.133   5.815   0.814
  187   1HD1  ILE  22          HD11      ILE  22  -0.357   6.645  -1.281
  188   2HD1  ILE  22          HD12      ILE  22   0.028   6.547  -3.011
  189   3HD1  ILE  22          HD13      ILE  22  -0.692   5.154  -2.191
  190    H    GLN  23           H        GLN  23   4.823   7.937  -2.792
  191    HA   GLN  23           HA       GLN  23   6.039   9.665  -0.884
  192   1HB   GLN  23          HB2       GLN  23   6.713   8.659  -3.654
  193   2HB   GLN  23          HB3       GLN  23   7.804   9.769  -2.812
  194   1HG   GLN  23          HG2       GLN  23   8.143   8.240  -0.990
  195   2HG   GLN  23          HG3       GLN  23   6.853   7.174  -1.540
  196   1HE2  GLN  23          HE21      GLN  23   8.632   5.526  -1.308
  197   2HE2  GLN  23          HE22      GLN  23   9.733   5.313  -2.656
  198    H    GLN  24           H        GLN  24   3.774  10.600  -3.181
  199    HA   GLN  24           HA       GLN  24   4.667  13.472  -3.084
  200   1HB   GLN  24          HB2       GLN  24   3.125  12.109  -5.330
  201   2HB   GLN  24          HB3       GLN  24   3.654  13.796  -5.278
  202   1HG   GLN  24          HG2       GLN  24   6.007  13.060  -5.328
  203   2HG   GLN  24          HG3       GLN  24   5.469  11.369  -5.269
  204   1HE2  GLN  24          HE21      GLN  24   5.027  10.331  -7.179
  205   2HE2  GLN  24          HE22      GLN  24   4.962  11.133  -8.751
  206    H    ASN  25           H        ASN  25   1.998  11.193  -3.180
  207    HA   ASN  25           HA       ASN  25   0.283  13.084  -1.625
  208   1HB   ASN  25          HB2       ASN  25  -0.387  11.504  -4.093
  209   2HB   ASN  25          HB3       ASN  25  -1.624  11.728  -2.851
  210   1HD2  ASN  25          HD21      ASN  25  -1.967  13.972  -2.022
  211   2HD2  ASN  25          HD22      ASN  25  -1.916  15.246  -3.241
  212    HA   PRO  26           HA       PRO  26   0.852   9.283   0.931
  213   1HB   PRO  26          HB2       PRO  26   0.959  10.560   3.357
  214   2HB   PRO  26          HB3       PRO  26   2.379  10.330   2.289
  215   1HG   PRO  26          HG2       PRO  26   0.587  12.766   2.491
  216   2HG   PRO  26          HG3       PRO  26   2.383  12.706   2.554
  217   1HD   PRO  26          HD2       PRO  26   1.052  13.307   0.300
  218   2HD   PRO  26          HD3       PRO  26   2.507  12.262   0.222
  219    H    SER  27           H        SER  27  -1.407  11.960   0.923
  220    HA   SER  27           HA       SER  27  -3.550  10.946   2.482
  221   1HB   SER  27          HB2       SER  27  -4.924  12.402   0.959
  222   2HB   SER  27          HB3       SER  27  -3.557  13.211   1.731
  223    HG   SER  27           HG       SER  27  -3.813  13.615  -0.558
  224    H    LEU  28           H        LEU  28  -2.307   9.748  -0.547
  225    HA   LEU  28           HA       LEU  28  -4.787   8.194  -1.075
  226   1HB   LEU  28          HB2       LEU  28  -2.324   8.662  -2.792
  227   2HB   LEU  28          HB3       LEU  28  -3.741   7.724  -3.261
  228    HG   LEU  28           HG       LEU  28  -3.660  10.722  -2.746
  229   1HD1  LEU  28          HD11      LEU  28  -4.191  10.833  -5.145
  230   2HD1  LEU  28          HD12      LEU  28  -2.693   9.918  -4.890
  231   3HD1  LEU  28          HD13      LEU  28  -4.211   9.056  -5.235
  232   1HD2  LEU  28          HD21      LEU  28  -5.852   9.918  -2.006
  233   2HD2  LEU  28          HD22      LEU  28  -6.007  10.735  -3.561
  234   3HD2  LEU  28          HD23      LEU  28  -6.033   8.958  -3.496
  235    H    LEU  29           H        LEU  29  -2.235   7.627   0.895
  236    HA   LEU  29           HA       LEU  29  -1.484   4.957   0.250
  237   1HB   LEU  29          HB2       LEU  29  -0.337   6.244   1.913
  238   2HB   LEU  29          HB3       LEU  29  -1.743   6.414   2.910
  239    HG   LEU  29           HG       LEU  29  -1.762   4.025   3.451
  240   1HD1  LEU  29          HD11      LEU  29   0.161   2.579   2.753
  241   2HD1  LEU  29          HD12      LEU  29  -0.891   3.010   1.405
  242   3HD1  LEU  29          HD13      LEU  29   0.656   3.858   1.610
  243   1HD2  LEU  29          HD21      LEU  29  -0.371   5.556   4.803
  244   2HD2  LEU  29          HD22      LEU  29   0.324   3.928   4.737
  245   3HD2  LEU  29          HD23      LEU  29   1.021   5.229   3.746
  246    HA   PRO  30           HA       PRO  30  -5.613   3.517   2.610
  247   1HB   PRO  30          HB2       PRO  30  -7.243   5.921   1.795
  248   2HB   PRO  30          HB3       PRO  30  -7.382   4.918   3.250
  249   1HG   PRO  30          HG2       PRO  30  -6.216   7.437   3.057
  250   2HG   PRO  30          HG3       PRO  30  -5.831   6.249   4.355
  251   1HD   PRO  30          HD2       PRO  30  -4.157   7.161   2.125
  252   2HD   PRO  30          HD3       PRO  30  -3.705   6.174   3.534
  253    H    ALA  31           H        ALA  31  -5.801   5.776  -0.084
  254    HA   ALA  31           HA       ALA  31  -7.586   4.257  -1.692
  255   1HB   ALA  31          HB1       ALA  31  -7.259   6.720  -1.685
  256   2HB   ALA  31          HB2       ALA  31  -5.719   6.480  -2.552
  257   3HB   ALA  31          HB3       ALA  31  -7.244   5.968  -3.307
  258    H    LEU  32           H        LEU  32  -4.249   3.605  -1.147
  259    HA   LEU  32           HA       LEU  32  -4.007   2.118  -3.724
  260   1HB   LEU  32          HB2       LEU  32  -2.128   3.562  -3.123
  261   2HB   LEU  32          HB3       LEU  32  -2.082   2.817  -1.507
  262    HG   LEU  32           HG       LEU  32  -1.320   0.713  -2.420
  263   1HD1  LEU  32          HD11      LEU  32  -1.445   2.059  -5.155
  264   2HD1  LEU  32          HD12      LEU  32  -0.776   0.441  -4.807
  265   3HD1  LEU  32          HD13      LEU  32  -2.493   0.734  -4.602
  266   1HD2  LEU  32          HD21      LEU  32   0.924   1.424  -3.104
  267   2HD2  LEU  32          HD22      LEU  32   0.303   3.018  -3.574
  268   3HD2  LEU  32          HD23      LEU  32   0.296   2.521  -1.870
  269    H    LEU  33           H        LEU  33  -3.950   1.765  -0.161
  270    HA   LEU  33           HA       LEU  33  -3.769  -1.067  -0.007
  271   1HB   LEU  33          HB2       LEU  33  -5.165   0.991   1.737
  272   2HB   LEU  33          HB3       LEU  33  -4.944  -0.699   2.200
  273    HG   LEU  33           HG       LEU  33  -2.514   0.948   1.421
  274   1HD1  LEU  33          HD11      LEU  33  -3.680   2.319   3.027
  275   2HD1  LEU  33          HD12      LEU  33  -3.869   0.938   4.140
  276   3HD1  LEU  33          HD13      LEU  33  -2.250   1.592   3.779
  277   1HD2  LEU  33          HD21      LEU  33  -2.267  -1.494   1.755
  278   2HD2  LEU  33          HD22      LEU  33  -1.390  -0.561   2.981
  279   3HD2  LEU  33          HD23      LEU  33  -2.935  -1.334   3.395
  280    H    GLN  34           H        GLN  34  -6.705   1.026  -0.440
  281    HA   GLN  34           HA       GLN  34  -8.470  -1.228  -0.623
  282   1HB   GLN  34          HB2       GLN  34 -10.146   0.231  -1.312
  283   2HB   GLN  34          HB3       GLN  34  -9.144   1.157  -0.197
  284   1HG   GLN  34          HG2       GLN  34  -7.991   2.164  -2.225
  285   2HG   GLN  34          HG3       GLN  34  -9.165   1.336  -3.247
  286   1HE2  GLN  34          HE21      GLN  34  -9.343   3.806  -3.844
  287   2HE2  GLN  34          HE22      GLN  34 -10.618   4.651  -2.977
  288    H    GLN  35           H        GLN  35  -6.285   0.192  -3.067
  289    HA   GLN  35           HA       GLN  35  -7.649  -1.222  -5.264
  290   1HB   GLN  35          HB2       GLN  35  -5.035   0.334  -5.108
  291   2HB   GLN  35          HB3       GLN  35  -5.532  -0.567  -6.543
  292   1HG   GLN  35          HG2       GLN  35  -7.616   0.732  -6.696
  293   2HG   GLN  35          HG3       GLN  35  -7.173   1.646  -5.254
  294   1HE2  GLN  35          HE21      GLN  35  -5.673   3.363  -5.468
  295   2HE2  GLN  35          HE22      GLN  35  -4.997   3.843  -7.029
  296    H    ILE  36           H        ILE  36  -4.780  -1.768  -3.239
  297    HA   ILE  36           HA       ILE  36  -4.016  -4.293  -4.339
  298    HB   ILE  36           HB       ILE  36  -3.807  -3.211  -1.529
  299   1HG1  ILE  36          HG12      ILE  36  -1.633  -3.453  -3.662
  300   2HG1  ILE  36          HG13      ILE  36  -2.593  -1.991  -3.471
  301   1HG2  ILE  36          HG21      ILE  36  -2.106  -4.987  -1.149
  302   2HG2  ILE  36          HG22      ILE  36  -3.620  -5.751  -1.600
  303   3HG2  ILE  36          HG23      ILE  36  -2.338  -5.597  -2.800
  304   1HD1  ILE  36          HD11      ILE  36  -1.842  -1.819  -1.094
  305   2HD1  ILE  36          HD12      ILE  36  -0.738  -3.186  -1.398
  306   3HD1  ILE  36          HD13      ILE  36  -0.542  -1.673  -2.297
  307    H    GLY  37           H        GLY  37  -6.497  -3.483  -1.780
  308   1HA   GLY  37          HA2       GLY  37  -7.455  -6.085  -1.357
  309   2HA   GLY  37          HA3       GLY  37  -8.397  -4.598  -1.193
  310    H    ARG  38           H        ARG  38  -8.259  -3.918  -4.086
  311    HA   ARG  38           HA       ARG  38 -10.379  -5.649  -5.144
  312   1HB   ARG  38          HB2       ARG  38  -8.847  -3.312  -6.333
  313   2HB   ARG  38          HB3       ARG  38 -10.106  -4.189  -7.190
  314   1HG   ARG  38          HG2       ARG  38 -10.530  -2.748  -4.537
  315   2HG   ARG  38          HG3       ARG  38 -10.893  -2.099  -6.144
  316   1HD   ARG  38          HD2       ARG  38 -12.504  -3.989  -6.505
  317   2HD   ARG  38          HD3       ARG  38 -12.188  -4.536  -4.861
  318    HE   ARG  38           HE       ARG  38 -13.414  -2.778  -3.977
  319   1HH1  ARG  38          HH22      ARG  38 -13.143  -2.216  -7.435
  320   2HH1  ARG  38          HH21      ARG  38 -14.346  -0.946  -7.405
  321   1HH2  ARG  38          HH12      ARG  38 -14.927  -1.164  -4.020
  322   2HH2  ARG  38          HH11      ARG  38 -15.321  -0.372  -5.523
  323    H    GLU  39           H        GLU  39  -6.890  -5.269  -5.872
  324    HA   GLU  39           HA       GLU  39  -7.037  -7.132  -8.120
  325   1HB   GLU  39          HB2       GLU  39  -4.898  -5.417  -6.801
  326   2HB   GLU  39          HB3       GLU  39  -4.562  -6.523  -8.134
  327   1HG   GLU  39          HG2       GLU  39  -6.225  -5.344  -9.540
  328   2HG   GLU  39          HG3       GLU  39  -6.553  -4.214  -8.222
  329    H    ASN  40           H        ASN  40  -5.701  -7.150  -4.849
  330    HA   ASN  40           HA       ASN  40  -5.227 -10.063  -4.834
  331   1HB   ASN  40          HB2       ASN  40  -3.103  -7.923  -4.423
  332   2HB   ASN  40          HB3       ASN  40  -2.971  -9.546  -3.729
  333   1HD2  ASN  40          HD21      ASN  40  -1.200  -8.207  -5.580
  334   2HD2  ASN  40          HD22      ASN  40  -0.996  -9.472  -6.791
  335    HA   PRO  41           HA       PRO  41  -7.057  -8.270  -0.882
  336   1HB   PRO  41          HB2       PRO  41  -8.797 -10.358  -0.398
  337   2HB   PRO  41          HB3       PRO  41  -9.179  -8.907  -1.379
  338   1HG   PRO  41          HG2       PRO  41  -8.213 -11.591  -2.366
  339   2HG   PRO  41          HG3       PRO  41  -9.624 -10.641  -2.948
  340   1HD   PRO  41          HD2       PRO  41  -7.280 -10.531  -4.253
  341   2HD   PRO  41          HD3       PRO  41  -8.197  -9.022  -3.975
  342    H    GLN  42           H        GLN  42  -5.496 -11.258  -1.813
  343    HA   GLN  42           HA       GLN  42  -4.843 -12.184   0.871
  344   1HB   GLN  42          HB2       GLN  42  -3.571 -12.821  -1.819
  345   2HB   GLN  42          HB3       GLN  42  -3.368 -13.737  -0.315
  346   1HG   GLN  42          HG2       GLN  42  -5.869 -14.097  -0.290
  347   2HG   GLN  42          HG3       GLN  42  -5.946 -13.371  -1.896
  348   1HE2  GLN  42          HE21      GLN  42  -6.059 -16.345  -0.506
  349   2HE2  GLN  42          HE22      GLN  42  -5.254 -17.274  -1.764
  350    H    LEU  43           H        LEU  43  -3.026 -10.306  -1.651
  351    HA   LEU  43           HA       LEU  43  -0.700  -9.859   0.016
  352   1HB   LEU  43          HB2       LEU  43  -0.772  -9.556  -2.469
  353   2HB   LEU  43          HB3       LEU  43  -1.874  -8.198  -2.273
  354    HG   LEU  43           HG       LEU  43  -0.190  -6.887  -1.140
  355   1HD1  LEU  43          HD11      LEU  43   1.619  -9.326  -1.447
  356   2HD1  LEU  43          HD12      LEU  43   2.188  -7.692  -1.025
  357   3HD1  LEU  43          HD13      LEU  43   1.108  -8.553   0.071
  358   1HD2  LEU  43          HD21      LEU  43   0.896  -8.170  -3.676
  359   2HD2  LEU  43          HD22      LEU  43  -0.302  -6.856  -3.597
  360   3HD2  LEU  43          HD23      LEU  43   1.343  -6.577  -3.021
  361    H    LEU  44           H        LEU  44  -3.850  -8.346  -0.295
  362    HA   LEU  44           HA       LEU  44  -3.170  -5.950   1.145
  363   1HB   LEU  44          HB2       LEU  44  -5.222  -6.427  -0.347
  364   2HB   LEU  44          HB3       LEU  44  -5.946  -7.219   1.016
  365    HG   LEU  44           HG       LEU  44  -6.342  -4.669   0.370
  366   1HD1  LEU  44          HD11      LEU  44  -7.241  -4.231   2.523
  367   2HD1  LEU  44          HD12      LEU  44  -7.596  -5.880   2.012
  368   3HD1  LEU  44          HD13      LEU  44  -6.326  -5.591   3.240
  369   1HD2  LEU  44          HD21      LEU  44  -4.213  -4.324   2.522
  370   2HD2  LEU  44          HD22      LEU  44  -4.041  -3.858   0.808
  371   3HD2  LEU  44          HD23      LEU  44  -5.254  -3.076   1.831
  372    H    GLN  45           H        GLN  45  -5.003  -8.762   2.190
  373    HA   GLN  45           HA       GLN  45  -4.945  -8.381   4.995
  374   1HB   GLN  45          HB2       GLN  45  -5.040 -10.904   3.319
  375   2HB   GLN  45          HB3       GLN  45  -5.148 -10.938   5.081
  376   1HG   GLN  45          HG2       GLN  45  -7.143  -9.586   5.103
  377   2HG   GLN  45          HG3       GLN  45  -7.028  -9.263   3.368
  378   1HE2  GLN  45          HE21      GLN  45  -7.290 -11.101   1.885
  379   2HE2  GLN  45          HE22      GLN  45  -8.318 -12.455   2.378
  380    H    GLN  46           H        GLN  46  -2.248  -9.605   2.978
  381    HA   GLN  46           HA       GLN  46  -0.560 -10.252   5.278
  382   1HB   GLN  46          HB2       GLN  46  -0.192  -9.858   2.286
  383   2HB   GLN  46          HB3       GLN  46   1.202  -9.969   3.346
  384   1HG   GLN  46          HG2       GLN  46   0.457 -12.165   4.167
  385   2HG   GLN  46          HG3       GLN  46  -1.038 -12.053   3.247
  386   1HE2  GLN  46          HE21      GLN  46  -0.950 -12.169   0.924
  387   2HE2  GLN  46          HE22      GLN  46   0.437 -12.925   0.118
  388    H    ILE  47           H        ILE  47  -0.758  -7.408   3.055
  389    HA   ILE  47           HA       ILE  47   1.239  -5.861   4.348
  390    HB   ILE  47           HB       ILE  47  -1.115  -5.196   2.585
  391   1HG1  ILE  47          HG12      ILE  47   1.908  -4.880   2.276
  392   2HG1  ILE  47          HG13      ILE  47   1.021  -6.324   1.772
  393   1HG2  ILE  47          HG21      ILE  47  -0.246  -2.840   2.471
  394   2HG2  ILE  47          HG22      ILE  47  -0.975  -3.232   4.019
  395   3HG2  ILE  47          HG23      ILE  47   0.796  -3.196   3.865
  396   1HD1  ILE  47          HD11      ILE  47   0.732  -3.536   0.615
  397   2HD1  ILE  47          HD12      ILE  47   1.381  -4.989  -0.164
  398   3HD1  ILE  47          HD13      ILE  47  -0.348  -4.908   0.245
  399    H    SER  48           H        SER  48  -2.256  -6.146   5.135
  400    HA   SER  48           HA       SER  48  -2.158  -4.110   7.178
  401   1HB   SER  48          HB2       SER  48  -4.303  -4.906   7.912
  402   2HB   SER  48          HB3       SER  48  -4.261  -4.811   6.146
  403    HG   SER  48           HG       SER  48  -5.198  -6.764   6.992
  404    H    GLN  49           H        GLN  49  -1.405  -7.552   7.253
  405    HA   GLN  49           HA       GLN  49  -1.076  -7.759  10.128
  406   1HB   GLN  49          HB2       GLN  49  -0.434  -9.474   7.720
  407   2HB   GLN  49          HB3       GLN  49   0.255  -9.890   9.285
  408   1HG   GLN  49          HG2       GLN  49  -1.988  -9.973  10.299
  409   2HG   GLN  49          HG3       GLN  49  -2.723  -9.493   8.767
  410   1HE2  GLN  49          HE21      GLN  49  -2.626 -11.012   6.967
  411   2HE2  GLN  49          HE22      GLN  49  -2.403 -12.740   7.284
  412    H    HIS  50           H        HIS  50   0.910  -6.261   7.761
  413    HA   HIS  50           HA       HIS  50   3.156  -6.042   9.711
  414   1HB   HIS  50          HB2       HIS  50   3.438  -6.692   6.752
  415   2HB   HIS  50          HB3       HIS  50   4.771  -6.374   7.865
  416    HD1  HIS  50           HD1      HIS  50   5.195  -8.354   9.810
  417    HD2  HIS  50           HD2      HIS  50   2.626  -9.181   6.582
  418    HE1  HIS  50           HE1      HIS  50   4.907 -10.861   9.755
  419    H    GLN  51           H        GLN  51   0.972  -4.150   8.959
  420    HA   GLN  51           HA       GLN  51   1.650  -2.580   6.820
  421   1HB   GLN  51          HB2       GLN  51  -0.539  -2.818   8.206
  422   2HB   GLN  51          HB3       GLN  51   0.062  -1.426   9.124
  423   1HG   GLN  51          HG2       GLN  51   0.219  -0.124   7.013
  424   2HG   GLN  51          HG3       GLN  51  -0.286  -1.544   6.090
  425   1HE2  GLN  51          HE21      GLN  51  -1.460   1.325   7.411
  426   2HE2  GLN  51          HE22      GLN  51  -3.154   0.851   7.509
  427    H    GLU  52           H        GLU  52   2.820  -2.031  10.127
  428    HA   GLU  52           HA       GLU  52   3.950   0.573   9.641
  429   1HB   GLU  52          HB2       GLU  52   5.254   0.216  11.620
  430   2HB   GLU  52          HB3       GLU  52   3.606  -0.343  11.885
  431   1HG   GLU  52          HG2       GLU  52   4.408  -2.709  11.470
  432   2HG   GLU  52          HG3       GLU  52   6.051  -2.083  11.365
  433    H    HIS  53           H        HIS  53   5.086  -2.672   8.808
  434    HA   HIS  53           HA       HIS  53   7.745  -1.733   7.984
  435   1HB   HIS  53          HB2       HIS  53   6.424  -4.445   7.604
  436   2HB   HIS  53          HB3       HIS  53   8.123  -4.049   7.356
  437    HD1  HIS  53           HD1      HIS  53   9.159  -2.789   9.843
  438    HD2  HIS  53           HD2      HIS  53   5.968  -5.517   9.948
  439    HE1  HIS  53           HE1      HIS  53   9.052  -3.667  12.228
  440    H    PHE  54           H        PHE  54   4.622  -2.519   6.419
  441    HA   PHE  54           HA       PHE  54   5.530  -1.941   3.709
  442   1HB   PHE  54          HB2       PHE  54   3.339  -3.040   4.313
  443   2HB   PHE  54          HB3       PHE  54   2.785  -1.490   4.944
  444    HD1  PHE  54           HD1      PHE  54   4.435  -2.807   1.800
  445    HD2  PHE  54           HD2      PHE  54   1.359  -0.307   3.499
  446    HE1  PHE  54           HE1      PHE  54   3.640  -2.231  -0.478
  447    HE2  PHE  54           HE2      PHE  54   0.550   0.239   1.218
  448    HZ   PHE  54           HZ       PHE  54   1.692  -0.710  -0.772
  449    H    ILE  55           H        ILE  55   4.303   0.232   6.284
  450    HA   ILE  55           HA       ILE  55   4.660   2.646   4.818
  451    HB   ILE  55           HB       ILE  55   4.489   1.960   7.708
  452   1HG1  ILE  55          HG12      ILE  55   2.801   3.649   5.800
  453   2HG1  ILE  55          HG13      ILE  55   2.538   1.929   6.097
  454   1HG2  ILE  55          HG21      ILE  55   4.949   4.770   6.592
  455   2HG2  ILE  55          HG22      ILE  55   4.481   4.384   8.263
  456   3HG2  ILE  55          HG23      ILE  55   6.053   3.883   7.669
  457   1HD1  ILE  55          HD11      ILE  55   2.169   2.421   8.509
  458   2HD1  ILE  55          HD12      ILE  55   2.249   4.163   8.119
  459   3HD1  ILE  55          HD13      ILE  55   0.977   3.153   7.410
  460    H    GLN  56           H        GLN  56   7.117   0.760   6.674
  461    HA   GLN  56           HA       GLN  56   9.256   2.643   6.167
  462   1HB   GLN  56          HB2       GLN  56   9.269  -0.339   6.784
  463   2HB   GLN  56          HB3       GLN  56  10.733   0.626   6.603
  464   1HG   GLN  56          HG2       GLN  56  10.136   2.054   8.460
  465   2HG   GLN  56          HG3       GLN  56   8.567   1.285   8.646
  466   1HE2  GLN  56          HE21      GLN  56  11.252   1.480  10.346
  467   2HE2  GLN  56          HE22      GLN  56  11.412  -0.184  10.899
  468    H    MET  57           H        MET  57   8.269  -0.332   4.339
  469    HA   MET  57           HA       MET  57  10.218  -0.046   2.263
  470   1HB   MET  57          HB2       MET  57   7.447  -1.314   2.241
  471   2HB   MET  57          HB3       MET  57   8.644  -1.513   0.953
  472   1HG   MET  57          HG2       MET  57  10.140  -2.709   2.385
  473   2HG   MET  57          HG3       MET  57   9.234  -2.266   3.828
  474   1HE   MET  57          HE1       MET  57   8.302  -5.856   4.231
  475   2HE   MET  57          HE2       MET  57   9.896  -5.115   3.947
  476   3HE   MET  57          HE3       MET  57   8.703  -4.303   4.988
  477    H    LEU  58           H        LEU  58   7.000   1.340   2.608
  478    HA   LEU  58           HA       LEU  58   6.702   2.686   0.124
  479   1HB   LEU  58          HB2       LEU  58   5.657   2.749   2.922
  480   2HB   LEU  58          HB3       LEU  58   5.403   4.240   2.000
  481    HG   LEU  58           HG       LEU  58   4.583   1.479   0.993
  482   1HD1  LEU  58          HD11      LEU  58   2.979   3.561   2.556
  483   2HD1  LEU  58          HD12      LEU  58   2.304   2.129   1.735
  484   3HD1  LEU  58          HD13      LEU  58   3.403   1.927   3.107
  485   1HD2  LEU  58          HD21      LEU  58   3.715   4.313   0.291
  486   2HD2  LEU  58          HD22      LEU  58   4.835   3.351  -0.672
  487   3HD2  LEU  58          HD23      LEU  58   3.145   2.812  -0.499
  488    H    ASN  59           H        ASN  59   8.412   3.577   3.048
  489    HA   ASN  59           HA       ASN  59   9.239   6.234   2.096
  490   1HB   ASN  59          HB2       ASN  59   9.571   4.587   4.608
  491   2HB   ASN  59          HB3       ASN  59  10.739   5.859   4.293
  492   1HD2  ASN  59          HD21      ASN  59   7.365   5.195   5.032
  493   2HD2  ASN  59          HD22      ASN  59   6.950   6.876   5.380
  494    H    GLU  60           H        GLU  60  10.654   2.977   2.071
  495    HA   GLU  60           HA       GLU  60  13.290   3.746   1.201
  496   1HB   GLU  60          HB2       GLU  60  11.667   1.202   0.767
  497   2HB   GLU  60          HB3       GLU  60  13.325   1.404   0.218
  498   1HG   GLU  60          HG2       GLU  60  13.986   1.923   2.599
  499   2HG   GLU  60          HG3       GLU  60  12.362   1.458   3.099
  500    HA   PRO  61           HA       PRO  61  12.534   4.975  -2.995
  501   1HB   PRO  61          HB2       PRO  61  14.877   4.370  -4.267
  502   2HB   PRO  61          HB3       PRO  61  14.724   5.664  -3.038
  503   1HG   PRO  61          HG2       PRO  61  15.667   2.814  -2.660
  504   2HG   PRO  61          HG3       PRO  61  16.471   4.326  -2.110
  505   1HD   PRO  61          HD2       PRO  61  14.912   2.832  -0.469
  506   2HD   PRO  61          HD3       PRO  61  14.899   4.623  -0.373
  507    H    VAL  62           H        VAL  62  12.320   4.257  -5.226
  508    HA   VAL  62           HA       VAL  62  11.604   1.411  -5.564
  509    HB   VAL  62           HB       VAL  62  10.542   2.264  -7.635
  510   1HG1  VAL  62          HG11      VAL  62   8.674   3.411  -6.533
  511   2HG1  VAL  62          HG12      VAL  62   9.234   2.043  -5.571
  512   3HG1  VAL  62          HG13      VAL  62   9.669   3.700  -5.090
  513   1HG2  VAL  62          HG21      VAL  62  10.258   4.602  -8.079
  514   2HG2  VAL  62          HG22      VAL  62  11.150   5.074  -6.622
  515   3HG2  VAL  62          HG23      VAL  62  11.990   4.291  -7.984
  516    H    GLN  63           H        GLN  63  14.312   3.337  -6.264
  517    HA   GLN  63           HA       GLN  63  15.347   1.475  -8.319
  518   1HB   GLN  63          HB2       GLN  63  14.120   3.211  -9.542
  519   2HB   GLN  63          HB3       GLN  63  14.963   4.489  -8.662
  520   1HG   GLN  63          HG2       GLN  63  17.081   3.874  -9.679
  521   2HG   GLN  63          HG3       GLN  63  16.348   2.466 -10.465
  522   1HE2  GLN  63          HE21      GLN  63  17.718   5.106 -11.460
  523   2HE2  GLN  63          HE22      GLN  63  16.578   5.679 -12.669
  524    H    GLU  64           H        GLU  64  17.585   1.408  -8.398
  525    HA   GLU  64           HA       GLU  64  19.703   1.408  -7.561
  526   1HB   GLU  64          HB2       GLU  64  19.088   4.355  -7.838
  527   2HB   GLU  64          HB3       GLU  64  20.720   3.744  -7.513
  528   1HG   GLU  64          HG2       GLU  64  20.791   2.488  -9.540
  529   2HG   GLU  64          HG3       GLU  64  19.095   2.770  -9.884
  530    H    ALA  65           H        ALA  65  17.894   0.896  -5.473
  531    HA   ALA  65           HA       ALA  65  18.628   2.154  -3.016
  532   1HB   ALA  65          HB1       ALA  65  17.674  -0.692  -3.559
  533   2HB   ALA  65          HB2       ALA  65  17.606   0.163  -2.005
  534   3HB   ALA  65          HB3       ALA  65  16.622   0.728  -3.367
  535    H    GLY  66           H        GLY  66  20.462   0.030  -5.023
  536   1HA   GLY  66          HA2       GLY  66  22.848   0.272  -3.483
  537   2HA   GLY  66          HA3       GLY  66  22.185  -1.354  -3.281
  538    H    GLY  67           H        GLY  67  24.553  -1.393  -4.365
  539   1HA   GLY  67          HA2       GLY  67  25.679  -2.419  -6.084
  540   2HA   GLY  67          HA3       GLY  67  24.151  -2.602  -6.939
  541    H    GLN  68           H        GLN  68  24.780   0.695  -6.268
  542    HA   GLN  68           HA       GLN  68  25.011   1.393  -9.022
  543   1HB   GLN  68          HB2       GLN  68  24.026   2.715  -7.065
  544   2HB   GLN  68          HB3       GLN  68  25.681   3.160  -6.644
  545   1HG   GLN  68          HG2       GLN  68  25.915   4.210  -8.930
  546   2HG   GLN  68          HG3       GLN  68  24.247   3.747  -9.278
  547   1HE2  GLN  68          HE21      GLN  68  22.805   5.479  -8.981
  548   2HE2  GLN  68          HE22      GLN  68  23.066   6.761  -7.811
  549    H    GLY  69           H        GLY  69  27.504   0.611  -6.714
  550   1HA   GLY  69          HA2       GLY  69  29.540   0.228  -8.539
  551   2HA   GLY  69          HA3       GLY  69  29.745   1.914  -8.055
  552    H    GLY  70           H        GLY  70  28.912   1.524  -5.272
  553   1HA   GLY  70          HA2       GLY  70  29.552   0.723  -3.220
  554   2HA   GLY  70          HA3       GLY  70  30.312  -0.647  -4.022
  555    H    GLY  71           H        GLY  71  31.679   2.215  -5.206
  556   1HA   GLY  71          HA2       GLY  71  33.368   3.394  -3.500
  557   2HA   GLY  71          HA3       GLY  71  34.170   1.826  -3.650
  558    H    GLY  72           H        GLY  72  33.374   1.563  -6.525
  559   1HA   GLY  72          HA2       GLY  72  34.270   3.701  -8.169
  560   2HA   GLY  72          HA3       GLY  72  35.662   2.678  -7.814
  Start of MODEL   16
    1   1H    GLY   1           H1       GLY   1   7.380 -14.151   9.305
    2   2H    GLY   1           H2       GLY   1   7.759 -15.741   9.163
    3   3H    GLY   1           H3       GLY   1   6.256 -15.218   8.764
    4   1HA   GLY   1          HA2       GLY   1   7.530 -15.647   6.765
    5   2HA   GLY   1          HA3       GLY   1   7.107 -13.932   6.922
    6    H    SER   2           H        SER   2   9.601 -16.000   6.218
    7    HA   SER   2           HA       SER   2  11.742 -14.090   7.059
    8   1HB   SER   2          HB2       SER   2  11.795 -17.116   7.322
    9   2HB   SER   2          HB3       SER   2  13.151 -16.024   7.640
   10    HG   SER   2           HG       SER   2  11.998 -16.568   9.547
   11    H    HIS   3           H        HIS   3  13.468 -14.856   3.963
   12    HA   HIS   3           HA       HIS   3  14.173 -14.034   6.610
   13   1HB   HIS   3          HB2       HIS   3  15.005 -12.928   3.905
   14   2HB   HIS   3          HB3       HIS   3  15.826 -12.638   5.433
   15    HD1  HIS   3           HD1      HIS   3  16.816 -15.047   6.635
   16    HD2  HIS   3           HD2      HIS   3  15.902 -14.969   2.533
   17    HE1  HIS   3           HE1      HIS   3  18.009 -17.041   5.602
   18    H    MET   4           H        MET   4  11.710 -12.760   4.598
   19    HA   MET   4           HA       MET   4  11.254 -10.565   6.491
   20   1HB   MET   4          HB2       MET   4  10.957  -8.879   4.714
   21   2HB   MET   4          HB3       MET   4  12.616  -9.461   4.784
   22   1HG   MET   4          HG2       MET   4  12.188 -10.949   2.855
   23   2HG   MET   4          HG3       MET   4  10.520 -10.370   2.764
   24   1HE   MET   4          HE1       MET   4   9.750  -8.180   1.643
   25   2HE   MET   4          HE2       MET   4  10.465  -7.343   3.037
   26   3HE   MET   4          HE3       MET   4  10.813  -6.779   1.392
   27    HA   PRO   5           HA       PRO   5   6.954 -11.559   5.261
   28   1HB   PRO   5          HB2       PRO   5   5.615  -9.397   6.190
   29   2HB   PRO   5          HB3       PRO   5   6.354 -10.585   7.305
   30   1HG   PRO   5          HG2       PRO   5   7.512  -7.947   6.367
   31   2HG   PRO   5          HG3       PRO   5   7.354  -8.537   8.055
   32   1HD   PRO   5          HD2       PRO   5   9.663  -8.800   6.609
   33   2HD   PRO   5          HD3       PRO   5   9.146 -10.042   7.787
   34    H    LEU   6           H        LEU   6   5.214 -10.421   3.926
   35    HA   LEU   6           HA       LEU   6   4.510  -9.513   1.972
   36   1HB   LEU   6          HB2       LEU   6   6.324  -7.199   2.724
   37   2HB   LEU   6          HB3       LEU   6   4.901  -7.143   1.683
   38    HG   LEU   6           HG       LEU   6   4.889  -7.689   4.680
   39   1HD1  LEU   6          HD11      LEU   6   3.939  -5.310   3.041
   40   2HD1  LEU   6          HD12      LEU   6   3.780  -5.508   4.804
   41   3HD1  LEU   6          HD13      LEU   6   5.384  -5.359   4.071
   42   1HD2  LEU   6          HD21      LEU   6   3.046  -8.914   3.649
   43   2HD2  LEU   6          HD22      LEU   6   2.405  -7.464   4.428
   44   3HD2  LEU   6          HD23      LEU   6   2.613  -7.502   2.661
   45    H    GLU   7           H        GLU   7   6.984 -11.160   1.707
   46    HA   GLU   7           HA       GLU   7   8.801 -10.161  -0.156
   47   1HB   GLU   7          HB2       GLU   7   9.408 -12.445  -0.608
   48   2HB   GLU   7          HB3       GLU   7   9.087 -12.237   1.112
   49   1HG   GLU   7          HG2       GLU   7   6.824 -13.253   0.801
   50   2HG   GLU   7          HG3       GLU   7   7.169 -13.485  -0.909
   51    H    PHE   8           H        PHE   8   5.524 -11.111  -0.871
   52    HA   PHE   8           HA       PHE   8   5.614 -11.520  -3.663
   53   1HB   PHE   8          HB2       PHE   8   3.507 -10.066  -2.022
   54   2HB   PHE   8          HB3       PHE   8   3.277 -10.757  -3.627
   55    HD1  PHE   8           HD1      PHE   8   3.384 -11.458  -0.033
   56    HD2  PHE   8           HD2      PHE   8   3.358 -13.252  -3.956
   57    HE1  PHE   8           HE1      PHE   8   2.788 -13.646   0.967
   58    HE2  PHE   8           HE2      PHE   8   2.739 -15.434  -2.947
   59    HZ   PHE   8           HZ       PHE   8   2.456 -15.634  -0.486
   60    H    LEU   9           H        LEU   9   5.929  -8.476  -1.861
   61    HA   LEU   9           HA       LEU   9   5.489  -6.719  -4.129
   62   1HB   LEU   9          HB2       LEU   9   6.823  -6.310  -1.423
   63   2HB   LEU   9          HB3       LEU   9   6.519  -5.012  -2.571
   64    HG   LEU   9           HG       LEU   9   4.344  -6.720  -1.280
   65   1HD1  LEU   9          HD11      LEU   9   3.844  -4.736   0.038
   66   2HD1  LEU   9          HD12      LEU   9   5.521  -5.230   0.317
   67   3HD1  LEU   9          HD13      LEU   9   5.177  -3.841  -0.736
   68   1HD2  LEU   9          HD21      LEU   9   4.214  -4.246  -3.062
   69   2HD2  LEU   9          HD22      LEU   9   3.579  -5.863  -3.442
   70   3HD2  LEU   9          HD23      LEU   9   2.836  -4.910  -2.154
   71    H    ARG  10           H        ARG  10   8.138  -8.706  -3.288
   72    HA   ARG  10           HA       ARG  10  10.063  -7.192  -4.991
   73   1HB   ARG  10          HB2       ARG  10  10.386  -9.582  -3.132
   74   2HB   ARG  10          HB3       ARG  10  11.675  -8.940  -4.158
   75   1HG   ARG  10          HG2       ARG  10  11.475  -6.726  -3.021
   76   2HG   ARG  10          HG3       ARG  10  10.213  -7.389  -1.977
   77   1HD   ARG  10          HD2       ARG  10  12.266  -7.395  -0.758
   78   2HD   ARG  10          HD3       ARG  10  11.822  -9.076  -1.116
   79    HE   ARG  10           HE       ARG  10  13.573  -8.105  -3.163
   80   1HH1  ARG  10          HH22      ARG  10  13.779  -8.982   0.228
   81   2HH1  ARG  10          HH21      ARG  10  15.466  -9.432   0.100
   82   1HH2  ARG  10          HH12      ARG  10  15.713  -8.699  -3.256
   83   2HH2  ARG  10          HH11      ARG  10  16.525  -9.267  -1.820
   84    H    ASN  11           H        ASN  11   7.588  -9.121  -5.649
   85    HA   ASN  11           HA       ASN  11   8.901 -10.306  -8.063
   86   1HB   ASN  11          HB2       ASN  11   8.428 -12.050  -6.369
   87   2HB   ASN  11          HB3       ASN  11   6.732 -11.551  -6.324
   88   1HD2  ASN  11          HD21      ASN  11   5.417 -12.857  -7.561
   89   2HD2  ASN  11          HD22      ASN  11   5.957 -13.699  -9.011
   90    H    GLN  12           H        GLN  12   5.894  -8.928  -6.678
   91    HA   GLN  12           HA       GLN  12   4.461  -8.595  -9.140
   92   1HB   GLN  12          HB2       GLN  12   4.468  -7.031  -6.523
   93   2HB   GLN  12          HB3       GLN  12   3.336  -6.734  -7.839
   94   1HG   GLN  12          HG2       GLN  12   3.549  -9.434  -6.449
   95   2HG   GLN  12          HG3       GLN  12   2.469  -8.137  -5.927
   96   1HE2  GLN  12          HE21      GLN  12   0.835  -7.329  -7.537
   97   2HE2  GLN  12          HE22      GLN  12   0.217  -8.491  -8.706
   98    HA   PRO  13           HA       PRO  13   6.902  -5.161 -10.802
   99   1HB   PRO  13          HB2       PRO  13   5.130  -4.195 -12.676
  100   2HB   PRO  13          HB3       PRO  13   6.069  -5.721 -12.872
  101   1HG   PRO  13          HG2       PRO  13   3.196  -5.299 -12.111
  102   2HG   PRO  13          HG3       PRO  13   3.911  -6.574 -13.147
  103   1HD   PRO  13          HD2       PRO  13   3.226  -6.792 -10.472
  104   2HD   PRO  13          HD3       PRO  13   4.400  -7.885 -11.299
  105    H    GLN  14           H        GLN  14   3.716  -4.656  -9.428
  106    HA   GLN  14           HA       GLN  14   3.262  -1.971  -9.759
  107   1HB   GLN  14          HB2       GLN  14   1.688  -2.152  -7.938
  108   2HB   GLN  14          HB3       GLN  14   1.677  -3.637  -8.881
  109   1HG   GLN  14          HG2       GLN  14   3.261  -4.629  -7.100
  110   2HG   GLN  14          HG3       GLN  14   2.941  -3.195  -6.137
  111   1HE2  GLN  14          HE21      GLN  14   0.796  -2.916  -5.211
  112   2HE2  GLN  14          HE22      GLN  14  -0.324  -4.279  -5.175
  113    H    PHE  15           H        PHE  15   5.499  -3.301  -7.375
  114    HA   PHE  15           HA       PHE  15   5.500  -1.157  -5.535
  115   1HB   PHE  15          HB2       PHE  15   7.245  -2.210  -4.498
  116   2HB   PHE  15          HB3       PHE  15   6.499  -3.553  -5.347
  117    HD1  PHE  15           HD1      PHE  15   7.556  -3.944  -7.858
  118    HD2  PHE  15           HD2      PHE  15   9.563  -2.034  -4.553
  119    HE1  PHE  15           HE1      PHE  15   9.743  -4.368  -8.937
  120    HE2  PHE  15           HE2      PHE  15  11.749  -2.455  -5.644
  121    HZ   PHE  15           HZ       PHE  15  11.843  -3.618  -7.838
  122    H    GLN  16           H        GLN  16   7.211  -1.415  -8.656
  123    HA   GLN  16           HA       GLN  16   9.044   0.670  -8.218
  124   1HB   GLN  16          HB2       GLN  16   8.815  -1.426  -9.846
  125   2HB   GLN  16          HB3       GLN  16   7.893  -0.319 -10.852
  126   1HG   GLN  16          HG2       GLN  16  10.117  -0.361 -11.603
  127   2HG   GLN  16          HG3       GLN  16   9.874   1.221 -10.819
  128   1HE2  GLN  16          HE21      GLN  16  11.786  -1.724 -10.819
  129   2HE2  GLN  16          HE22      GLN  16  12.743  -1.320  -9.398
  130    H    GLN  17           H        GLN  17   5.651   0.808  -8.771
  131    HA   GLN  17           HA       GLN  17   5.795   3.633  -9.773
  132   1HB   GLN  17          HB2       GLN  17   3.755   1.462 -10.381
  133   2HB   GLN  17          HB3       GLN  17   3.643   3.156 -10.887
  134   1HG   GLN  17          HG2       GLN  17   5.832   2.880 -12.099
  135   2HG   GLN  17          HG3       GLN  17   5.789   1.156 -11.733
  136   1HE2  GLN  17          HE21      GLN  17   5.418   2.979 -14.326
  137   2HE2  GLN  17          HE22      GLN  17   4.037   2.186 -15.081
  138    H    MET  18           H        MET  18   3.746   1.395  -7.731
  139    HA   MET  18           HA       MET  18   1.921   3.405  -7.003
  140   1HB   MET  18          HB2       MET  18   1.115   1.874  -5.411
  141   2HB   MET  18          HB3       MET  18   1.588   0.976  -6.850
  142   1HG   MET  18          HG2       MET  18   3.760   0.376  -5.662
  143   2HG   MET  18          HG3       MET  18   3.118   1.169  -4.219
  144   1HE   MET  18          HE1       MET  18   3.236  -0.670  -2.553
  145   2HE   MET  18          HE2       MET  18   2.775  -2.357  -2.855
  146   3HE   MET  18          HE3       MET  18   4.154  -1.646  -3.725
  147    H    ARG  19           H        ARG  19   5.003   2.618  -5.456
  148    HA   ARG  19           HA       ARG  19   4.637   4.313  -3.122
  149   1HB   ARG  19          HB2       ARG  19   7.230   3.338  -4.409
  150   2HB   ARG  19          HB3       ARG  19   6.986   3.860  -2.735
  151   1HG   ARG  19          HG2       ARG  19   5.286   1.961  -2.526
  152   2HG   ARG  19          HG3       ARG  19   5.836   1.358  -4.069
  153   1HD   ARG  19          HD2       ARG  19   7.789   1.835  -1.798
  154   2HD   ARG  19          HD3       ARG  19   6.990   0.273  -2.085
  155    HE   ARG  19           HE       ARG  19   7.974   0.666  -4.511
  156   1HH1  ARG  19          HH22      ARG  19   9.806   1.239  -1.550
  157   2HH1  ARG  19          HH21      ARG  19  11.300   1.323  -2.471
  158   1HH2  ARG  19          HH12      ARG  19   9.943   0.501  -5.465
  159   2HH2  ARG  19          HH11      ARG  19  11.375   0.871  -4.514
  160    H    GLN  20           H        GLN  20   5.560   4.977  -6.378
  161    HA   GLN  20           HA       GLN  20   6.731   7.628  -5.932
  162   1HB   GLN  20          HB2       GLN  20   5.244   6.717  -8.420
  163   2HB   GLN  20          HB3       GLN  20   6.300   8.097  -8.231
  164   1HG   GLN  20          HG2       GLN  20   8.208   6.500  -7.703
  165   2HG   GLN  20          HG3       GLN  20   7.126   5.171  -8.142
  166   1HE2  GLN  20          HE21      GLN  20   8.136   4.447 -10.082
  167   2HE2  GLN  20          HE22      GLN  20   8.369   5.515 -11.463
  168    H    ILE  21           H        ILE  21   3.443   6.345  -6.183
  169    HA   ILE  21           HA       ILE  21   2.143   8.873  -6.515
  170    HB   ILE  21           HB       ILE  21   0.931   6.329  -5.327
  171   1HG1  ILE  21          HG12      ILE  21   1.398   7.064  -8.229
  172   2HG1  ILE  21          HG13      ILE  21   2.101   5.698  -7.371
  173   1HG2  ILE  21          HG21      ILE  21  -1.159   7.214  -6.234
  174   2HG2  ILE  21          HG22      ILE  21  -0.423   8.416  -5.181
  175   3HG2  ILE  21          HG23      ILE  21  -0.294   8.599  -6.945
  176   1HD1  ILE  21          HD11      ILE  21  -0.814   5.952  -8.135
  177   2HD1  ILE  21          HD12      ILE  21   0.401   4.813  -8.747
  178   3HD1  ILE  21          HD13      ILE  21  -0.143   4.685  -7.068
  179    H    ILE  22           H        ILE  22   2.977   6.824  -3.757
  180    HA   ILE  22           HA       ILE  22   1.384   8.323  -1.834
  181    HB   ILE  22           HB       ILE  22   3.499   6.191  -1.341
  182   1HG1  ILE  22          HG12      ILE  22   1.941   5.026  -2.633
  183   2HG1  ILE  22          HG13      ILE  22   1.438   4.694  -0.993
  184   1HG2  ILE  22          HG21      ILE  22   1.260   7.233   0.443
  185   2HG2  ILE  22          HG22      ILE  22   2.287   5.826   0.793
  186   3HG2  ILE  22          HG23      ILE  22   3.008   7.431   0.696
  187   1HD1  ILE  22          HD11      ILE  22  -0.559   5.118  -2.192
  188   2HD1  ILE  22          HD12      ILE  22  -0.261   6.613  -1.273
  189   3HD1  ILE  22          HD13      ILE  22   0.108   6.541  -3.007
  190    H    GLN  23           H        GLN  23   4.843   8.196  -2.614
  191    HA   GLN  23           HA       GLN  23   5.735   9.783  -0.436
  192   1HB   GLN  23          HB2       GLN  23   7.809   9.659  -1.464
  193   2HB   GLN  23          HB3       GLN  23   6.920   8.193  -1.963
  194   1HG   GLN  23          HG2       GLN  23   6.454   9.243  -4.159
  195   2HG   GLN  23          HG3       GLN  23   7.418  10.657  -3.682
  196   1HE2  GLN  23          HE21      GLN  23   7.760   7.053  -3.723
  197   2HE2  GLN  23          HE22      GLN  23   9.427   7.092  -4.316
  198    H    GLN  24           H        GLN  24   4.034  10.713  -3.123
  199    HA   GLN  24           HA       GLN  24   4.665  13.650  -2.839
  200   1HB   GLN  24          HB2       GLN  24   3.224  12.282  -5.144
  201   2HB   GLN  24          HB3       GLN  24   3.766  13.964  -5.058
  202   1HG   GLN  24          HG2       GLN  24   6.130  13.132  -4.947
  203   2HG   GLN  24          HG3       GLN  24   5.500  11.479  -5.104
  204   1HE2  GLN  24          HE21      GLN  24   4.932  10.715  -7.161
  205   2HE2  GLN  24          HE22      GLN  24   5.095  11.686  -8.626
  206    H    ASN  25           H        ASN  25   2.042  11.295  -3.060
  207    HA   ASN  25           HA       ASN  25   0.214  13.147  -1.596
  208   1HB   ASN  25          HB2       ASN  25  -0.256  11.682  -4.171
  209   2HB   ASN  25          HB3       ASN  25  -1.583  11.767  -3.009
  210   1HD2  ASN  25          HD21      ASN  25  -2.106  13.915  -2.069
  211   2HD2  ASN  25          HD22      ASN  25  -2.033  15.278  -3.187
  212    HA   PRO  26           HA       PRO  26   0.561   9.278   0.874
  213   1HB   PRO  26          HB2       PRO  26   0.573  10.446   3.342
  214   2HB   PRO  26          HB3       PRO  26   2.040  10.275   2.331
  215   1HG   PRO  26          HG2       PRO  26   0.225  12.692   2.555
  216   2HG   PRO  26          HG3       PRO  26   2.016  12.638   2.711
  217   1HD   PRO  26          HD2       PRO  26   0.791  13.325   0.413
  218   2HD   PRO  26          HD3       PRO  26   2.272  12.315   0.374
  219    H    SER  27           H        SER  27  -1.669  11.959   0.722
  220    HA   SER  27           HA       SER  27  -3.930  10.936   2.105
  221   1HB   SER  27          HB2       SER  27  -5.189  12.342   0.451
  222   2HB   SER  27          HB3       SER  27  -3.906  13.191   1.321
  223    HG   SER  27           HG       SER  27  -4.028  13.508  -1.021
  224    H    LEU  28           H        LEU  28  -2.407   9.750  -0.811
  225    HA   LEU  28           HA       LEU  28  -4.776   8.081  -1.478
  226   1HB   LEU  28          HB2       LEU  28  -2.225   8.606  -3.042
  227   2HB   LEU  28          HB3       LEU  28  -3.586   7.620  -3.576
  228    HG   LEU  28           HG       LEU  28  -3.580  10.632  -3.149
  229   1HD1  LEU  28          HD11      LEU  28  -4.062  10.640  -5.567
  230   2HD1  LEU  28          HD12      LEU  28  -2.550   9.779  -5.231
  231   3HD1  LEU  28          HD13      LEU  28  -4.032   8.861  -5.584
  232   1HD2  LEU  28          HD21      LEU  28  -5.916   8.816  -3.902
  233   2HD2  LEU  28          HD22      LEU  28  -5.789   9.837  -2.447
  234   3HD2  LEU  28          HD23      LEU  28  -5.904  10.590  -4.036
  235    H    LEU  29           H        LEU  29  -2.298   7.674   0.644
  236    HA   LEU  29           HA       LEU  29  -1.488   4.980   0.112
  237   1HB   LEU  29          HB2       LEU  29  -0.381   6.372   1.735
  238   2HB   LEU  29          HB3       LEU  29  -1.801   6.532   2.715
  239    HG   LEU  29           HG       LEU  29  -1.764   4.159   3.317
  240   1HD1  LEU  29          HD11      LEU  29   0.212   2.754   2.704
  241   2HD1  LEU  29          HD12      LEU  29  -0.813   3.123   1.313
  242   3HD1  LEU  29          HD13      LEU  29   0.711   4.012   1.544
  243   1HD2  LEU  29          HD21      LEU  29   0.970   5.469   3.628
  244   2HD2  LEU  29          HD22      LEU  29  -0.452   5.774   4.650
  245   3HD2  LEU  29          HD23      LEU  29   0.302   4.172   4.644
  246    HA   PRO  30           HA       PRO  30  -5.677   3.681   2.438
  247   1HB   PRO  30          HB2       PRO  30  -7.264   6.044   1.420
  248   2HB   PRO  30          HB3       PRO  30  -7.473   5.126   2.923
  249   1HG   PRO  30          HG2       PRO  30  -6.283   7.621   2.632
  250   2HG   PRO  30          HG3       PRO  30  -5.950   6.509   4.011
  251   1HD   PRO  30          HD2       PRO  30  -4.200   7.291   1.796
  252   2HD   PRO  30          HD3       PRO  30  -3.795   6.379   3.267
  253    H    ALA  31           H        ALA  31  -5.729   5.728  -0.412
  254    HA   ALA  31           HA       ALA  31  -7.529   4.160  -1.980
  255   1HB   ALA  31          HB1       ALA  31  -7.088   6.604  -2.100
  256   2HB   ALA  31          HB2       ALA  31  -5.544   6.243  -2.913
  257   3HB   ALA  31          HB3       ALA  31  -7.075   5.752  -3.670
  258    H    LEU  32           H        LEU  32  -4.168   3.587  -1.300
  259    HA   LEU  32           HA       LEU  32  -3.796   1.935  -3.755
  260   1HB   LEU  32          HB2       LEU  32  -1.996   3.478  -3.142
  261   2HB   LEU  32          HB3       LEU  32  -1.982   2.797  -1.498
  262    HG   LEU  32           HG       LEU  32  -1.100   0.699  -2.289
  263   1HD1  LEU  32          HD11      LEU  32  -2.213   0.503  -4.469
  264   2HD1  LEU  32          HD12      LEU  32  -1.282   1.887  -5.092
  265   3HD1  LEU  32          HD13      LEU  32  -0.474   0.353  -4.664
  266   1HD2  LEU  32          HD21      LEU  32   0.422   3.028  -3.536
  267   2HD2  LEU  32          HD22      LEU  32   0.441   2.579  -1.819
  268   3HD2  LEU  32          HD23      LEU  32   1.119   1.479  -3.027
  269    H    LEU  33           H        LEU  33  -3.864   1.777  -0.177
  270    HA   LEU  33           HA       LEU  33  -3.645  -1.039   0.141
  271   1HB   LEU  33          HB2       LEU  33  -5.172   1.077   1.697
  272   2HB   LEU  33          HB3       LEU  33  -4.934  -0.583   2.255
  273    HG   LEU  33           HG       LEU  33  -2.500   1.073   1.522
  274   1HD1  LEU  33          HD11      LEU  33  -4.022   1.211   4.148
  275   2HD1  LEU  33          HD12      LEU  33  -2.388   1.863   3.851
  276   3HD1  LEU  33          HD13      LEU  33  -3.774   2.523   2.965
  277   1HD2  LEU  33          HD21      LEU  33  -3.018  -1.098   3.595
  278   2HD2  LEU  33          HD22      LEU  33  -2.235  -1.329   2.016
  279   3HD2  LEU  33          HD23      LEU  33  -1.458  -0.320   3.250
  280    H    GLN  34           H        GLN  34  -6.643   0.974  -0.370
  281    HA   GLN  34           HA       GLN  34  -8.275  -1.407  -0.526
  282   1HB   GLN  34          HB2       GLN  34 -10.093  -0.022  -1.052
  283   2HB   GLN  34          HB3       GLN  34  -9.108   0.833   0.128
  284   1HG   GLN  34          HG2       GLN  34  -8.058   2.056  -1.906
  285   2HG   GLN  34          HG3       GLN  34  -9.382   1.379  -2.857
  286   1HE2  GLN  34          HE21      GLN  34  -8.757   3.291   0.130
  287   2HE2  GLN  34          HE22      GLN  34 -10.229   4.258  -0.003
  288    H    GLN  35           H        GLN  35  -6.143   0.037  -2.893
  289    HA   GLN  35           HA       GLN  35  -7.525  -1.202  -5.182
  290   1HB   GLN  35          HB2       GLN  35  -6.460   0.911  -5.553
  291   2HB   GLN  35          HB3       GLN  35  -4.940   0.369  -4.827
  292   1HG   GLN  35          HG2       GLN  35  -4.497  -1.130  -6.636
  293   2HG   GLN  35          HG3       GLN  35  -6.095  -0.837  -7.357
  294   1HE2  GLN  35          HE21      GLN  35  -2.803   0.398  -7.017
  295   2HE2  GLN  35          HE22      GLN  35  -3.045   1.784  -8.080
  296    H    ILE  36           H        ILE  36  -4.671  -1.859  -3.107
  297    HA   ILE  36           HA       ILE  36  -3.960  -4.364  -4.317
  298    HB   ILE  36           HB       ILE  36  -3.683  -3.429  -1.462
  299   1HG1  ILE  36          HG12      ILE  36  -1.473  -3.617  -3.542
  300   2HG1  ILE  36          HG13      ILE  36  -2.469  -2.168  -3.448
  301   1HG2  ILE  36          HG21      ILE  36  -1.897  -5.260  -1.357
  302   2HG2  ILE  36          HG22      ILE  36  -3.515  -5.913  -1.564
  303   3HG2  ILE  36          HG23      ILE  36  -2.434  -5.820  -2.951
  304   1HD1  ILE  36          HD11      ILE  36  -0.487  -1.799  -2.155
  305   2HD1  ILE  36          HD12      ILE  36  -1.875  -1.904  -1.046
  306   3HD1  ILE  36          HD13      ILE  36  -0.754  -3.280  -1.213
  307    H    GLY  37           H        GLY  37  -6.419  -3.518  -1.779
  308   1HA   GLY  37          HA2       GLY  37  -7.532  -6.064  -1.431
  309   2HA   GLY  37          HA3       GLY  37  -8.399  -4.537  -1.295
  310    H    ARG  38           H        ARG  38  -7.625  -4.286  -4.422
  311    HA   ARG  38           HA       ARG  38  -9.828  -6.001  -5.508
  312   1HB   ARG  38          HB2       ARG  38  -8.265  -3.794  -6.917
  313   2HB   ARG  38          HB3       ARG  38  -9.674  -4.660  -7.513
  314   1HG   ARG  38          HG2       ARG  38 -11.026  -3.668  -5.623
  315   2HG   ARG  38          HG3       ARG  38  -9.591  -2.753  -5.142
  316   1HD   ARG  38          HD2       ARG  38 -10.970  -1.290  -6.420
  317   2HD   ARG  38          HD3       ARG  38  -9.526  -1.668  -7.369
  318    HE   ARG  38           HE       ARG  38 -11.704  -3.471  -8.001
  319   1HH1  ARG  38          HH22      ARG  38 -10.665  -0.185  -8.664
  320   2HH1  ARG  38          HH21      ARG  38 -11.532  -0.123 -10.183
  321   1HH2  ARG  38          HH12      ARG  38 -12.775  -3.326  -9.944
  322   2HH2  ARG  38          HH11      ARG  38 -12.696  -1.854 -10.877
  323    H    GLU  39           H        GLU  39  -6.377  -5.204  -6.099
  324    HA   GLU  39           HA       GLU  39  -6.061  -7.113  -8.222
  325   1HB   GLU  39          HB2       GLU  39  -4.207  -5.366  -6.565
  326   2HB   GLU  39          HB3       GLU  39  -3.650  -6.371  -7.902
  327   1HG   GLU  39          HG2       GLU  39  -5.733  -4.154  -8.143
  328   2HG   GLU  39          HG3       GLU  39  -4.023  -4.003  -8.532
  329    H    ASN  40           H        ASN  40  -5.247  -7.167  -4.773
  330    HA   ASN  40           HA       ASN  40  -4.859 -10.044  -4.759
  331   1HB   ASN  40          HB2       ASN  40  -2.581  -8.992  -5.412
  332   2HB   ASN  40          HB3       ASN  40  -2.523  -8.347  -3.789
  333   1HD2  ASN  40          HD21      ASN  40  -0.790 -10.398  -5.096
  334   2HD2  ASN  40          HD22      ASN  40  -0.960 -11.836  -4.088
  335    HA   PRO  41           HA       PRO  41  -6.837  -8.082  -0.988
  336   1HB   PRO  41          HB2       PRO  41  -8.793 -10.009  -0.619
  337   2HB   PRO  41          HB3       PRO  41  -8.954  -8.553  -1.650
  338   1HG   PRO  41          HG2       PRO  41  -8.142 -11.331  -2.504
  339   2HG   PRO  41          HG3       PRO  41  -9.400 -10.273  -3.234
  340   1HD   PRO  41          HD2       PRO  41  -6.953 -10.395  -4.315
  341   2HD   PRO  41          HD3       PRO  41  -7.736  -8.798  -4.121
  342    H    GLN  42           H        GLN  42  -5.359 -11.176  -1.608
  343    HA   GLN  42           HA       GLN  42  -5.176 -11.996   1.206
  344   1HB   GLN  42          HB2       GLN  42  -3.617 -12.932  -1.226
  345   2HB   GLN  42          HB3       GLN  42  -3.724 -13.745   0.347
  346   1HG   GLN  42          HG2       GLN  42  -6.222 -13.911   0.001
  347   2HG   GLN  42          HG3       GLN  42  -5.996 -13.307  -1.640
  348   1HE2  GLN  42          HE21      GLN  42  -7.173 -15.872  -1.034
  349   2HE2  GLN  42          HE22      GLN  42  -6.076 -17.092  -1.669
  350    H    LEU  43           H        LEU  43  -3.006 -10.408  -1.200
  351    HA   LEU  43           HA       LEU  43  -0.840  -9.961   0.653
  352   1HB   LEU  43          HB2       LEU  43  -0.770  -9.753  -1.907
  353   2HB   LEU  43          HB3       LEU  43  -1.669  -8.247  -1.724
  354    HG   LEU  43           HG       LEU  43   0.128  -7.167  -0.605
  355   1HD1  LEU  43          HD11      LEU  43   1.535  -9.867  -0.565
  356   2HD1  LEU  43          HD12      LEU  43   2.345  -8.314  -0.235
  357   3HD1  LEU  43          HD13      LEU  43   1.063  -8.875   0.836
  358   1HD2  LEU  43          HD21      LEU  43   0.262  -7.313  -3.059
  359   2HD2  LEU  43          HD22      LEU  43   1.877  -7.275  -2.333
  360   3HD2  LEU  43          HD23      LEU  43   1.213  -8.810  -2.930
  361    H    LEU  44           H        LEU  44  -3.882  -8.327  -0.018
  362    HA   LEU  44           HA       LEU  44  -3.233  -5.861   1.320
  363   1HB   LEU  44          HB2       LEU  44  -5.187  -6.312  -0.264
  364   2HB   LEU  44          HB3       LEU  44  -6.011  -7.104   1.037
  365    HG   LEU  44           HG       LEU  44  -6.384  -4.553   0.385
  366   1HD1  LEU  44          HD11      LEU  44  -6.508  -5.484   3.253
  367   2HD1  LEU  44          HD12      LEU  44  -7.400  -4.134   2.497
  368   3HD1  LEU  44          HD13      LEU  44  -7.713  -5.787   1.966
  369   1HD2  LEU  44          HD21      LEU  44  -4.104  -3.745   0.956
  370   2HD2  LEU  44          HD22      LEU  44  -5.379  -2.961   1.900
  371   3HD2  LEU  44          HD23      LEU  44  -4.382  -4.200   2.659
  372    H    GLN  45           H        GLN  45  -5.228  -8.553   2.405
  373    HA   GLN  45           HA       GLN  45  -5.379  -8.007   5.170
  374   1HB   GLN  45          HB2       GLN  45  -5.276 -10.641   3.668
  375   2HB   GLN  45          HB3       GLN  45  -5.554 -10.553   5.411
  376   1HG   GLN  45          HG2       GLN  45  -7.573  -9.272   5.142
  377   2HG   GLN  45          HG3       GLN  45  -7.283  -9.032   3.416
  378   1HE2  GLN  45          HE21      GLN  45  -7.494 -10.859   1.972
  379   2HE2  GLN  45          HE22      GLN  45  -8.487 -12.244   2.445
  380    H    GLN  46           H        GLN  46  -2.616  -9.514   3.444
  381    HA   GLN  46           HA       GLN  46  -1.073 -10.001   5.863
  382   1HB   GLN  46          HB2       GLN  46  -0.472  -9.909   2.893
  383   2HB   GLN  46          HB3       GLN  46   0.818 -10.053   4.081
  384   1HG   GLN  46          HG2       GLN  46  -0.178 -12.088   5.012
  385   2HG   GLN  46          HG3       GLN  46  -1.585 -11.938   3.966
  386   1HE2  GLN  46          HE21      GLN  46  -1.304 -12.221   1.654
  387   2HE2  GLN  46          HE22      GLN  46   0.065 -13.168   1.041
  388    H    ILE  47           H        ILE  47  -1.104  -7.270   3.503
  389    HA   ILE  47           HA       ILE  47   0.891  -5.698   4.807
  390    HB   ILE  47           HB       ILE  47  -1.410  -5.056   2.965
  391   1HG1  ILE  47          HG12      ILE  47   1.621  -4.802   2.683
  392   2HG1  ILE  47          HG13      ILE  47   0.724  -6.255   2.228
  393   1HG2  ILE  47          HG21      ILE  47   0.525  -3.082   4.253
  394   2HG2  ILE  47          HG22      ILE  47  -0.451  -2.725   2.815
  395   3HG2  ILE  47          HG23      ILE  47  -1.250  -3.061   4.344
  396   1HD1  ILE  47          HD11      ILE  47   0.413  -3.520   0.960
  397   2HD1  ILE  47          HD12      ILE  47   1.137  -4.975   0.253
  398   3HD1  ILE  47          HD13      ILE  47  -0.606  -4.942   0.612
  399    H    SER  48           H        SER  48  -2.604  -6.073   5.528
  400    HA   SER  48           HA       SER  48  -2.627  -4.094   7.631
  401   1HB   SER  48          HB2       SER  48  -4.370  -6.566   7.296
  402   2HB   SER  48          HB3       SER  48  -4.655  -5.249   8.444
  403    HG   SER  48           HG       SER  48  -5.833  -4.944   6.518
  404    H    GLN  49           H        GLN  49  -1.670  -7.516   7.630
  405    HA   GLN  49           HA       GLN  49  -1.258  -7.691  10.511
  406   1HB   GLN  49          HB2       GLN  49  -0.508  -9.437   8.137
  407   2HB   GLN  49          HB3       GLN  49  -0.072  -9.844   9.796
  408   1HG   GLN  49          HG2       GLN  49  -2.409  -9.894  10.476
  409   2HG   GLN  49          HG3       GLN  49  -2.948  -9.388   8.880
  410   1HE2  GLN  49          HE21      GLN  49  -3.204 -12.011  10.628
  411   2HE2  GLN  49          HE22      GLN  49  -2.855 -13.252   9.426
  412    H    HIS  50           H        HIS  50   0.631  -6.371   7.938
  413    HA   HIS  50           HA       HIS  50   3.083  -6.228   9.641
  414   1HB   HIS  50          HB2       HIS  50   2.923  -6.891   6.678
  415   2HB   HIS  50          HB3       HIS  50   4.406  -6.732   7.625
  416    HD1  HIS  50           HD1      HIS  50   4.196  -8.620   9.953
  417    HD2  HIS  50           HD2      HIS  50   2.423  -9.388   6.221
  418    HE1  HIS  50           HE1      HIS  50   3.871 -11.139   9.821
  419    H    GLN  51           H        GLN  51   1.029  -4.166   9.219
  420    HA   GLN  51           HA       GLN  51   1.476  -2.541   7.062
  421   1HB   GLN  51          HB2       GLN  51  -0.438  -2.632   8.801
  422   2HB   GLN  51          HB3       GLN  51   0.507  -1.447   9.719
  423   1HG   GLN  51          HG2       GLN  51   0.472   0.050   7.691
  424   2HG   GLN  51          HG3       GLN  51  -0.461  -1.190   6.841
  425   1HE2  GLN  51          HE21      GLN  51  -2.617  -0.567   6.714
  426   2HE2  GLN  51          HE22      GLN  51  -3.479   0.243   8.021
  427    H    GLU  52           H        GLU  52   3.214  -2.274  10.164
  428    HA   GLU  52           HA       GLU  52   4.571   0.205   9.548
  429   1HB   GLU  52          HB2       GLU  52   5.350  -2.102  11.374
  430   2HB   GLU  52          HB3       GLU  52   6.194  -0.551  11.283
  431   1HG   GLU  52          HG2       GLU  52   4.085   0.622  11.916
  432   2HG   GLU  52          HG3       GLU  52   3.284  -0.934  12.098
  433    H    HIS  53           H        HIS  53   5.294  -3.197   8.737
  434    HA   HIS  53           HA       HIS  53   7.925  -2.638   7.637
  435   1HB   HIS  53          HB2       HIS  53   6.998  -4.884   8.506
  436   2HB   HIS  53          HB3       HIS  53   6.169  -5.017   6.958
  437    HD1  HIS  53           HD1      HIS  53   9.586  -5.391   8.536
  438    HD2  HIS  53           HD2      HIS  53   7.832  -5.214   4.720
  439    HE1  HIS  53           HE1      HIS  53  11.344  -6.236   6.901
  440    H    PHE  54           H        PHE  54   4.614  -2.929   6.269
  441    HA   PHE  54           HA       PHE  54   5.326  -2.345   3.528
  442   1HB   PHE  54          HB2       PHE  54   3.104  -3.242   4.287
  443   2HB   PHE  54          HB3       PHE  54   2.762  -1.686   5.038
  444    HD1  PHE  54           HD1      PHE  54   1.327  -0.291   3.794
  445    HD2  PHE  54           HD2      PHE  54   3.982  -2.964   1.699
  446    HE1  PHE  54           HE1      PHE  54   0.381   0.461   1.624
  447    HE2  PHE  54           HE2      PHE  54   3.051  -2.193  -0.464
  448    HZ   PHE  54           HZ       PHE  54   1.246  -0.478  -0.506
  449    H    ILE  55           H        ILE  55   4.382  -0.088   6.150
  450    HA   ILE  55           HA       ILE  55   4.775   2.293   4.655
  451    HB   ILE  55           HB       ILE  55   4.694   1.623   7.543
  452   1HG1  ILE  55          HG12      ILE  55   2.994   3.374   5.701
  453   2HG1  ILE  55          HG13      ILE  55   2.682   1.665   6.013
  454   1HG2  ILE  55          HG21      ILE  55   5.224   4.413   6.409
  455   2HG2  ILE  55          HG22      ILE  55   4.787   4.053   8.094
  456   3HG2  ILE  55          HG23      ILE  55   6.321   3.485   7.458
  457   1HD1  ILE  55          HD11      ILE  55   1.216   2.940   7.382
  458   2HD1  ILE  55          HD12      ILE  55   2.428   2.174   8.437
  459   3HD1  ILE  55          HD13      ILE  55   2.548   3.912   8.036
  460    H    GLN  56           H        GLN  56   7.234   0.300   6.397
  461    HA   GLN  56           HA       GLN  56   9.369   2.157   5.744
  462   1HB   GLN  56          HB2       GLN  56   9.344  -0.717   6.710
  463   2HB   GLN  56          HB3       GLN  56  10.840   0.133   6.321
  464   1HG   GLN  56          HG2       GLN  56   8.807   1.168   8.349
  465   2HG   GLN  56          HG3       GLN  56  10.208   0.186   8.758
  466   1HE2  GLN  56          HE21      GLN  56  12.272   1.206   8.907
  467   2HE2  GLN  56          HE22      GLN  56  12.470   2.931   8.620
  468    H    MET  57           H        MET  57   8.253  -0.848   4.046
  469    HA   MET  57           HA       MET  57  10.183  -0.614   1.915
  470   1HB   MET  57          HB2       MET  57   7.379  -1.818   1.958
  471   2HB   MET  57          HB3       MET  57   8.510  -1.951   0.600
  472   1HG   MET  57          HG2       MET  57  10.143  -3.099   2.062
  473   2HG   MET  57          HG3       MET  57   9.020  -2.982   3.412
  474   1HE   MET  57          HE1       MET  57   8.458  -4.077  -0.479
  475   2HE   MET  57          HE2       MET  57  10.016  -4.685   0.127
  476   3HE   MET  57          HE3       MET  57   8.697  -5.820  -0.221
  477    H    LEU  58           H        LEU  58   7.081   0.949   2.459
  478    HA   LEU  58           HA       LEU  58   6.816   2.413   0.025
  479   1HB   LEU  58          HB2       LEU  58   5.736   2.313   2.777
  480   2HB   LEU  58          HB3       LEU  58   5.662   3.932   2.070
  481    HG   LEU  58           HG       LEU  58   4.550   1.424   0.740
  482   1HD1  LEU  58          HD11      LEU  58   2.362   2.226   1.575
  483   2HD1  LEU  58          HD12      LEU  58   3.444   1.813   2.916
  484   3HD1  LEU  58          HD13      LEU  58   3.176   3.513   2.502
  485   1HD2  LEU  58          HD21      LEU  58   3.292   3.077  -0.600
  486   2HD2  LEU  58          HD22      LEU  58   4.064   4.406   0.317
  487   3HD2  LEU  58          HD23      LEU  58   5.036   3.387  -0.745
  488    H    ASN  59           H        ASN  59   8.612   3.093   2.994
  489    HA   ASN  59           HA       ASN  59   9.455   5.779   2.217
  490   1HB   ASN  59          HB2       ASN  59  10.218   3.881   4.478
  491   2HB   ASN  59          HB3       ASN  59  10.969   5.455   4.261
  492   1HD2  ASN  59          HD21      ASN  59   9.466   4.627   6.593
  493   2HD2  ASN  59          HD22      ASN  59   8.114   5.750   6.680
  494    H    GLU  60           H        GLU  60  10.816   2.538   1.793
  495    HA   GLU  60           HA       GLU  60  13.453   3.284   0.971
  496   1HB   GLU  60          HB2       GLU  60  11.643   0.966   0.180
  497   2HB   GLU  60          HB3       GLU  60  13.297   1.135  -0.402
  498   1HG   GLU  60          HG2       GLU  60  14.021   1.238   2.049
  499   2HG   GLU  60          HG3       GLU  60  12.390   0.714   2.462
  500    HA   PRO  61           HA       PRO  61  12.762   5.231  -2.952
  501   1HB   PRO  61          HB2       PRO  61  15.072   4.746  -4.324
  502   2HB   PRO  61          HB3       PRO  61  14.993   5.786  -2.868
  503   1HG   PRO  61          HG2       PRO  61  15.754   2.861  -3.049
  504   2HG   PRO  61          HG3       PRO  61  16.654   4.189  -2.236
  505   1HD   PRO  61          HD2       PRO  61  14.999   2.518  -0.884
  506   2HD   PRO  61          HD3       PRO  61  15.108   4.254  -0.455
  507    H    VAL  62           H        VAL  62  12.601   4.950  -5.292
  508    HA   VAL  62           HA       VAL  62  12.010   2.216  -6.310
  509    HB   VAL  62           HB       VAL  62  11.007   3.508  -8.198
  510   1HG1  VAL  62          HG11      VAL  62   9.794   4.044  -5.455
  511   2HG1  VAL  62          HG12      VAL  62   8.940   4.134  -7.010
  512   3HG1  VAL  62          HG13      VAL  62   9.575   2.586  -6.455
  513   1HG2  VAL  62          HG21      VAL  62  11.181   5.967  -6.414
  514   2HG2  VAL  62          HG22      VAL  62  12.211   5.680  -7.836
  515   3HG2  VAL  62          HG23      VAL  62  10.464   5.832  -8.028
  516    H    GLN  63           H        GLN  63  12.623   2.012  -8.693
  517    HA   GLN  63           HA       GLN  63  15.304   3.173  -9.323
  518   1HB   GLN  63          HB2       GLN  63  14.447   0.261  -9.556
  519   2HB   GLN  63          HB3       GLN  63  15.969   0.931 -10.144
  520   1HG   GLN  63          HG2       GLN  63  16.583   1.579  -7.823
  521   2HG   GLN  63          HG3       GLN  63  15.109   0.817  -7.219
  522   1HE2  GLN  63          HE21      GLN  63  18.250   0.206  -7.134
  523   2HE2  GLN  63          HE22      GLN  63  18.240  -1.532  -7.408
  524    H    GLU  64           H        GLU  64  15.918   2.897 -11.594
  525    HA   GLU  64           HA       GLU  64  13.791   2.626 -13.600
  526   1HB   GLU  64          HB2       GLU  64  14.227   4.903 -14.536
  527   2HB   GLU  64          HB3       GLU  64  13.382   4.862 -13.001
  528   1HG   GLU  64          HG2       GLU  64  14.925   6.696 -13.017
  529   2HG   GLU  64          HG3       GLU  64  15.386   5.541 -11.787
  530    H    ALA  65           H        ALA  65  14.781   3.281 -15.850
  531    HA   ALA  65           HA       ALA  65  17.494   2.077 -16.130
  532   1HB   ALA  65          HB1       ALA  65  16.598   0.566 -17.841
  533   2HB   ALA  65          HB2       ALA  65  15.741   0.331 -16.312
  534   3HB   ALA  65          HB3       ALA  65  14.971   1.248 -17.627
  535    H    GLY  66           H        GLY  66  16.559   4.892 -16.409
  536   1HA   GLY  66          HA2       GLY  66  17.092   5.441 -19.313
  537   2HA   GLY  66          HA3       GLY  66  16.171   6.477 -18.224
  538    H    GLY  67           H        GLY  67  18.415   5.761 -16.128
  539   1HA   GLY  67          HA2       GLY  67  20.820   7.124 -17.150
  540   2HA   GLY  67          HA3       GLY  67  19.884   8.001 -15.937
  541    H    GLN  68           H        GLN  68  21.965   7.835 -14.792
  542    HA   GLN  68           HA       GLN  68  22.143   5.363 -13.106
  543   1HB   GLN  68          HB2       GLN  68  24.450   6.986 -14.256
  544   2HB   GLN  68          HB3       GLN  68  24.605   5.682 -13.075
  545   1HG   GLN  68          HG2       GLN  68  23.618   4.080 -14.715
  546   2HG   GLN  68          HG3       GLN  68  23.530   5.378 -15.907
  547   1HE2  GLN  68          HE21      GLN  68  25.102   4.876 -17.444
  548   2HE2  GLN  68          HE22      GLN  68  26.767   4.488 -17.028
  549    H    GLY  69           H        GLY  69  21.317   8.535 -12.963
  550   1HA   GLY  69          HA2       GLY  69  21.270   8.819 -10.190
  551   2HA   GLY  69          HA3       GLY  69  22.786   9.561 -10.711
  552    H    GLY  70           H        GLY  70  21.316  11.301  -9.555
  553   1HA   GLY  70          HA2       GLY  70  21.022  13.469 -11.136
  554   2HA   GLY  70          HA3       GLY  70  19.437  12.719 -11.338
  555    H    GLY  71           H        GLY  71  19.418  11.736  -8.491
  556   1HA   GLY  71          HA2       GLY  71  19.654  13.853  -6.606
  557   2HA   GLY  71          HA3       GLY  71  18.017  13.871  -7.261
  558    H    GLY  72           H        GLY  72  17.872  13.513  -4.777
  559   1HA   GLY  72          HA2       GLY  72  16.789  10.906  -4.258
  560   2HA   GLY  72          HA3       GLY  72  18.360  11.060  -3.472
  Start of MODEL   17
    1   1H    GLY   1           H1       GLY   1  17.375 -16.017   1.442
    2   2H    GLY   1           H2       GLY   1  16.783 -15.244   0.120
    3   3H    GLY   1           H3       GLY   1  17.448 -16.740  -0.031
    4   1HA   GLY   1          HA2       GLY   1  15.063 -16.919  -0.151
    5   2HA   GLY   1          HA3       GLY   1  15.695 -17.715   1.302
    6    H    SER   2           H        SER   2  13.572 -17.465   2.218
    7    HA   SER   2           HA       SER   2  12.308 -14.935   2.683
    8   1HB   SER   2          HB2       SER   2  11.937 -17.613   4.070
    9   2HB   SER   2          HB3       SER   2  10.857 -16.217   4.214
   10    HG   SER   2           HG       SER   2  10.444 -16.355   2.025
   11    H    HIS   3           H        HIS   3  13.828 -13.535   3.590
   12    HA   HIS   3           HA       HIS   3  14.509 -13.990   6.476
   13   1HB   HIS   3          HB2       HIS   3  16.074 -12.377   4.443
   14   2HB   HIS   3          HB3       HIS   3  16.563 -12.784   6.084
   15    HD1  HIS   3           HD1      HIS   3  16.088 -15.945   6.022
   16    HD2  HIS   3           HD2      HIS   3  17.798 -13.622   2.968
   17    HE1  HIS   3           HE1      HIS   3  17.495 -17.537   4.623
   18    H    MET   4           H        MET   4  12.485 -12.171   4.606
   19    HA   MET   4           HA       MET   4  12.147 -10.080   6.659
   20   1HB   MET   4          HB2       MET   4  12.567  -9.518   3.684
   21   2HB   MET   4          HB3       MET   4  11.871  -8.361   4.814
   22   1HG   MET   4          HG2       MET   4  13.956  -8.413   6.159
   23   2HG   MET   4          HG3       MET   4  14.657  -9.552   5.002
   24   1HE   MET   4          HE1       MET   4  13.851  -5.063   4.170
   25   2HE   MET   4          HE2       MET   4  12.498  -6.206   4.281
   26   3HE   MET   4          HE3       MET   4  13.523  -5.894   5.706
   27    HA   PRO   5           HA       PRO   5   7.883 -11.056   5.633
   28   1HB   PRO   5          HB2       PRO   5   6.518  -8.886   6.552
   29   2HB   PRO   5          HB3       PRO   5   7.357 -10.026   7.645
   30   1HG   PRO   5          HG2       PRO   5   8.391  -7.384   6.575
   31   2HG   PRO   5          HG3       PRO   5   8.348  -7.937   8.282
   32   1HD   PRO   5          HD2       PRO   5  10.582  -8.185   6.740
   33   2HD   PRO   5          HD3       PRO   5  10.132  -9.446   7.927
   34    H    LEU   6           H        LEU   6   6.051 -10.306   4.319
   35    HA   LEU   6           HA       LEU   6   5.119  -9.632   2.366
   36   1HB   LEU   6          HB2       LEU   6   6.514  -7.009   2.980
   37   2HB   LEU   6          HB3       LEU   6   5.070  -7.236   1.991
   38    HG   LEU   6           HG       LEU   6   5.213  -7.758   4.992
   39   1HD1  LEU   6          HD11      LEU   6   4.042  -5.459   3.390
   40   2HD1  LEU   6          HD12      LEU   6   3.851  -5.707   5.145
   41   3HD1  LEU   6          HD13      LEU   6   5.455  -5.394   4.463
   42   1HD2  LEU   6          HD21      LEU   6   2.744  -7.840   4.826
   43   2HD2  LEU   6          HD22      LEU   6   2.857  -7.736   3.053
   44   3HD2  LEU   6          HD23      LEU   6   3.494  -9.155   3.916
   45    H    GLU   7           H        GLU   7   7.723 -10.907   1.962
   46    HA   GLU   7           HA       GLU   7   9.361  -9.672   0.086
   47   1HB   GLU   7          HB2       GLU   7  10.184 -11.865  -0.490
   48   2HB   GLU   7          HB3       GLU   7   9.940 -11.733   1.249
   49   1HG   GLU   7          HG2       GLU   7   7.860 -13.039   1.095
   50   2HG   GLU   7          HG3       GLU   7   7.986 -13.095  -0.660
   51    H    PHE   8           H        PHE   8   6.187 -10.920  -0.602
   52    HA   PHE   8           HA       PHE   8   6.276 -11.268  -3.403
   53   1HB   PHE   8          HB2       PHE   8   4.008 -10.018  -1.824
   54   2HB   PHE   8          HB3       PHE   8   3.893 -10.940  -3.320
   55    HD1  PHE   8           HD1      PHE   8   3.682 -11.096   0.252
   56    HD2  PHE   8           HD2      PHE   8   4.710 -13.446  -3.215
   57    HE1  PHE   8           HE1      PHE   8   3.384 -13.175   1.571
   58    HE2  PHE   8           HE2      PHE   8   4.408 -15.525  -1.888
   59    HZ   PHE   8           HZ       PHE   8   3.747 -15.391   0.504
   60    H    LEU   9           H        LEU   9   6.295  -8.267  -1.529
   61    HA   LEU   9           HA       LEU   9   5.639  -6.467  -3.722
   62   1HB   LEU   9          HB2       LEU   9   6.973  -6.066  -1.011
   63   2HB   LEU   9          HB3       LEU   9   6.564  -4.755  -2.103
   64    HG   LEU   9           HG       LEU   9   4.510  -6.677  -0.919
   65   1HD1  LEU   9          HD11      LEU   9   5.203  -3.810  -0.162
   66   2HD1  LEU   9          HD12      LEU   9   3.905  -4.813   0.539
   67   3HD1  LEU   9          HD13      LEU   9   5.605  -5.253   0.789
   68   1HD2  LEU   9          HD21      LEU   9   3.730  -5.667  -3.036
   69   2HD2  LEU   9          HD22      LEU   9   2.886  -4.936  -1.669
   70   3HD2  LEU   9          HD23      LEU   9   4.208  -4.055  -2.462
   71    H    ARG  10           H        ARG  10   8.621  -7.841  -2.443
   72    HA   ARG  10           HA       ARG  10  10.423  -6.188  -4.067
   73   1HB   ARG  10          HB2       ARG  10  10.931  -8.748  -2.484
   74   2HB   ARG  10          HB3       ARG  10  12.165  -7.676  -3.136
   75   1HG   ARG  10          HG2       ARG  10  10.195  -7.009  -0.907
   76   2HG   ARG  10          HG3       ARG  10  11.920  -7.331  -0.752
   77   1HD   ARG  10          HD2       ARG  10  12.381  -5.335  -2.194
   78   2HD   ARG  10          HD3       ARG  10  10.646  -4.953  -2.165
   79    HE   ARG  10           HE       ARG  10  11.199  -5.147   0.488
   80   1HH1  ARG  10          HH22      ARG  10  12.771  -3.264  -2.018
   81   2HH1  ARG  10          HH21      ARG  10  13.360  -2.072  -0.879
   82   1HH2  ARG  10          HH12      ARG  10  12.030  -3.642   1.882
   83   2HH2  ARG  10          HH11      ARG  10  12.947  -2.285   1.266
   84    H    ASN  11           H        ASN  11   8.313  -8.429  -5.043
   85    HA   ASN  11           HA       ASN  11   9.997  -9.480  -7.274
   86   1HB   ASN  11          HB2       ASN  11   8.126 -10.953  -5.372
   87   2HB   ASN  11          HB3       ASN  11   8.622 -11.625  -6.927
   88   1HD2  ASN  11          HD21      ASN  11   9.700 -10.992  -3.648
   89   2HD2  ASN  11          HD22      ASN  11  11.261 -11.776  -3.874
   90    H    GLN  12           H        GLN  12   7.968  -7.195  -7.098
   91    HA   GLN  12           HA       GLN  12   6.546  -7.945  -9.567
   92   1HB   GLN  12          HB2       GLN  12   4.396  -7.115  -8.806
   93   2HB   GLN  12          HB3       GLN  12   4.946  -8.426  -7.772
   94   1HG   GLN  12          HG2       GLN  12   5.720  -6.698  -6.092
   95   2HG   GLN  12          HG3       GLN  12   4.996  -5.445  -7.113
   96   1HE2  GLN  12          HE21      GLN  12   4.280  -8.308  -5.112
   97   2HE2  GLN  12          HE22      GLN  12   2.576  -7.899  -4.880
   98    HA   PRO  13           HA       PRO  13   7.913  -3.919 -10.721
   99   1HB   PRO  13          HB2       PRO  13   6.202  -3.322 -12.812
  100   2HB   PRO  13          HB3       PRO  13   7.555  -4.512 -12.904
  101   1HG   PRO  13          HG2       PRO  13   4.605  -4.946 -12.565
  102   2HG   PRO  13          HG3       PRO  13   5.780  -5.904 -13.521
  103   1HD   PRO  13          HD2       PRO  13   4.833  -6.512 -11.014
  104   2HD   PRO  13          HD3       PRO  13   6.406  -7.128 -11.651
  105    H    GLN  14           H        GLN  14   4.522  -4.244  -9.768
  106    HA   GLN  14           HA       GLN  14   3.792  -1.500  -9.932
  107   1HB   GLN  14          HB2       GLN  14   2.708  -3.630  -8.044
  108   2HB   GLN  14          HB3       GLN  14   1.936  -2.095  -8.431
  109   1HG   GLN  14          HG2       GLN  14   2.403  -4.439 -10.319
  110   2HG   GLN  14          HG3       GLN  14   0.866  -3.838  -9.713
  111   1HE2  GLN  14          HE21      GLN  14   0.258  -1.509 -10.415
  112   2HE2  GLN  14          HE22      GLN  14   0.826  -1.010 -12.005
  113    H    PHE  15           H        PHE  15   5.706  -3.110  -7.487
  114    HA   PHE  15           HA       PHE  15   5.476  -1.104  -5.394
  115   1HB   PHE  15          HB2       PHE  15   6.128  -3.458  -5.011
  116   2HB   PHE  15          HB3       PHE  15   7.559  -3.238  -6.013
  117    HD1  PHE  15           HD1      PHE  15   9.573  -2.236  -5.124
  118    HD2  PHE  15           HD2      PHE  15   5.978  -2.378  -2.752
  119    HE1  PHE  15           HE1      PHE  15  10.875  -1.603  -3.108
  120    HE2  PHE  15           HE2      PHE  15   7.289  -1.778  -0.732
  121    HZ   PHE  15           HZ       PHE  15   9.739  -1.380  -0.910
  122    H    GLN  16           H        GLN  16   6.881  -1.019  -8.459
  123    HA   GLN  16           HA       GLN  16   8.555   1.343  -7.768
  124   1HB   GLN  16          HB2       GLN  16   8.940  -0.994  -9.647
  125   2HB   GLN  16          HB3       GLN  16   9.704   0.550 -10.036
  126   1HG   GLN  16          HG2       GLN  16  10.097  -1.001  -7.437
  127   2HG   GLN  16          HG3       GLN  16  11.227  -0.945  -8.791
  128   1HE2  GLN  16          HE21      GLN  16  11.884   1.422  -9.469
  129   2HE2  GLN  16          HE22      GLN  16  12.102   2.565  -8.157
  130    H    GLN  17           H        GLN  17   5.607   1.004  -8.473
  131    HA   GLN  17           HA       GLN  17   5.582   3.440 -10.194
  132   1HB   GLN  17          HB2       GLN  17   3.568   1.139 -10.311
  133   2HB   GLN  17          HB3       GLN  17   3.491   2.662 -11.210
  134   1HG   GLN  17          HG2       GLN  17   5.676   2.005 -12.324
  135   2HG   GLN  17          HG3       GLN  17   5.571   0.447 -11.511
  136   1HE2  GLN  17          HE21      GLN  17   5.683  -0.341 -13.828
  137   2HE2  GLN  17          HE22      GLN  17   4.137  -0.499 -14.663
  138    H    MET  18           H        MET  18   3.776   1.480  -7.749
  139    HA   MET  18           HA       MET  18   1.844   3.516  -7.203
  140   1HB   MET  18          HB2       MET  18   1.115   2.079  -5.499
  141   2HB   MET  18          HB3       MET  18   1.562   1.105  -6.893
  142   1HG   MET  18          HG2       MET  18   3.816   0.667  -5.681
  143   2HG   MET  18          HG3       MET  18   3.103   1.432  -4.275
  144   1HE   MET  18          HE1       MET  18   4.206  -1.101  -3.487
  145   2HE   MET  18          HE2       MET  18   2.995  -0.293  -2.465
  146   3HE   MET  18          HE3       MET  18   2.856  -2.033  -2.794
  147    H    ARG  19           H        ARG  19   4.988   2.869  -5.689
  148    HA   ARG  19           HA       ARG  19   4.556   4.541  -3.389
  149   1HB   ARG  19          HB2       ARG  19   7.219   3.780  -4.646
  150   2HB   ARG  19          HB3       ARG  19   6.887   4.220  -2.961
  151   1HG   ARG  19          HG2       ARG  19   5.267   2.191  -2.952
  152   2HG   ARG  19          HG3       ARG  19   6.039   1.697  -4.452
  153   1HD   ARG  19          HD2       ARG  19   7.430   2.085  -1.787
  154   2HD   ARG  19          HD3       ARG  19   7.064   0.541  -2.577
  155    HE   ARG  19           HE       ARG  19   8.691   1.037  -4.277
  156   1HH1  ARG  19          HH22      ARG  19   8.795   3.358  -1.635
  157   2HH1  ARG  19          HH21      ARG  19  10.355   3.958  -2.100
  158   1HH2  ARG  19          HH12      ARG  19  10.735   1.795  -4.761
  159   2HH2  ARG  19          HH11      ARG  19  11.506   2.953  -3.708
  160    H    GLN  20           H        GLN  20   5.872   5.272  -6.615
  161    HA   GLN  20           HA       GLN  20   6.676   7.952  -6.210
  162   1HB   GLN  20          HB2       GLN  20   5.361   6.534  -8.585
  163   2HB   GLN  20          HB3       GLN  20   5.920   8.195  -8.621
  164   1HG   GLN  20          HG2       GLN  20   7.747   7.207  -9.459
  165   2HG   GLN  20          HG3       GLN  20   8.225   7.166  -7.769
  166   1HE2  GLN  20          HE21      GLN  20   8.939   5.475 -10.199
  167   2HE2  GLN  20          HE22      GLN  20   8.475   3.831  -9.776
  168    H    ILE  21           H        ILE  21   3.425   6.579  -6.461
  169    HA   ILE  21           HA       ILE  21   2.086   9.078  -6.852
  170    HB   ILE  21           HB       ILE  21   0.841   6.545  -5.687
  171   1HG1  ILE  21          HG12      ILE  21   1.571   7.126  -8.577
  172   2HG1  ILE  21          HG13      ILE  21   2.144   5.806  -7.573
  173   1HG2  ILE  21          HG21      ILE  21  -0.515   8.646  -5.741
  174   2HG2  ILE  21          HG22      ILE  21  -0.269   8.728  -7.498
  175   3HG2  ILE  21          HG23      ILE  21  -1.179   7.382  -6.772
  176   1HD1  ILE  21          HD11      ILE  21  -0.673   6.056  -8.630
  177   2HD1  ILE  21          HD12      ILE  21   0.581   4.876  -9.072
  178   3HD1  ILE  21          HD13      ILE  21  -0.119   4.830  -7.451
  179    H    ILE  22           H        ILE  22   2.833   7.020  -4.074
  180    HA   ILE  22           HA       ILE  22   1.422   8.611  -2.088
  181    HB   ILE  22           HB       ILE  22   3.507   6.440  -1.658
  182   1HG1  ILE  22          HG12      ILE  22   1.882   5.296  -2.901
  183   2HG1  ILE  22          HG13      ILE  22   1.449   4.968  -1.241
  184   1HG2  ILE  22          HG21      ILE  22   1.293   7.430   0.189
  185   2HG2  ILE  22          HG22      ILE  22   2.426   6.106   0.512
  186   3HG2  ILE  22          HG23      ILE  22   3.032   7.753   0.389
  187   1HD1  ILE  22          HD11      ILE  22  -0.593   5.394  -2.357
  188   2HD1  ILE  22          HD12      ILE  22  -0.263   6.891  -1.450
  189   3HD1  ILE  22          HD13      ILE  22   0.038   6.816  -3.198
  190    H    GLN  23           H        GLN  23   4.788   8.425  -3.158
  191    HA   GLN  23           HA       GLN  23   5.953  10.205  -1.260
  192   1HB   GLN  23          HB2       GLN  23   6.627   9.332  -4.079
  193   2HB   GLN  23          HB3       GLN  23   7.680  10.438  -3.204
  194   1HG   GLN  23          HG2       GLN  23   6.927   7.687  -2.112
  195   2HG   GLN  23          HG3       GLN  23   8.313   7.985  -3.161
  196   1HE2  GLN  23          HE21      GLN  23   9.616   7.070  -1.312
  197   2HE2  GLN  23          HE22      GLN  23   9.986   8.149   0.014
  198    H    GLN  24           H        GLN  24   3.575  11.001  -3.487
  199    HA   GLN  24           HA       GLN  24   4.274  13.926  -3.387
  200   1HB   GLN  24          HB2       GLN  24   2.683  12.497  -5.554
  201   2HB   GLN  24          HB3       GLN  24   3.120  14.209  -5.510
  202   1HG   GLN  24          HG2       GLN  24   5.510  13.588  -5.697
  203   2HG   GLN  24          HG3       GLN  24   5.046  11.874  -5.672
  204   1HE2  GLN  24          HE21      GLN  24   4.523  10.891  -7.603
  205   2HE2  GLN  24          HE22      GLN  24   4.335  11.755  -9.132
  206    H    ASN  25           H        ASN  25   1.736  11.481  -3.383
  207    HA   ASN  25           HA       ASN  25  -0.002  13.248  -1.711
  208   1HB   ASN  25          HB2       ASN  25  -0.687  11.691  -4.186
  209   2HB   ASN  25          HB3       ASN  25  -1.882  11.801  -2.888
  210   1HD2  ASN  25          HD21      ASN  25  -2.358  13.977  -1.990
  211   2HD2  ASN  25          HD22      ASN  25  -2.420  15.297  -3.159
  212    HA   PRO  26           HA       PRO  26   0.823   9.444   0.763
  213   1HB   PRO  26          HB2       PRO  26   0.945  10.686   3.204
  214   2HB   PRO  26          HB3       PRO  26   2.341  10.541   2.090
  215   1HG   PRO  26          HG2       PRO  26   0.448  12.886   2.393
  216   2HG   PRO  26          HG3       PRO  26   2.245  12.909   2.395
  217   1HD   PRO  26          HD2       PRO  26   0.807  13.483   0.197
  218   2HD   PRO  26          HD3       PRO  26   2.314  12.522   0.054
  219    H    SER  27           H        SER  27  -1.556  12.015   0.847
  220    HA   SER  27           HA       SER  27  -3.608  10.872   2.439
  221   1HB   SER  27          HB2       SER  27  -5.091  12.289   0.987
  222   2HB   SER  27          HB3       SER  27  -3.740  13.148   1.736
  223    HG   SER  27           HG       SER  27  -4.098  13.574  -0.540
  224    H    LEU  28           H        LEU  28  -2.374   9.767  -0.624
  225    HA   LEU  28           HA       LEU  28  -4.784   8.087  -1.101
  226   1HB   LEU  28          HB2       LEU  28  -2.414   8.719  -2.892
  227   2HB   LEU  28          HB3       LEU  28  -3.782   7.694  -3.321
  228    HG   LEU  28           HG       LEU  28  -3.879  10.687  -2.787
  229   1HD1  LEU  28          HD11      LEU  28  -4.496  10.777  -5.165
  230   2HD1  LEU  28          HD12      LEU  28  -2.934   9.962  -4.967
  231   3HD1  LEU  28          HD13      LEU  28  -4.402   9.003  -5.269
  232   1HD2  LEU  28          HD21      LEU  28  -6.155   8.776  -3.475
  233   2HD2  LEU  28          HD22      LEU  28  -5.989   9.738  -1.983
  234   3HD2  LEU  28          HD23      LEU  28  -6.248  10.551  -3.526
  235    H    LEU  29           H        LEU  29  -2.089   7.669   0.745
  236    HA   LEU  29           HA       LEU  29  -1.299   5.011   0.068
  237   1HB   LEU  29          HB2       LEU  29  -0.113   6.430   1.656
  238   2HB   LEU  29          HB3       LEU  29  -1.440   6.419   2.769
  239    HG   LEU  29           HG       LEU  29  -1.194   3.996   3.154
  240   1HD1  LEU  29          HD11      LEU  29   1.143   4.217   1.212
  241   2HD1  LEU  29          HD12      LEU  29   0.877   2.849   2.315
  242   3HD1  LEU  29          HD13      LEU  29  -0.301   3.189   1.040
  243   1HD2  LEU  29          HD21      LEU  29   1.434   5.512   3.418
  244   2HD2  LEU  29          HD22      LEU  29   0.055   5.623   4.535
  245   3HD2  LEU  29          HD23      LEU  29   0.927   4.093   4.364
  246    HA   PRO  30           HA       PRO  30  -5.267   3.566   2.688
  247   1HB   PRO  30          HB2       PRO  30  -6.994   5.895   1.861
  248   2HB   PRO  30          HB3       PRO  30  -7.040   4.944   3.357
  249   1HG   PRO  30          HG2       PRO  30  -5.956   7.481   3.023
  250   2HG   PRO  30          HG3       PRO  30  -5.477   6.351   4.340
  251   1HD   PRO  30          HD2       PRO  30  -3.947   7.225   1.995
  252   2HD   PRO  30          HD3       PRO  30  -3.388   6.323   3.421
  253    H    ALA  31           H        ALA  31  -5.703   5.727  -0.081
  254    HA   ALA  31           HA       ALA  31  -7.499   4.092  -1.547
  255   1HB   ALA  31          HB1       ALA  31  -7.231   5.781  -3.242
  256   2HB   ALA  31          HB2       ALA  31  -7.181   6.572  -1.647
  257   3HB   ALA  31          HB3       ALA  31  -5.681   6.311  -2.561
  258    H    LEU  32           H        LEU  32  -4.097   3.615  -1.133
  259    HA   LEU  32           HA       LEU  32  -3.828   2.054  -3.654
  260   1HB   LEU  32          HB2       LEU  32  -2.047   3.620  -3.156
  261   2HB   LEU  32          HB3       LEU  32  -1.901   2.967  -1.512
  262    HG   LEU  32           HG       LEU  32  -1.017   0.875  -2.342
  263   1HD1  LEU  32          HD11      LEU  32  -0.464   0.551  -4.728
  264   2HD1  LEU  32          HD12      LEU  32  -2.200   0.675  -4.495
  265   3HD1  LEU  32          HD13      LEU  32  -1.306   2.074  -5.132
  266   1HD2  LEU  32          HD21      LEU  32   0.394   3.239  -3.652
  267   2HD2  LEU  32          HD22      LEU  32   0.470   2.825  -1.924
  268   3HD2  LEU  32          HD23      LEU  32   1.138   1.715  -3.130
  269    H    LEU  33           H        LEU  33  -3.687   1.727  -0.083
  270    HA   LEU  33           HA       LEU  33  -3.470  -1.123   0.067
  271   1HB   LEU  33          HB2       LEU  33  -4.891   0.934   1.800
  272   2HB   LEU  33          HB3       LEU  33  -4.667  -0.751   2.267
  273    HG   LEU  33           HG       LEU  33  -2.217   0.863   1.494
  274   1HD1  LEU  33          HD11      LEU  33  -3.613   1.003   4.187
  275   2HD1  LEU  33          HD12      LEU  33  -1.983   1.624   3.813
  276   3HD1  LEU  33          HD13      LEU  33  -3.396   2.326   3.011
  277   1HD2  LEU  33          HD21      LEU  33  -1.160  -0.592   3.161
  278   2HD2  LEU  33          HD22      LEU  33  -2.729  -1.325   3.551
  279   3HD2  LEU  33          HD23      LEU  33  -2.013  -1.556   1.939
  280    H    GLN  34           H        GLN  34  -6.355   0.996  -0.252
  281    HA   GLN  34           HA       GLN  34  -8.312  -1.042  -0.558
  282   1HB   GLN  34          HB2       GLN  34  -8.105   1.803  -1.591
  283   2HB   GLN  34          HB3       GLN  34  -9.537   0.804  -1.849
  284   1HG   GLN  34          HG2       GLN  34  -9.997   0.628   0.496
  285   2HG   GLN  34          HG3       GLN  34  -8.428   1.281   0.940
  286   1HE2  GLN  34          HE21      GLN  34  -9.312   3.016   2.196
  287   2HE2  GLN  34          HE22      GLN  34 -10.155   4.353   1.420
  288    H    GLN  35           H        GLN  35  -5.923   0.147  -2.978
  289    HA   GLN  35           HA       GLN  35  -7.364  -1.055  -5.215
  290   1HB   GLN  35          HB2       GLN  35  -5.943   1.050  -5.326
  291   2HB   GLN  35          HB3       GLN  35  -4.531   0.059  -4.967
  292   1HG   GLN  35          HG2       GLN  35  -4.444   0.330  -7.249
  293   2HG   GLN  35          HG3       GLN  35  -5.114  -1.293  -7.065
  294   1HE2  GLN  35          HE21      GLN  35  -5.707   1.964  -8.252
  295   2HE2  GLN  35          HE22      GLN  35  -7.314   1.646  -8.890
  296    H    ILE  36           H        ILE  36  -4.482  -1.816  -3.230
  297    HA   ILE  36           HA       ILE  36  -3.817  -4.344  -4.373
  298    HB   ILE  36           HB       ILE  36  -3.592  -3.376  -1.520
  299   1HG1  ILE  36          HG12      ILE  36  -1.412  -3.538  -3.656
  300   2HG1  ILE  36          HG13      ILE  36  -2.347  -2.074  -3.377
  301   1HG2  ILE  36          HG21      ILE  36  -3.431  -5.933  -1.751
  302   2HG2  ILE  36          HG22      ILE  36  -2.081  -5.697  -2.859
  303   3HG2  ILE  36          HG23      ILE  36  -1.954  -5.188  -1.169
  304   1HD1  ILE  36          HD11      ILE  36  -1.606  -2.074  -0.986
  305   2HD1  ILE  36          HD12      ILE  36  -0.510  -3.425  -1.386
  306   3HD1  ILE  36          HD13      ILE  36  -0.305  -1.852  -2.177
  307    H    GLY  37           H        GLY  37  -6.277  -3.473  -1.839
  308   1HA   GLY  37          HA2       GLY  37  -7.326  -6.035  -1.421
  309   2HA   GLY  37          HA3       GLY  37  -8.205  -4.515  -1.242
  310    H    ARG  38           H        ARG  38  -7.764  -4.114  -4.352
  311    HA   ARG  38           HA       ARG  38 -10.137  -5.686  -5.206
  312   1HB   ARG  38          HB2       ARG  38  -8.525  -3.629  -6.775
  313   2HB   ARG  38          HB3       ARG  38 -10.030  -4.404  -7.263
  314   1HG   ARG  38          HG2       ARG  38 -10.953  -3.387  -4.987
  315   2HG   ARG  38          HG3       ARG  38  -9.577  -2.284  -5.170
  316   1HD   ARG  38          HD2       ARG  38 -11.816  -2.753  -7.170
  317   2HD   ARG  38          HD3       ARG  38 -11.631  -1.337  -6.128
  318    HE   ARG  38           HE       ARG  38  -9.266  -1.317  -7.494
  319   1HH1  ARG  38          HH22      ARG  38 -12.569  -1.410  -8.692
  320   2HH1  ARG  38          HH21      ARG  38 -12.106  -0.682 -10.215
  321   1HH2  ARG  38          HH12      ARG  38  -8.770  -0.466  -9.355
  322   2HH2  ARG  38          HH11      ARG  38  -9.972  -0.147 -10.600
  323    H    GLU  39           H        GLU  39  -6.680  -5.414  -6.131
  324    HA   GLU  39           HA       GLU  39  -6.979  -7.543  -8.132
  325   1HB   GLU  39          HB2       GLU  39  -4.770  -5.621  -7.293
  326   2HB   GLU  39          HB3       GLU  39  -4.616  -6.821  -8.582
  327   1HG   GLU  39          HG2       GLU  39  -6.606  -5.770  -9.714
  328   2HG   GLU  39          HG3       GLU  39  -6.573  -4.487  -8.500
  329    H    ASN  40           H        ASN  40  -5.636  -7.184  -4.933
  330    HA   ASN  40           HA       ASN  40  -4.650  -9.972  -4.812
  331   1HB   ASN  40          HB2       ASN  40  -3.025  -7.450  -4.225
  332   2HB   ASN  40          HB3       ASN  40  -2.587  -9.084  -3.705
  333   1HD2  ASN  40          HD21      ASN  40  -1.427 -10.373  -4.960
  334   2HD2  ASN  40          HD22      ASN  40  -0.864  -9.854  -6.544
  335    HA   PRO  41           HA       PRO  41  -6.989  -8.199  -1.051
  336   1HB   PRO  41          HB2       PRO  41  -8.785 -10.267  -0.701
  337   2HB   PRO  41          HB3       PRO  41  -9.063  -8.834  -1.740
  338   1HG   PRO  41          HG2       PRO  41  -8.021 -11.539  -2.582
  339   2HG   PRO  41          HG3       PRO  41  -9.367 -10.595  -3.312
  340   1HD   PRO  41          HD2       PRO  41  -6.909 -10.514  -4.389
  341   2HD   PRO  41          HD3       PRO  41  -7.844  -8.996  -4.222
  342    H    GLN  42           H        GLN  42  -5.416 -11.250  -1.766
  343    HA   GLN  42           HA       GLN  42  -5.022 -12.099   0.991
  344   1HB   GLN  42          HB2       GLN  42  -3.438 -12.819  -1.512
  345   2HB   GLN  42          HB3       GLN  42  -3.444 -13.679   0.039
  346   1HG   GLN  42          HG2       GLN  42  -5.925 -14.060  -0.274
  347   2HG   GLN  42          HG3       GLN  42  -5.785 -13.328  -1.872
  348   1HE2  GLN  42          HE21      GLN  42  -6.735 -15.533  -2.502
  349   2HE2  GLN  42          HE22      GLN  42  -5.570 -16.820  -2.791
  350    H    LEU  43           H        LEU  43  -2.882 -10.467  -1.440
  351    HA   LEU  43           HA       LEU  43  -0.732  -9.992   0.366
  352   1HB   LEU  43          HB2       LEU  43  -0.661  -9.793  -2.149
  353   2HB   LEU  43          HB3       LEU  43  -1.548  -8.283  -2.034
  354    HG   LEU  43           HG       LEU  43   0.241  -7.183  -0.894
  355   1HD1  LEU  43          HD11      LEU  43   1.668  -9.878  -0.836
  356   2HD1  LEU  43          HD12      LEU  43   2.448  -8.313  -0.489
  357   3HD1  LEU  43          HD13      LEU  43   1.165  -8.901   0.566
  358   1HD2  LEU  43          HD21      LEU  43   1.993  -7.309  -2.609
  359   2HD2  LEU  43          HD22      LEU  43   1.343  -8.865  -3.181
  360   3HD2  LEU  43          HD23      LEU  43   0.384  -7.374  -3.350
  361    H    LEU  44           H        LEU  44  -3.743  -8.312  -0.189
  362    HA   LEU  44           HA       LEU  44  -3.079  -5.897   1.240
  363   1HB   LEU  44          HB2       LEU  44  -5.024  -6.348  -0.359
  364   2HB   LEU  44          HB3       LEU  44  -5.852  -7.150   0.933
  365    HG   LEU  44           HG       LEU  44  -6.215  -4.589   0.316
  366   1HD1  LEU  44          HD11      LEU  44  -6.360  -5.562   3.168
  367   2HD1  LEU  44          HD12      LEU  44  -7.240  -4.196   2.425
  368   3HD1  LEU  44          HD13      LEU  44  -7.556  -5.839   1.867
  369   1HD2  LEU  44          HD21      LEU  44  -5.220  -3.023   1.862
  370   2HD2  LEU  44          HD22      LEU  44  -4.214  -4.272   2.593
  371   3HD2  LEU  44          HD23      LEU  44  -3.946  -3.784   0.897
  372    H    GLN  45           H        GLN  45  -5.036  -8.668   2.219
  373    HA   GLN  45           HA       GLN  45  -5.183  -8.179   5.008
  374   1HB   GLN  45          HB2       GLN  45  -5.148 -10.768   3.430
  375   2HB   GLN  45          HB3       GLN  45  -5.360 -10.736   5.183
  376   1HG   GLN  45          HG2       GLN  45  -7.368  -9.417   5.031
  377   2HG   GLN  45          HG3       GLN  45  -7.144  -9.142   3.299
  378   1HE2  GLN  45          HE21      GLN  45  -7.386 -10.966   1.839
  379   2HE2  GLN  45          HE22      GLN  45  -8.392 -12.341   2.316
  380    H    GLN  46           H        GLN  46  -2.433  -9.754   3.234
  381    HA   GLN  46           HA       GLN  46  -0.924 -10.277   5.626
  382   1HB   GLN  46          HB2       GLN  46  -0.451 -10.214   2.638
  383   2HB   GLN  46          HB3       GLN  46   0.931 -10.201   3.722
  384   1HG   GLN  46          HG2       GLN  46   0.440 -12.450   3.067
  385   2HG   GLN  46          HG3       GLN  46   0.205 -12.237   4.812
  386   1HE2  GLN  46          HE21      GLN  46  -1.123 -13.670   2.047
  387   2HE2  GLN  46          HE22      GLN  46  -2.731 -13.944   2.726
  388    H    ILE  47           H        ILE  47  -0.819  -7.506   3.313
  389    HA   ILE  47           HA       ILE  47   1.168  -5.986   4.682
  390    HB   ILE  47           HB       ILE  47  -1.110  -5.308   2.824
  391   1HG1  ILE  47          HG12      ILE  47   1.922  -5.032   2.585
  392   2HG1  ILE  47          HG13      ILE  47   1.034  -6.475   2.085
  393   1HG2  ILE  47          HG21      ILE  47   0.777  -3.343   4.187
  394   2HG2  ILE  47          HG22      ILE  47  -0.146  -2.963   2.721
  395   3HG2  ILE  47          HG23      ILE  47  -0.999  -3.327   4.214
  396   1HD1  ILE  47          HD11      ILE  47  -0.303  -5.058   0.513
  397   2HD1  ILE  47          HD12      ILE  47   0.807  -3.707   0.871
  398   3HD1  ILE  47          HD13      ILE  47   1.428  -5.195   0.133
  399    H    SER  48           H        SER  48  -2.362  -6.188   5.200
  400    HA   SER  48           HA       SER  48  -2.543  -4.188   7.233
  401   1HB   SER  48          HB2       SER  48  -4.265  -6.672   6.873
  402   2HB   SER  48          HB3       SER  48  -4.668  -5.252   7.848
  403    HG   SER  48           HG       SER  48  -4.271  -5.342   5.040
  404    H    GLN  49           H        GLN  49  -1.730  -7.630   7.451
  405    HA   GLN  49           HA       GLN  49  -1.548  -7.753  10.345
  406   1HB   GLN  49          HB2       GLN  49  -0.739  -9.510   8.013
  407   2HB   GLN  49          HB3       GLN  49  -0.236  -9.927   9.648
  408   1HG   GLN  49          HG2       GLN  49  -2.514 -10.091  10.422
  409   2HG   GLN  49          HG3       GLN  49  -3.146  -9.402   8.926
  410   1HE2  GLN  49          HE21      GLN  49  -3.025 -10.653   6.969
  411   2HE2  GLN  49          HE22      GLN  49  -2.849 -12.405   7.018
  412    H    HIS  50           H        HIS  50   0.518  -6.256   8.077
  413    HA   HIS  50           HA       HIS  50   2.810  -6.219   9.984
  414   1HB   HIS  50          HB2       HIS  50   2.937  -6.794   6.999
  415   2HB   HIS  50          HB3       HIS  50   4.335  -6.614   8.064
  416    HD1  HIS  50           HD1      HIS  50   1.696  -9.138   7.084
  417    HD2  HIS  50           HD2      HIS  50   4.920  -8.684   9.728
  418    HE1  HIS  50           HE1      HIS  50   2.240 -11.481   7.954
  419    H    GLN  51           H        GLN  51   0.715  -4.161   9.236
  420    HA   GLN  51           HA       GLN  51   1.450  -2.604   7.145
  421   1HB   GLN  51          HB2       GLN  51  -0.689  -2.677   8.547
  422   2HB   GLN  51          HB3       GLN  51   0.063  -1.447   9.581
  423   1HG   GLN  51          HG2       GLN  51   0.333   0.013   7.575
  424   2HG   GLN  51          HG3       GLN  51  -0.406  -1.238   6.570
  425   1HE2  GLN  51          HE21      GLN  51  -1.246   1.654   7.350
  426   2HE2  GLN  51          HE22      GLN  51  -2.913   1.424   7.876
  427    H    GLU  52           H        GLU  52   2.749  -2.148  10.439
  428    HA   GLU  52           HA       GLU  52   4.106   0.335   9.875
  429   1HB   GLU  52          HB2       GLU  52   5.371  -0.079  11.879
  430   2HB   GLU  52          HB3       GLU  52   3.668  -0.433  12.145
  431   1HG   GLU  52          HG2       GLU  52   4.202  -2.894  11.845
  432   2HG   GLU  52          HG3       GLU  52   5.908  -2.462  11.767
  433    H    HIS  53           H        HIS  53   5.065  -3.063   9.356
  434    HA   HIS  53           HA       HIS  53   7.769  -2.423   8.483
  435   1HB   HIS  53          HB2       HIS  53   6.118  -4.933   7.983
  436   2HB   HIS  53          HB3       HIS  53   7.852  -4.751   7.771
  437    HD1  HIS  53           HD1      HIS  53   5.407  -5.798  10.362
  438    HD2  HIS  53           HD2      HIS  53   9.267  -4.145  10.180
  439    HE1  HIS  53           HE1      HIS  53   6.455  -6.176  12.651
  440    H    PHE  54           H        PHE  54   4.607  -2.926   6.868
  441    HA   PHE  54           HA       PHE  54   5.534  -2.731   4.154
  442   1HB   PHE  54          HB2       PHE  54   3.251  -3.456   4.634
  443   2HB   PHE  54          HB3       PHE  54   2.898  -1.938   5.454
  444    HD1  PHE  54           HD1      PHE  54   4.253  -3.018   2.101
  445    HD2  PHE  54           HD2      PHE  54   1.589  -0.411   4.261
  446    HE1  PHE  54           HE1      PHE  54   3.464  -2.041  -0.046
  447    HE2  PHE  54           HE2      PHE  54   0.796   0.551   2.114
  448    HZ   PHE  54           HZ       PHE  54   1.733  -0.257  -0.037
  449    H    ILE  55           H        ILE  55   4.326  -0.133   6.356
  450    HA   ILE  55           HA       ILE  55   4.798   1.999   4.572
  451    HB   ILE  55           HB       ILE  55   4.579   1.890   7.533
  452   1HG1  ILE  55          HG12      ILE  55   2.836   2.989   5.269
  453   2HG1  ILE  55          HG13      ILE  55   2.629   1.398   6.006
  454   1HG2  ILE  55          HG21      ILE  55   4.903   4.398   5.812
  455   2HG2  ILE  55          HG22      ILE  55   4.432   4.381   7.525
  456   3HG2  ILE  55          HG23      ILE  55   6.034   3.842   7.067
  457   1HD1  ILE  55          HD11      ILE  55   2.213   2.500   8.205
  458   2HD1  ILE  55          HD12      ILE  55   2.219   4.074   7.354
  459   3HD1  ILE  55          HD13      ILE  55   1.004   2.849   6.944
  460    H    GLN  56           H        GLN  56   7.094   0.488   6.897
  461    HA   GLN  56           HA       GLN  56   9.258   2.272   6.186
  462   1HB   GLN  56          HB2       GLN  56   9.173  -0.352   7.716
  463   2HB   GLN  56          HB3       GLN  56  10.643   0.592   7.515
  464   1HG   GLN  56          HG2       GLN  56   8.113   1.616   8.868
  465   2HG   GLN  56          HG3       GLN  56   9.530   0.988   9.695
  466   1HE2  GLN  56          HE21      GLN  56   8.686   3.487  10.401
  467   2HE2  GLN  56          HE22      GLN  56   9.799   4.688   9.758
  468    H    MET  57           H        MET  57   7.940  -0.028   4.224
  469    HA   MET  57           HA       MET  57  10.492  -0.282   2.654
  470   1HB   MET  57          HB2       MET  57   7.952  -1.971   2.559
  471   2HB   MET  57          HB3       MET  57   9.327  -2.126   1.459
  472   1HG   MET  57          HG2       MET  57  10.782  -2.522   3.515
  473   2HG   MET  57          HG3       MET  57   9.302  -2.613   4.452
  474   1HE   MET  57          HE1       MET  57  10.725  -4.900   5.142
  475   2HE   MET  57          HE2       MET  57   8.961  -4.935   5.355
  476   3HE   MET  57          HE3       MET  57   9.795  -6.335   4.649
  477    H    LEU  58           H        LEU  58   7.024   0.503   2.509
  478    HA   LEU  58           HA       LEU  58   6.688   1.539  -0.043
  479   1HB   LEU  58          HB2       LEU  58   5.018   0.878   1.435
  480   2HB   LEU  58          HB3       LEU  58   5.580   1.943   2.705
  481    HG   LEU  58           HG       LEU  58   3.416   2.350   1.519
  482   1HD1  LEU  58          HD11      LEU  58   3.538   4.735   2.013
  483   2HD1  LEU  58          HD12      LEU  58   4.410   3.801   3.226
  484   3HD1  LEU  58          HD13      LEU  58   5.314   4.682   1.975
  485   1HD2  LEU  58          HD21      LEU  58   3.353   3.813  -0.399
  486   2HD2  LEU  58          HD22      LEU  58   5.117   3.862  -0.510
  487   3HD2  LEU  58          HD23      LEU  58   4.240   2.346  -0.824
  488    H    ASN  59           H        ASN  59   8.009   3.136   2.896
  489    HA   ASN  59           HA       ASN  59   7.986   5.792   1.752
  490   1HB   ASN  59          HB2       ASN  59   8.775   6.502   3.893
  491   2HB   ASN  59          HB3       ASN  59   7.560   5.252   4.161
  492   1HD2  ASN  59          HD21      ASN  59   9.055   5.811   6.275
  493   2HD2  ASN  59          HD22      ASN  59  10.212   4.508   6.550
  494    H    GLU  60           H        GLU  60  10.163   3.341   1.231
  495    HA   GLU  60           HA       GLU  60  12.736   4.529   1.324
  496   1HB   GLU  60          HB2       GLU  60  11.422   2.311  -0.228
  497   2HB   GLU  60          HB3       GLU  60  13.118   2.700  -0.510
  498   1HG   GLU  60          HG2       GLU  60  12.018   2.101   2.271
  499   2HG   GLU  60          HG3       GLU  60  12.608   0.863   1.170
  500    HA   PRO  61           HA       PRO  61  12.938   7.099  -2.385
  501   1HB   PRO  61          HB2       PRO  61  15.364   6.435  -3.513
  502   2HB   PRO  61          HB3       PRO  61  15.164   7.492  -2.080
  503   1HG   PRO  61          HG2       PRO  61  15.807   4.546  -2.173
  504   2HG   PRO  61          HG3       PRO  61  16.590   5.824  -1.183
  505   1HD   PRO  61          HD2       PRO  61  14.700   4.159  -0.184
  506   2HD   PRO  61          HD3       PRO  61  14.770   5.871   0.331
  507    H    VAL  62           H        VAL  62  12.642   6.969  -4.670
  508    HA   VAL  62           HA       VAL  62  11.570   4.357  -5.546
  509    HB   VAL  62           HB       VAL  62  10.289   5.783  -7.122
  510   1HG1  VAL  62          HG11      VAL  62   9.341   5.047  -4.983
  511   2HG1  VAL  62          HG12      VAL  62  10.001   6.481  -4.169
  512   3HG1  VAL  62          HG13      VAL  62   8.747   6.659  -5.413
  513   1HG2  VAL  62          HG21      VAL  62  11.804   7.759  -7.221
  514   2HG2  VAL  62          HG22      VAL  62  10.140   8.187  -6.811
  515   3HG2  VAL  62          HG23      VAL  62  11.367   8.161  -5.542
  516    H    GLN  63           H        GLN  63  14.363   6.118  -6.198
  517    HA   GLN  63           HA       GLN  63  14.928   4.535  -8.592
  518   1HB   GLN  63          HB2       GLN  63  15.469   6.437 -10.019
  519   2HB   GLN  63          HB3       GLN  63  13.779   6.471  -9.543
  520   1HG   GLN  63          HG2       GLN  63  14.399   8.184  -7.754
  521   2HG   GLN  63          HG3       GLN  63  16.020   8.225  -8.450
  522   1HE2  GLN  63          HE21      GLN  63  16.333   9.576 -10.280
  523   2HE2  GLN  63          HE22      GLN  63  15.003  10.397 -11.089
  524    H    GLU  64           H        GLU  64  17.196   4.900  -9.350
  525    HA   GLU  64           HA       GLU  64  19.054   5.344  -7.035
  526   1HB   GLU  64          HB2       GLU  64  19.099   3.170  -9.159
  527   2HB   GLU  64          HB3       GLU  64  20.314   3.401  -7.890
  528   1HG   GLU  64          HG2       GLU  64  18.566   3.038  -6.160
  529   2HG   GLU  64          HG3       GLU  64  17.388   2.706  -7.426
  530    H    ALA  65           H        ALA  65  18.297   6.913  -9.663
  531    HA   ALA  65           HA       ALA  65  20.999   7.938 -10.196
  532   1HB   ALA  65          HB1       ALA  65  20.751   7.693 -12.643
  533   2HB   ALA  65          HB2       ALA  65  20.704   6.111 -11.860
  534   3HB   ALA  65          HB3       ALA  65  19.195   6.863 -12.416
  535    H    GLY  66           H        GLY  66  20.701   9.857 -11.882
  536   1HA   GLY  66          HA2       GLY  66  18.393  11.272 -12.314
  537   2HA   GLY  66          HA3       GLY  66  18.824  11.747 -10.669
  538    H    GLY  67           H        GLY  67  21.792  11.559 -11.380
  539   1HA   GLY  67          HA2       GLY  67  22.362  14.241 -11.874
  540   2HA   GLY  67          HA3       GLY  67  23.486  12.906 -12.133
  541    H    GLN  68           H        GLN  68  21.802  11.738 -14.313
  542    HA   GLN  68           HA       GLN  68  22.802  13.126 -16.593
  543   1HB   GLN  68          HB2       GLN  68  21.670  11.508 -17.893
  544   2HB   GLN  68          HB3       GLN  68  22.390  10.693 -16.525
  545   1HG   GLN  68          HG2       GLN  68  19.428  11.464 -16.626
  546   2HG   GLN  68          HG3       GLN  68  20.057   9.979 -17.302
  547   1HE2  GLN  68          HE21      GLN  68  18.284   9.235 -15.688
  548   2HE2  GLN  68          HE22      GLN  68  18.894   8.821 -14.090
  549    H    GLY  69           H        GLY  69  20.089  13.948 -14.698
  550   1HA   GLY  69          HA2       GLY  69  18.363  15.030 -16.754
  551   2HA   GLY  69          HA3       GLY  69  18.238  15.260 -15.011
  552    H    GLY  70           H        GLY  70  21.347  16.204 -15.965
  553   1HA   GLY  70          HA2       GLY  70  20.778  18.870 -16.989
  554   2HA   GLY  70          HA3       GLY  70  21.265  18.871 -15.295
  555    H    GLY  71           H        GLY  71  22.873  20.278 -16.726
  556   1HA   GLY  71          HA2       GLY  71  25.467  19.160 -16.567
  557   2HA   GLY  71          HA3       GLY  71  24.941  19.041 -18.246
  558    H    GLY  72           H        GLY  72  27.031  20.439 -18.160
  559   1HA   GLY  72          HA2       GLY  72  26.409  23.115 -18.992
  560   2HA   GLY  72          HA3       GLY  72  27.116  23.151 -17.376
  Start of MODEL   18
    1   1H    GLY   1           H1       GLY   1   7.168 -17.721   3.253
    2   2H    GLY   1           H2       GLY   1   8.399 -18.196   4.232
    3   3H    GLY   1           H3       GLY   1   8.240 -18.854   2.738
    4   1HA   GLY   1          HA2       GLY   1   8.693 -16.737   1.685
    5   2HA   GLY   1          HA3       GLY   1   8.881 -16.029   3.300
    6    H    SER   2           H        SER   2  11.002 -15.441   2.290
    7    HA   SER   2           HA       SER   2  13.092 -17.513   2.817
    8   1HB   SER   2          HB2       SER   2  12.478 -17.343   0.382
    9   2HB   SER   2          HB3       SER   2  12.956 -15.643   0.421
   10    HG   SER   2           HG       SER   2  14.584 -17.931   0.847
   11    H    HIS   3           H        HIS   3  12.262 -14.047   2.680
   12    HA   HIS   3           HA       HIS   3  14.530 -13.457   4.478
   13   1HB   HIS   3          HB2       HIS   3  15.521 -11.799   3.103
   14   2HB   HIS   3          HB3       HIS   3  15.453 -13.292   2.192
   15    HD1  HIS   3           HD1      HIS   3  12.330 -12.749   1.091
   16    HD2  HIS   3           HD2      HIS   3  15.692 -10.228   1.002
   17    HE1  HIS   3           HE1      HIS   3  12.002 -11.190  -0.877
   18    H    MET   4           H        MET   4  11.358 -12.424   3.285
   19    HA   MET   4           HA       MET   4  11.273 -10.425   5.485
   20   1HB   MET   4          HB2       MET   4  10.578  -9.802   2.580
   21   2HB   MET   4          HB3       MET   4  10.237  -8.750   3.952
   22   1HG   MET   4          HG2       MET   4  12.728  -8.735   4.437
   23   2HG   MET   4          HG3       MET   4  12.956  -9.509   2.862
   24   1HE   MET   4          HE1       MET   4  12.203  -8.337   0.527
   25   2HE   MET   4          HE2       MET   4  10.580  -7.947   1.152
   26   3HE   MET   4          HE3       MET   4  11.582  -6.676   0.428
   27    HA   PRO   5           HA       PRO   5   7.116 -12.002   5.859
   28   1HB   PRO   5          HB2       PRO   5   5.835 -10.047   7.259
   29   2HB   PRO   5          HB3       PRO   5   7.142 -11.046   7.964
   30   1HG   PRO   5          HG2       PRO   5   7.367  -8.290   6.724
   31   2HG   PRO   5          HG3       PRO   5   7.985  -8.830   8.321
   32   1HD   PRO   5          HD2       PRO   5   9.588  -8.752   6.128
   33   2HD   PRO   5          HD3       PRO   5   9.732 -10.070   7.328
   34    H    LEU   6           H        LEU   6   7.790  -9.313   3.888
   35    HA   LEU   6           HA       LEU   6   5.109  -9.407   2.571
   36   1HB   LEU   6          HB2       LEU   6   6.834  -7.007   3.278
   37   2HB   LEU   6          HB3       LEU   6   5.486  -6.923   2.138
   38    HG   LEU   6           HG       LEU   6   5.218  -7.624   5.083
   39   1HD1  LEU   6          HD11      LEU   6   5.807  -5.257   4.646
   40   2HD1  LEU   6          HD12      LEU   6   4.465  -5.137   3.491
   41   3HD1  LEU   6          HD13      LEU   6   4.137  -5.408   5.215
   42   1HD2  LEU   6          HD21      LEU   6   2.776  -7.304   4.621
   43   2HD2  LEU   6          HD22      LEU   6   3.134  -7.215   2.882
   44   3HD2  LEU   6          HD23      LEU   6   3.433  -8.715   3.794
   45    H    GLU   7           H        GLU   7   7.835 -10.695   1.950
   46    HA   GLU   7           HA       GLU   7   8.827  -9.582  -0.505
   47   1HB   GLU   7          HB2       GLU   7   9.856 -11.734  -0.854
   48   2HB   GLU   7          HB3       GLU   7  10.075 -11.180   0.806
   49   1HG   GLU   7          HG2       GLU   7   8.213 -12.719   1.517
   50   2HG   GLU   7          HG3       GLU   7   8.082 -13.276  -0.146
   51    H    PHE   8           H        PHE   8   5.744 -11.072  -0.016
   52    HA   PHE   8           HA       PHE   8   5.333 -11.884  -2.747
   53   1HB   PHE   8          HB2       PHE   8   3.922 -12.546  -0.798
   54   2HB   PHE   8          HB3       PHE   8   3.302 -10.899  -0.721
   55    HD1  PHE   8           HD1      PHE   8   3.885 -13.239  -3.662
   56    HD2  PHE   8           HD2      PHE   8   1.014 -11.082  -1.272
   57    HE1  PHE   8           HE1      PHE   8   2.080 -13.929  -5.201
   58    HE2  PHE   8           HE2      PHE   8  -0.791 -11.788  -2.818
   59    HZ   PHE   8           HZ       PHE   8  -0.261 -13.203  -4.791
   60    H    LEU   9           H        LEU   9   5.701  -8.710  -1.383
   61    HA   LEU   9           HA       LEU   9   4.458  -7.135  -3.461
   62   1HB   LEU   9          HB2       LEU   9   6.834  -6.696  -1.608
   63   2HB   LEU   9          HB3       LEU   9   6.354  -5.495  -2.787
   64    HG   LEU   9           HG       LEU   9   4.406  -6.520  -0.693
   65   1HD1  LEU   9          HD11      LEU   9   6.180  -4.044  -0.557
   66   2HD1  LEU   9          HD12      LEU   9   4.945  -4.551   0.627
   67   3HD1  LEU   9          HD13      LEU   9   6.405  -5.528   0.393
   68   1HD2  LEU   9          HD21      LEU   9   4.512  -3.942  -2.341
   69   2HD2  LEU   9          HD22      LEU   9   3.447  -5.317  -2.683
   70   3HD2  LEU   9          HD23      LEU   9   3.249  -4.395  -1.180
   71    H    ARG  10           H        ARG  10   7.684  -8.649  -3.153
   72    HA   ARG  10           HA       ARG  10   8.865  -7.495  -5.488
   73   1HB   ARG  10          HB2       ARG  10   9.492 -10.035  -3.926
   74   2HB   ARG  10          HB3       ARG  10  10.465  -9.453  -5.279
   75   1HG   ARG  10          HG2       ARG  10  10.796  -7.280  -3.983
   76   2HG   ARG  10          HG3       ARG  10   9.972  -8.055  -2.622
   77   1HD   ARG  10          HD2       ARG  10  12.286  -8.361  -2.209
   78   2HD   ARG  10          HD3       ARG  10  11.697  -9.929  -2.778
   79    HE   ARG  10           HE       ARG  10  12.561  -8.707  -5.093
   80   1HH1  ARG  10          HH22      ARG  10  14.239  -9.459  -2.076
   81   2HH1  ARG  10          HH21      ARG  10  15.786  -9.505  -2.876
   82   1HH2  ARG  10          HH12      ARG  10  14.566  -8.804  -6.008
   83   2HH2  ARG  10          HH11      ARG  10  15.965  -9.119  -5.019
   84    H    ASN  11           H        ASN  11   6.589 -10.087  -5.237
   85    HA   ASN  11           HA       ASN  11   7.081 -11.200  -7.894
   86   1HB   ASN  11          HB2       ASN  11   6.184 -12.491  -5.945
   87   2HB   ASN  11          HB3       ASN  11   4.719 -11.500  -5.989
   88   1HD2  ASN  11          HD21      ASN  11   3.041 -12.380  -7.155
   89   2HD2  ASN  11          HD22      ASN  11   3.255 -13.594  -8.417
   90    H    GLN  12           H        GLN  12   5.322  -8.393  -6.763
   91    HA   GLN  12           HA       GLN  12   3.236  -8.515  -8.794
   92   1HB   GLN  12          HB2       GLN  12   3.990  -6.183  -6.991
   93   2HB   GLN  12          HB3       GLN  12   2.474  -6.411  -7.846
   94   1HG   GLN  12          HG2       GLN  12   3.509  -7.940  -5.454
   95   2HG   GLN  12          HG3       GLN  12   2.071  -6.930  -5.562
   96   1HE2  GLN  12          HE21      GLN  12   2.708  -9.957  -4.962
   97   2HE2  GLN  12          HE22      GLN  12   1.404 -10.748  -5.837
   98    HA   PRO  13           HA       PRO  13   5.354  -6.118 -11.904
   99   1HB   PRO  13          HB2       PRO  13   3.244  -5.079 -13.332
  100   2HB   PRO  13          HB3       PRO  13   3.696  -6.822 -13.337
  101   1HG   PRO  13          HG2       PRO  13   1.497  -5.394 -11.870
  102   2HG   PRO  13          HG3       PRO  13   1.464  -7.002 -12.659
  103   1HD   PRO  13          HD2       PRO  13   1.838  -6.468  -9.972
  104   2HD   PRO  13          HD3       PRO  13   2.330  -8.012 -10.765
  105    H    GLN  14           H        GLN  14   3.625  -4.474  -9.449
  106    HA   GLN  14           HA       GLN  14   4.468  -1.770 -10.439
  107   1HB   GLN  14          HB2       GLN  14   1.765  -2.709  -9.404
  108   2HB   GLN  14          HB3       GLN  14   2.190  -1.009  -9.529
  109   1HG   GLN  14          HG2       GLN  14   2.136  -2.917 -11.903
  110   2HG   GLN  14          HG3       GLN  14   0.846  -1.819 -11.441
  111   1HE2  GLN  14          HE21      GLN  14   4.141  -1.963 -12.789
  112   2HE2  GLN  14          HE22      GLN  14   4.175  -0.280 -13.282
  113    H    PHE  15           H        PHE  15   5.222  -3.714  -7.932
  114    HA   PHE  15           HA       PHE  15   4.701  -1.987  -5.660
  115   1HB   PHE  15          HB2       PHE  15   5.947  -3.445  -4.392
  116   2HB   PHE  15          HB3       PHE  15   5.250  -4.489  -5.620
  117    HD1  PHE  15           HD1      PHE  15   6.775  -5.202  -7.604
  118    HD2  PHE  15           HD2      PHE  15   8.283  -3.323  -4.031
  119    HE1  PHE  15           HE1      PHE  15   9.055  -6.008  -8.143
  120    HE2  PHE  15           HE2      PHE  15  10.559  -4.148  -4.562
  121    HZ   PHE  15           HZ       PHE  15  10.955  -5.483  -6.624
  122    H    GLN  16           H        GLN  16   7.057  -1.960  -8.157
  123    HA   GLN  16           HA       GLN  16   8.958  -0.095  -6.977
  124   1HB   GLN  16          HB2       GLN  16   8.401  -1.236  -9.734
  125   2HB   GLN  16          HB3       GLN  16   9.700  -0.060  -9.446
  126   1HG   GLN  16          HG2       GLN  16  10.735  -1.572  -7.797
  127   2HG   GLN  16          HG3       GLN  16   9.463  -2.764  -8.051
  128   1HE2  GLN  16          HE21      GLN  16  12.600  -2.341  -8.776
  129   2HE2  GLN  16          HE22      GLN  16  12.641  -3.089 -10.370
  130    H    GLN  17           H        GLN  17   5.801   0.360  -8.310
  131    HA   GLN  17           HA       GLN  17   6.401   3.217  -9.000
  132   1HB   GLN  17          HB2       GLN  17   4.461   1.291 -10.320
  133   2HB   GLN  17          HB3       GLN  17   4.522   3.036 -10.605
  134   1HG   GLN  17          HG2       GLN  17   7.006   2.710 -11.207
  135   2HG   GLN  17          HG3       GLN  17   6.672   0.979 -11.239
  136   1HE2  GLN  17          HE21      GLN  17   5.839   4.123 -12.783
  137   2HE2  GLN  17          HE22      GLN  17   5.255   3.379 -14.271
  138    H    MET  18           H        MET  18   3.817   1.096  -7.560
  139    HA   MET  18           HA       MET  18   2.001   3.181  -7.051
  140   1HB   MET  18          HB2       MET  18   0.963   1.680  -5.508
  141   2HB   MET  18          HB3       MET  18   1.479   0.812  -6.952
  142   1HG   MET  18          HG2       MET  18   3.460  -0.068  -5.713
  143   2HG   MET  18          HG3       MET  18   2.965   0.836  -4.282
  144   1HE   MET  18          HE1       MET  18   0.717  -2.897  -5.881
  145   2HE   MET  18          HE2       MET  18   0.674  -1.356  -6.758
  146   3HE   MET  18          HE3       MET  18   2.204  -2.255  -6.608
  147    H    ARG  19           H        ARG  19   4.874   2.337  -5.211
  148    HA   ARG  19           HA       ARG  19   4.253   3.970  -2.884
  149   1HB   ARG  19          HB2       ARG  19   7.012   3.107  -3.822
  150   2HB   ARG  19          HB3       ARG  19   6.488   3.503  -2.183
  151   1HG   ARG  19          HG2       ARG  19   4.816   1.495  -2.497
  152   2HG   ARG  19          HG3       ARG  19   5.818   1.067  -3.869
  153   1HD   ARG  19          HD2       ARG  19   6.364   0.817  -0.968
  154   2HD   ARG  19          HD3       ARG  19   6.805  -0.261  -2.282
  155    HE   ARG  19           HE       ARG  19   8.422   1.758  -1.049
  156   1HH1  ARG  19          HH12      ARG  19   8.148   0.284  -4.250
  157   2HH1  ARG  19          HH11      ARG  19   9.770   0.810  -4.646
  158   1HH2  ARG  19          HH22      ARG  19  10.313   2.363  -1.626
  159   2HH2  ARG  19          HH21      ARG  19  11.000   1.934  -3.172
  160    H    GLN  20           H        GLN  20   5.760   4.664  -5.971
  161    HA   GLN  20           HA       GLN  20   6.918   7.232  -5.309
  162   1HB   GLN  20          HB2       GLN  20   5.720   6.400  -7.978
  163   2HB   GLN  20          HB3       GLN  20   6.851   7.703  -7.675
  164   1HG   GLN  20          HG2       GLN  20   8.589   6.032  -6.968
  165   2HG   GLN  20          HG3       GLN  20   7.460   4.731  -7.338
  166   1HE2  GLN  20          HE21      GLN  20   8.637   3.766  -9.057
  167   2HE2  GLN  20          HE22      GLN  20   8.942   4.634 -10.559
  168    H    ILE  21           H        ILE  21   3.664   6.167  -6.178
  169    HA   ILE  21           HA       ILE  21   2.492   8.724  -6.564
  170    HB   ILE  21           HB       ILE  21   1.032   6.227  -5.583
  171   1HG1  ILE  21          HG12      ILE  21   1.985   6.897  -8.382
  172   2HG1  ILE  21          HG13      ILE  21   2.451   5.504  -7.406
  173   1HG2  ILE  21          HG21      ILE  21  -0.859   7.190  -6.804
  174   2HG2  ILE  21          HG22      ILE  21  -0.240   8.377  -5.663
  175   3HG2  ILE  21          HG23      ILE  21   0.163   8.525  -7.388
  176   1HD1  ILE  21          HD11      ILE  21  -0.268   5.924  -8.655
  177   2HD1  ILE  21          HD12      ILE  21   0.960   4.703  -9.046
  178   3HD1  ILE  21          HD13      ILE  21   0.131   4.634  -7.484
  179    H    ILE  22           H        ILE  22   2.894   6.623  -3.757
  180    HA   ILE  22           HA       ILE  22   1.410   8.304  -1.891
  181    HB   ILE  22           HB       ILE  22   3.404   6.098  -1.258
  182   1HG1  ILE  22          HG12      ILE  22   1.827   4.939  -2.547
  183   2HG1  ILE  22          HG13      ILE  22   1.288   4.695  -0.903
  184   1HG2  ILE  22          HG21      ILE  22   2.878   7.517   0.673
  185   2HG2  ILE  22          HG22      ILE  22   1.140   7.306   0.380
  186   3HG2  ILE  22          HG23      ILE  22   2.144   5.925   0.865
  187   1HD1  ILE  22          HD11      ILE  22   0.048   6.489  -3.025
  188   2HD1  ILE  22          HD12      ILE  22  -0.678   5.129  -2.159
  189   3HD1  ILE  22          HD13      ILE  22  -0.353   6.657  -1.305
  190    H    GLN  23           H        GLN  23   4.853   7.913  -2.673
  191    HA   GLN  23           HA       GLN  23   5.941   9.652  -0.723
  192   1HB   GLN  23          HB2       GLN  23   6.808   8.678  -3.450
  193   2HB   GLN  23          HB3       GLN  23   7.839   9.775  -2.535
  194   1HG   GLN  23          HG2       GLN  23   6.834   7.193  -1.281
  195   2HG   GLN  23          HG3       GLN  23   8.239   7.217  -2.343
  196   1HE2  GLN  23          HE21      GLN  23  10.029   6.951  -0.965
  197   2HE2  GLN  23          HE22      GLN  23  10.282   7.953   0.449
  198    H    GLN  24           H        GLN  24   3.925  10.605  -3.330
  199    HA   GLN  24           HA       GLN  24   4.720  13.452  -2.946
  200   1HB   GLN  24          HB2       GLN  24   4.139  13.830  -5.209
  201   2HB   GLN  24          HB3       GLN  24   5.336  12.520  -5.129
  202   1HG   GLN  24          HG2       GLN  24   3.415  10.902  -5.435
  203   2HG   GLN  24          HG3       GLN  24   2.356  12.289  -5.739
  204   1HE2  GLN  24          HE21      GLN  24   4.905  10.251  -7.016
  205   2HE2  GLN  24          HE22      GLN  24   4.927  10.963  -8.632
  206    H    ASN  25           H        ASN  25   2.074  11.153  -3.191
  207    HA   ASN  25           HA       ASN  25   0.266  13.132  -1.892
  208   1HB   ASN  25          HB2       ASN  25  -0.247  11.480  -4.354
  209   2HB   ASN  25          HB3       ASN  25  -1.564  11.735  -3.204
  210   1HD2  ASN  25          HD21      ASN  25  -1.924  14.015  -2.438
  211   2HD2  ASN  25          HD22      ASN  25  -1.824  15.243  -3.699
  212    HA   PRO  26           HA       PRO  26   0.733   9.388   0.775
  213   1HB   PRO  26          HB2       PRO  26   0.728  10.715   3.180
  214   2HB   PRO  26          HB3       PRO  26   2.192  10.475   2.173
  215   1HG   PRO  26          HG2       PRO  26   0.371  12.898   2.245
  216   2HG   PRO  26          HG3       PRO  26   2.163  12.858   2.390
  217   1HD   PRO  26          HD2       PRO  26   0.938  13.397   0.067
  218   2HD   PRO  26          HD3       PRO  26   2.393  12.348   0.077
  219    H    SER  27           H        SER  27  -1.561  12.026   0.629
  220    HA   SER  27           HA       SER  27  -3.737  11.035   2.151
  221   1HB   SER  27          HB2       SER  27  -5.083  12.414   0.532
  222   2HB   SER  27          HB3       SER  27  -3.752  13.270   1.321
  223    HG   SER  27           HG       SER  27  -3.919  13.601  -0.984
  224    H    LEU  28           H        LEU  28  -2.403   9.773  -0.827
  225    HA   LEU  28           HA       LEU  28  -4.849   8.174  -1.364
  226   1HB   LEU  28          HB2       LEU  28  -2.328   8.544  -3.016
  227   2HB   LEU  28          HB3       LEU  28  -3.757   7.621  -3.484
  228    HG   LEU  28           HG       LEU  28  -3.562  10.633  -3.141
  229   1HD1  LEU  28          HD11      LEU  28  -2.690   9.632  -5.241
  230   2HD1  LEU  28          HD12      LEU  28  -4.257   8.829  -5.493
  231   3HD1  LEU  28          HD13      LEU  28  -4.144  10.605  -5.533
  232   1HD2  LEU  28          HD21      LEU  28  -6.040   8.950  -3.720
  233   2HD2  LEU  28          HD22      LEU  28  -5.777  10.006  -2.309
  234   3HD2  LEU  28          HD23      LEU  28  -5.923  10.715  -3.916
  235    H    LEU  29           H        LEU  29  -2.301   7.689   0.676
  236    HA   LEU  29           HA       LEU  29  -1.566   4.991   0.133
  237   1HB   LEU  29          HB2       LEU  29  -0.419   6.357   1.755
  238   2HB   LEU  29          HB3       LEU  29  -1.823   6.508   2.762
  239    HG   LEU  29           HG       LEU  29  -1.792   4.125   3.320
  240   1HD1  LEU  29          HD11      LEU  29   0.131   2.698   2.651
  241   2HD1  LEU  29          HD12      LEU  29  -0.878   3.127   1.270
  242   3HD1  LEU  29          HD13      LEU  29   0.667   3.971   1.525
  243   1HD2  LEU  29          HD21      LEU  29   0.958   5.404   3.610
  244   2HD2  LEU  29          HD22      LEU  29  -0.444   5.699   4.663
  245   3HD2  LEU  29          HD23      LEU  29   0.298   4.092   4.610
  246    HA   PRO  30           HA       PRO  30  -5.689   3.683   2.547
  247   1HB   PRO  30          HB2       PRO  30  -7.333   6.041   1.629
  248   2HB   PRO  30          HB3       PRO  30  -7.459   5.109   3.131
  249   1HG   PRO  30          HG2       PRO  30  -6.298   7.617   2.803
  250   2HG   PRO  30          HG3       PRO  30  -5.917   6.503   4.163
  251   1HD   PRO  30          HD2       PRO  30  -4.232   7.298   1.902
  252   2HD   PRO  30          HD3       PRO  30  -3.791   6.372   3.355
  253    H    ALA  31           H        ALA  31  -5.989   5.828  -0.256
  254    HA   ALA  31           HA       ALA  31  -7.775   4.233  -1.756
  255   1HB   ALA  31          HB1       ALA  31  -5.820   6.348  -2.743
  256   2HB   ALA  31          HB2       ALA  31  -7.361   5.867  -3.482
  257   3HB   ALA  31          HB3       ALA  31  -7.346   6.690  -1.900
  258    H    LEU  32           H        LEU  32  -4.389   3.647  -1.255
  259    HA   LEU  32           HA       LEU  32  -4.147   2.009  -3.737
  260   1HB   LEU  32          HB2       LEU  32  -2.310   3.539  -3.232
  261   2HB   LEU  32          HB3       LEU  32  -2.206   2.879  -1.587
  262    HG   LEU  32           HG       LEU  32  -1.407   0.750  -2.416
  263   1HD1  LEU  32          HD11      LEU  32  -0.847   0.401  -4.796
  264   2HD1  LEU  32          HD12      LEU  32  -2.580   0.620  -4.590
  265   3HD1  LEU  32          HD13      LEU  32  -1.597   1.966  -5.207
  266   1HD2  LEU  32          HD21      LEU  32   0.784   1.489  -3.202
  267   2HD2  LEU  32          HD22      LEU  32   0.111   3.053  -3.702
  268   3HD2  LEU  32          HD23      LEU  32   0.164   2.615  -1.979
  269    H    LEU  33           H        LEU  33  -4.091   1.797  -0.151
  270    HA   LEU  33           HA       LEU  33  -3.906  -1.056   0.057
  271   1HB   LEU  33          HB2       LEU  33  -5.274   1.043   1.777
  272   2HB   LEU  33          HB3       LEU  33  -5.034  -0.636   2.267
  273    HG   LEU  33           HG       LEU  33  -2.611   0.987   1.425
  274   1HD1  LEU  33          HD11      LEU  33  -3.972   1.121   4.136
  275   2HD1  LEU  33          HD12      LEU  33  -2.346   1.749   3.745
  276   3HD1  LEU  33          HD13      LEU  33  -3.772   2.439   2.953
  277   1HD2  LEU  33          HD21      LEU  33  -3.055  -1.216   3.481
  278   2HD2  LEU  33          HD22      LEU  33  -2.356  -1.422   1.861
  279   3HD2  LEU  33          HD23      LEU  33  -1.500  -0.451   3.070
  280    H    GLN  34           H        GLN  34  -6.755   1.106  -0.319
  281    HA   GLN  34           HA       GLN  34  -8.736  -0.950  -0.509
  282   1HB   GLN  34          HB2       GLN  34  -8.582   1.891  -1.580
  283   2HB   GLN  34          HB3       GLN  34 -10.006   0.869  -1.781
  284   1HG   GLN  34          HG2       GLN  34 -10.289   0.648   0.628
  285   2HG   GLN  34          HG3       GLN  34  -8.815   1.556   0.941
  286   1HE2  GLN  34          HE21      GLN  34 -12.233   1.828   0.221
  287   2HE2  GLN  34          HE22      GLN  34 -12.259   3.587   0.187
  288    H    GLN  35           H        GLN  35  -6.366   0.177  -2.919
  289    HA   GLN  35           HA       GLN  35  -7.804  -1.101  -5.144
  290   1HB   GLN  35          HB2       GLN  35  -6.670   0.944  -5.614
  291   2HB   GLN  35          HB3       GLN  35  -5.176   0.402  -4.845
  292   1HG   GLN  35          HG2       GLN  35  -4.707  -1.150  -6.583
  293   2HG   GLN  35          HG3       GLN  35  -6.313  -0.928  -7.310
  294   1HE2  GLN  35          HE21      GLN  35  -5.749  -0.058  -9.347
  295   2HE2  GLN  35          HE22      GLN  35  -4.800   1.420  -9.512
  296    H    ILE  36           H        ILE  36  -4.876  -1.752  -3.196
  297    HA   ILE  36           HA       ILE  36  -4.185  -4.285  -4.305
  298    HB   ILE  36           HB       ILE  36  -3.881  -3.225  -1.495
  299   1HG1  ILE  36          HG12      ILE  36  -1.732  -3.417  -3.658
  300   2HG1  ILE  36          HG13      ILE  36  -2.729  -1.980  -3.496
  301   1HG2  ILE  36          HG21      ILE  36  -2.190  -4.957  -1.132
  302   2HG2  ILE  36          HG22      ILE  36  -3.633  -5.790  -1.691
  303   3HG2  ILE  36          HG23      ILE  36  -2.305  -5.506  -2.813
  304   1HD1  ILE  36          HD11      ILE  36  -0.878  -3.106  -1.373
  305   2HD1  ILE  36          HD12      ILE  36  -0.682  -1.612  -2.304
  306   3HD1  ILE  36          HD13      ILE  36  -2.002  -1.746  -1.119
  307    H    GLY  37           H        GLY  37  -6.594  -3.412  -1.726
  308   1HA   GLY  37          HA2       GLY  37  -7.535  -5.995  -1.172
  309   2HA   GLY  37          HA3       GLY  37  -8.449  -4.496  -0.993
  310    H    ARG  38           H        ARG  38  -7.949  -4.410  -4.200
  311    HA   ARG  38           HA       ARG  38 -10.197  -6.256  -4.954
  312   1HB   ARG  38          HB2       ARG  38  -9.202  -3.710  -6.270
  313   2HB   ARG  38          HB3       ARG  38 -10.497  -4.746  -6.876
  314   1HG   ARG  38          HG2       ARG  38 -10.532  -3.301  -4.196
  315   2HG   ARG  38          HG3       ARG  38 -11.301  -2.754  -5.684
  316   1HD   ARG  38          HD2       ARG  38 -11.979  -5.302  -4.156
  317   2HD   ARG  38          HD3       ARG  38 -12.889  -3.788  -4.145
  318    HE   ARG  38           HE       ARG  38 -12.751  -4.477  -6.836
  319   1HH1  ARG  38          HH12      ARG  38 -14.118  -5.996  -3.985
  320   2HH1  ARG  38          HH11      ARG  38 -15.350  -6.828  -4.909
  321   1HH2  ARG  38          HH22      ARG  38 -14.329  -5.574  -7.951
  322   2HH2  ARG  38          HH21      ARG  38 -15.462  -6.585  -7.092
  323    H    GLU  39           H        GLU  39  -6.974  -5.047  -6.124
  324    HA   GLU  39           HA       GLU  39  -6.814  -6.888  -8.276
  325   1HB   GLU  39          HB2       GLU  39  -5.973  -4.502  -7.906
  326   2HB   GLU  39          HB3       GLU  39  -4.783  -5.171  -6.791
  327   1HG   GLU  39          HG2       GLU  39  -3.768  -4.725  -8.779
  328   2HG   GLU  39          HG3       GLU  39  -3.860  -6.502  -8.685
  329    H    ASN  40           H        ASN  40  -5.657  -6.935  -4.935
  330    HA   ASN  40           HA       ASN  40  -4.584  -9.677  -5.115
  331   1HB   ASN  40          HB2       ASN  40  -2.957  -7.240  -4.247
  332   2HB   ASN  40          HB3       ASN  40  -2.487  -8.931  -4.010
  333   1HD2  ASN  40          HD22      ASN  40  -1.664 -10.152  -5.670
  334   2HD2  ASN  40          HD21      ASN  40  -0.862  -9.234  -6.937
  335    HA   PRO  41           HA       PRO  41  -6.850  -8.163  -1.196
  336   1HB   PRO  41          HB2       PRO  41  -8.557 -10.321  -0.849
  337   2HB   PRO  41          HB3       PRO  41  -8.918  -8.846  -1.806
  338   1HG   PRO  41          HG2       PRO  41  -7.839 -11.475  -2.819
  339   2HG   PRO  41          HG3       PRO  41  -9.228 -10.529  -3.456
  340   1HD   PRO  41          HD2       PRO  41  -6.816 -10.333  -4.614
  341   2HD   PRO  41          HD3       PRO  41  -7.767  -8.843  -4.323
  342    H    GLN  42           H        GLN  42  -5.305 -11.230  -1.972
  343    HA   GLN  42           HA       GLN  42  -4.784 -12.104   0.738
  344   1HB   GLN  42          HB2       GLN  42  -3.300 -12.706  -1.849
  345   2HB   GLN  42          HB3       GLN  42  -3.207 -13.639  -0.342
  346   1HG   GLN  42          HG2       GLN  42  -5.693 -14.035  -0.522
  347   2HG   GLN  42          HG3       GLN  42  -5.658 -13.282  -2.116
  348   1HE2  GLN  42          HE21      GLN  42  -5.868 -16.276  -0.817
  349   2HE2  GLN  42          HE22      GLN  42  -4.941 -17.175  -2.013
  350    H    LEU  43           H        LEU  43  -2.943 -10.100  -1.587
  351    HA   LEU  43           HA       LEU  43  -0.622  -9.723   0.146
  352   1HB   LEU  43          HB2       LEU  43  -0.563  -9.398  -2.327
  353   2HB   LEU  43          HB3       LEU  43  -1.713  -8.077  -2.194
  354    HG   LEU  43           HG       LEU  43  -0.165  -6.683  -1.033
  355   1HD1  LEU  43          HD11      LEU  43   2.177  -7.281  -0.637
  356   2HD1  LEU  43          HD12      LEU  43   1.128  -8.350   0.292
  357   3HD1  LEU  43          HD13      LEU  43   1.888  -8.935  -1.213
  358   1HD2  LEU  43          HD21      LEU  43   1.461  -6.361  -2.819
  359   2HD2  LEU  43          HD22      LEU  43   1.183  -8.018  -3.411
  360   3HD2  LEU  43          HD23      LEU  43  -0.108  -6.798  -3.509
  361    H    LEU  44           H        LEU  44  -3.774  -8.246  -0.291
  362    HA   LEU  44           HA       LEU  44  -3.174  -5.842   1.180
  363   1HB   LEU  44          HB2       LEU  44  -5.203  -6.318  -0.339
  364   2HB   LEU  44          HB3       LEU  44  -5.942  -7.124   1.009
  365    HG   LEU  44           HG       LEU  44  -6.357  -4.571   0.422
  366   1HD1  LEU  44          HD11      LEU  44  -7.231  -4.176   2.592
  367   2HD1  LEU  44          HD12      LEU  44  -7.576  -5.823   2.065
  368   3HD1  LEU  44          HD13      LEU  44  -6.292  -5.534   3.277
  369   1HD2  LEU  44          HD21      LEU  44  -4.053  -3.753   0.838
  370   2HD2  LEU  44          HD22      LEU  44  -5.268  -2.987   1.872
  371   3HD2  LEU  44          HD23      LEU  44  -4.211  -4.228   2.551
  372    H    GLN  45           H        GLN  45  -5.009  -8.682   2.168
  373    HA   GLN  45           HA       GLN  45  -5.072  -8.351   4.957
  374   1HB   GLN  45          HB2       GLN  45  -4.747 -10.886   3.310
  375   2HB   GLN  45          HB3       GLN  45  -5.010 -10.905   5.051
  376   1HG   GLN  45          HG2       GLN  45  -6.933  -9.598   3.075
  377   2HG   GLN  45          HG3       GLN  45  -7.083 -11.249   3.682
  378   1HE2  GLN  45          HE21      GLN  45  -7.645 -11.577   5.966
  379   2HE2  GLN  45          HE22      GLN  45  -8.332 -10.242   6.881
  380    H    GLN  46           H        GLN  46  -2.274  -9.582   3.054
  381    HA   GLN  46           HA       GLN  46  -0.627 -10.143   5.375
  382   1HB   GLN  46          HB2       GLN  46  -0.170  -9.802   2.395
  383   2HB   GLN  46          HB3       GLN  46   1.193  -9.922   3.498
  384   1HG   GLN  46          HG2       GLN  46   0.402 -12.089   4.332
  385   2HG   GLN  46          HG3       GLN  46  -1.077 -11.968   3.386
  386   1HE2  GLN  46          HE21      GLN  46  -0.957 -12.151   1.072
  387   2HE2  GLN  46          HE22      GLN  46   0.421 -12.968   0.313
  388    H    ILE  47           H        ILE  47  -0.807  -7.294   3.179
  389    HA   ILE  47           HA       ILE  47   1.142  -5.707   4.543
  390    HB   ILE  47           HB       ILE  47  -1.188  -5.075   2.736
  391   1HG1  ILE  47          HG12      ILE  47   1.843  -4.746   2.457
  392   2HG1  ILE  47          HG13      ILE  47   0.954  -6.171   1.912
  393   1HG2  ILE  47          HG21      ILE  47  -1.061  -3.130   4.215
  394   2HG2  ILE  47          HG22      ILE  47   0.710  -3.077   4.047
  395   3HG2  ILE  47          HG23      ILE  47  -0.348  -2.713   2.666
  396   1HD1  ILE  47          HD11      ILE  47   1.298  -4.816   0.002
  397   2HD1  ILE  47          HD12      ILE  47  -0.422  -4.683   0.428
  398   3HD1  ILE  47          HD13      ILE  47   0.707  -3.357   0.816
  399    H    SER  48           H        SER  48  -2.368  -6.145   5.176
  400    HA   SER  48           HA       SER  48  -2.489  -4.236   7.323
  401   1HB   SER  48          HB2       SER  48  -4.187  -6.698   6.780
  402   2HB   SER  48          HB3       SER  48  -4.524  -5.497   8.037
  403    HG   SER  48           HG       SER  48  -5.642  -5.032   6.104
  404    H    GLN  49           H        GLN  49  -1.570  -7.677   7.304
  405    HA   GLN  49           HA       GLN  49  -1.305  -7.958  10.165
  406   1HB   GLN  49          HB2       GLN  49  -0.348  -9.522   7.748
  407   2HB   GLN  49          HB3       GLN  49   0.124  -9.988   9.381
  408   1HG   GLN  49          HG2       GLN  49  -2.197 -10.246  10.060
  409   2HG   GLN  49          HG3       GLN  49  -2.780  -9.684   8.499
  410   1HE2  GLN  49          HE21      GLN  49  -2.532 -12.466  10.195
  411   2HE2  GLN  49          HE22      GLN  49  -2.221 -13.582   8.867
  412    H    HIS  50           H        HIS  50   0.797  -6.470   7.815
  413    HA   HIS  50           HA       HIS  50   3.027  -6.287   9.800
  414   1HB   HIS  50          HB2       HIS  50   3.265  -7.026   6.862
  415   2HB   HIS  50          HB3       HIS  50   4.604  -6.860   8.004
  416    HD1  HIS  50           HD1      HIS  50   4.170  -8.718  10.271
  417    HD2  HIS  50           HD2      HIS  50   2.617  -9.496   6.445
  418    HE1  HIS  50           HE1      HIS  50   3.706 -11.216  10.184
  419    H    GLN  51           H        GLN  51   1.036  -4.259   9.015
  420    HA   GLN  51           HA       GLN  51   1.718  -2.757   6.854
  421   1HB   GLN  51          HB2       GLN  51  -0.376  -2.767   8.401
  422   2HB   GLN  51          HB3       GLN  51   0.443  -1.463   9.275
  423   1HG   GLN  51          HG2       GLN  51   0.549  -0.152   7.147
  424   2HG   GLN  51          HG3       GLN  51  -0.178  -1.518   6.290
  425   1HE2  GLN  51          HE21      GLN  51  -2.211  -0.743   5.676
  426   2HE2  GLN  51          HE22      GLN  51  -3.354  -0.046   6.825
  427    H    GLU  52           H        GLU  52   3.192  -2.295  10.061
  428    HA   GLU  52           HA       GLU  52   4.442   0.208   9.603
  429   1HB   GLU  52          HB2       GLU  52   4.232  -1.021  11.766
  430   2HB   GLU  52          HB3       GLU  52   5.435  -2.189  11.203
  431   1HG   GLU  52          HG2       GLU  52   7.109  -0.399  11.025
  432   2HG   GLU  52          HG3       GLU  52   5.888   0.805  11.447
  433    H    HIS  53           H        HIS  53   5.422  -3.088   8.577
  434    HA   HIS  53           HA       HIS  53   8.021  -2.217   7.604
  435   1HB   HIS  53          HB2       HIS  53   7.485  -4.518   8.447
  436   2HB   HIS  53          HB3       HIS  53   6.499  -4.779   7.009
  437    HD1  HIS  53           HD1      HIS  53  10.113  -3.322   7.330
  438    HD2  HIS  53           HD2      HIS  53   7.893  -6.383   5.495
  439    HE1  HIS  53           HE1      HIS  53  11.736  -4.587   5.832
  440    H    PHE  54           H        PHE  54   4.800  -2.674   6.129
  441    HA   PHE  54           HA       PHE  54   5.627  -1.991   3.416
  442   1HB   PHE  54          HB2       PHE  54   3.421  -3.052   4.026
  443   2HB   PHE  54          HB3       PHE  54   2.947  -1.538   4.791
  444    HD1  PHE  54           HD1      PHE  54   1.280  -0.506   3.504
  445    HD2  PHE  54           HD2      PHE  54   4.589  -2.390   1.475
  446    HE1  PHE  54           HE1      PHE  54   0.343   0.187   1.314
  447    HE2  PHE  54           HE2      PHE  54   3.661  -1.664  -0.704
  448    HZ   PHE  54           HZ       PHE  54   1.533  -0.382  -0.791
  449    H    ILE  55           H        ILE  55   4.475   0.035   6.133
  450    HA   ILE  55           HA       ILE  55   4.779   2.536   4.841
  451    HB   ILE  55           HB       ILE  55   4.712   1.669   7.691
  452   1HG1  ILE  55          HG12      ILE  55   2.887   3.378   5.930
  453   2HG1  ILE  55          HG13      ILE  55   2.707   1.634   6.134
  454   1HG2  ILE  55          HG21      ILE  55   6.183   3.662   7.702
  455   2HG2  ILE  55          HG22      ILE  55   5.006   4.546   6.702
  456   3HG2  ILE  55          HG23      ILE  55   4.610   4.061   8.366
  457   1HD1  ILE  55          HD11      ILE  55   1.141   2.706   7.563
  458   2HD1  ILE  55          HD12      ILE  55   2.403   1.971   8.581
  459   3HD1  ILE  55          HD13      ILE  55   2.390   3.734   8.289
  460    H    GLN  56           H        GLN  56   7.308   0.621   6.574
  461    HA   GLN  56           HA       GLN  56   9.425   2.533   6.237
  462   1HB   GLN  56          HB2       GLN  56   9.427  -0.510   6.386
  463   2HB   GLN  56          HB3       GLN  56  10.903   0.446   6.335
  464   1HG   GLN  56          HG2       GLN  56  10.447   1.488   8.439
  465   2HG   GLN  56          HG3       GLN  56   8.822   0.822   8.524
  466   1HE2  GLN  56          HE21      GLN  56  10.721   0.442  10.617
  467   2HE2  GLN  56          HE22      GLN  56  11.120  -1.273  10.655
  468    H    MET  57           H        MET  57   8.554  -0.266   4.093
  469    HA   MET  57           HA       MET  57  10.524   0.382   2.101
  470   1HB   MET  57          HB2       MET  57   7.949  -1.230   1.969
  471   2HB   MET  57          HB3       MET  57   9.085  -1.080   0.615
  472   1HG   MET  57          HG2       MET  57  10.903  -1.984   2.001
  473   2HG   MET  57          HG3       MET  57   9.796  -2.189   3.357
  474   1HE   MET  57          HE1       MET  57   7.146  -3.400   2.227
  475   2HE   MET  57          HE2       MET  57   7.543  -5.127   2.355
  476   3HE   MET  57          HE3       MET  57   8.069  -4.002   3.626
  477    H    LEU  58           H        LEU  58   7.122   1.329   2.414
  478    HA   LEU  58           HA       LEU  58   6.690   2.816   0.074
  479   1HB   LEU  58          HB2       LEU  58   5.716   2.707   2.905
  480   2HB   LEU  58          HB3       LEU  58   5.328   4.195   2.044
  481    HG   LEU  58           HG       LEU  58   4.602   1.412   1.037
  482   1HD1  LEU  58          HD11      LEU  58   3.006   3.475   2.641
  483   2HD1  LEU  58          HD12      LEU  58   2.311   2.054   1.831
  484   3HD1  LEU  58          HD13      LEU  58   3.454   1.836   3.164
  485   1HD2  LEU  58          HD21      LEU  58   3.059   2.700  -0.406
  486   2HD2  LEU  58          HD22      LEU  58   3.659   4.221   0.321
  487   3HD2  LEU  58          HD23      LEU  58   4.739   3.228  -0.666
  488    H    ASN  59           H        ASN  59   8.506   3.643   2.907
  489    HA   ASN  59           HA       ASN  59   8.815   6.502   2.265
  490   1HB   ASN  59          HB2       ASN  59   9.277   4.700   4.618
  491   2HB   ASN  59          HB3       ASN  59  10.396   6.033   4.474
  492   1HD2  ASN  59          HD22      ASN  59   7.093   5.146   5.106
  493   2HD2  ASN  59          HD21      ASN  59   6.547   6.770   5.546
  494    H    GLU  60           H        GLU  60  10.517   3.683   1.338
  495    HA   GLU  60           HA       GLU  60  13.200   4.678   1.351
  496   1HB   GLU  60          HB2       GLU  60  11.803   2.520  -0.220
  497   2HB   GLU  60          HB3       GLU  60  13.515   2.881  -0.439
  498   1HG   GLU  60          HG2       GLU  60  12.250   2.120   2.225
  499   2HG   GLU  60          HG3       GLU  60  13.077   1.017   1.128
  500    HA   PRO  61           HA       PRO  61  13.553   7.596  -1.954
  501   1HB   PRO  61          HB2       PRO  61  15.829   5.880  -2.953
  502   2HB   PRO  61          HB3       PRO  61  15.748   7.662  -2.716
  503   1HG   PRO  61          HG2       PRO  61  16.963   6.032  -0.907
  504   2HG   PRO  61          HG3       PRO  61  16.046   7.494  -0.427
  505   1HD   PRO  61          HD2       PRO  61  15.263   4.634  -0.149
  506   2HD   PRO  61          HD3       PRO  61  14.782   6.095   0.779
  507    H    VAL  62           H        VAL  62  12.303   7.864  -3.690
  508    HA   VAL  62           HA       VAL  62  11.149   5.801  -5.224
  509    HB   VAL  62           HB       VAL  62  10.408   7.632  -6.710
  510   1HG1  VAL  62          HG11      VAL  62   8.969   8.715  -5.090
  511   2HG1  VAL  62          HG12      VAL  62   9.182   7.013  -4.640
  512   3HG1  VAL  62          HG13      VAL  62  10.057   8.282  -3.758
  513   1HG2  VAL  62          HG21      VAL  62  10.807   9.976  -6.148
  514   2HG2  VAL  62          HG22      VAL  62  11.956   9.519  -4.879
  515   3HG2  VAL  62          HG23      VAL  62  12.326   9.189  -6.586
  516    H    GLN  63           H        GLN  63  11.446   5.030  -7.248
  517    HA   GLN  63           HA       GLN  63  12.550   4.188  -9.017
  518   1HB   GLN  63          HB2       GLN  63  13.543   7.047  -9.309
  519   2HB   GLN  63          HB3       GLN  63  13.551   5.814 -10.575
  520   1HG   GLN  63          HG2       GLN  63  11.100   5.630 -10.465
  521   2HG   GLN  63          HG3       GLN  63  11.048   6.853  -9.189
  522   1HE2  GLN  63          HE21      GLN  63   9.482   7.751 -10.857
  523   2HE2  GLN  63          HE22      GLN  63  10.175   8.846 -12.053
  524    H    GLU  64           H        GLU  64  14.149   4.277  -6.379
  525    HA   GLU  64           HA       GLU  64  16.718   3.306  -7.542
  526   1HB   GLU  64          HB2       GLU  64  16.897   5.748  -7.041
  527   2HB   GLU  64          HB3       GLU  64  16.542   5.403  -5.343
  528   1HG   GLU  64          HG2       GLU  64  18.597   4.085  -5.151
  529   2HG   GLU  64          HG3       GLU  64  18.887   4.217  -6.884
  530    H    ALA  65           H        ALA  65  14.532   3.399  -4.702
  531    HA   ALA  65           HA       ALA  65  15.828   0.926  -3.663
  532   1HB   ALA  65          HB1       ALA  65  16.815   2.900  -2.560
  533   2HB   ALA  65          HB2       ALA  65  15.192   3.471  -2.125
  534   3HB   ALA  65          HB3       ALA  65  15.831   1.969  -1.419
  535    H    GLY  66           H        GLY  66  14.584  -0.013  -1.830
  536   1HA   GLY  66          HA2       GLY  66  12.012   0.116  -1.033
  537   2HA   GLY  66          HA3       GLY  66  11.814  -0.483  -2.686
  538    H    GLY  67           H        GLY  67  10.853  -2.340  -1.466
  539   1HA   GLY  67          HA2       GLY  67  12.390  -4.256  -0.025
  540   2HA   GLY  67          HA3       GLY  67  10.926  -4.576  -0.955
  541    H    GLN  68           H        GLN  68  12.705  -3.402  -3.327
  542    HA   GLN  68           HA       GLN  68  13.359  -5.843  -4.587
  543   1HB   GLN  68          HB2       GLN  68  14.284  -4.445  -6.343
  544   2HB   GLN  68          HB3       GLN  68  12.765  -3.785  -5.753
  545   1HG   GLN  68          HG2       GLN  68  14.045  -2.093  -4.398
  546   2HG   GLN  68          HG3       GLN  68  15.550  -2.770  -5.021
  547   1HE2  GLN  68          HE21      GLN  68  16.095  -0.641  -5.960
  548   2HE2  GLN  68          HE22      GLN  68  15.268  -0.136  -7.425
  549    H    GLY  69           H        GLY  69  15.213  -4.442  -2.103
  550   1HA   GLY  69          HA2       GLY  69  17.338  -6.363  -2.467
  551   2HA   GLY  69          HA3       GLY  69  17.892  -4.728  -2.825
  552    H    GLY  70           H        GLY  70  19.180  -5.950  -0.895
  553   1HA   GLY  70          HA2       GLY  70  18.764  -4.388   1.508
  554   2HA   GLY  70          HA3       GLY  70  18.227  -6.056   1.726
  555    H    GLY  71           H        GLY  71  21.027  -4.923  -0.203
  556   1HA   GLY  71          HA2       GLY  71  22.734  -6.986   0.894
  557   2HA   GLY  71          HA3       GLY  71  23.167  -5.769  -0.302
  558    H    GLY  72           H        GLY  72  22.099  -3.881   2.129
  559   1HA   GLY  72          HA2       GLY  72  24.134  -3.981   4.159
  560   2HA   GLY  72          HA3       GLY  72  24.560  -2.793   2.924
  Start of MODEL   19
    1   1H    GLY   1           H1       GLY   1  19.589 -12.564  11.160
    2   2H    GLY   1           H2       GLY   1  18.332 -13.494  11.655
    3   3H    GLY   1           H3       GLY   1  19.722 -13.460  12.530
    4   1HA   GLY   1          HA2       GLY   1  18.025 -12.153  13.625
    5   2HA   GLY   1          HA3       GLY   1  19.395 -11.153  13.105
    6    H    SER   2           H        SER   2  16.735 -10.239  13.622
    7    HA   SER   2           HA       SER   2  15.030  -8.993  12.842
    8   1HB   SER   2          HB2       SER   2  17.037  -7.731  11.929
    9   2HB   SER   2          HB3       SER   2  16.631  -8.413  10.346
   10    HG   SER   2           HG       SER   2  15.667  -6.344  10.785
   11    H    HIS   3           H        HIS   3  13.750  -8.483  10.551
   12    HA   HIS   3           HA       HIS   3  13.085 -10.943   9.098
   13   1HB   HIS   3          HB2       HIS   3  10.645 -10.771   9.862
   14   2HB   HIS   3          HB3       HIS   3  11.800 -11.460  10.984
   15    HD1  HIS   3           HD1      HIS   3  10.273  -7.865  10.501
   16    HD2  HIS   3           HD2      HIS   3  11.630 -10.606  13.391
   17    HE1  HIS   3           HE1      HIS   3   9.864  -6.786  12.746
   18    H    MET   4           H        MET   4  11.565 -10.659   7.421
   19    HA   MET   4           HA       MET   4  10.792  -7.933   6.590
   20   1HB   MET   4          HB2       MET   4  11.799  -8.231   4.347
   21   2HB   MET   4          HB3       MET   4  12.948  -7.989   5.652
   22   1HG   MET   4          HG2       MET   4  13.547 -10.347   5.664
   23   2HG   MET   4          HG3       MET   4  12.309 -10.711   4.454
   24   1HE   MET   4          HE1       MET   4  15.194 -11.757   4.070
   25   2HE   MET   4          HE2       MET   4  13.907 -11.952   2.859
   26   3HE   MET   4          HE3       MET   4  15.502 -11.343   2.370
   27    HA   PRO   5           HA       PRO   5   7.818 -11.461   5.998
   28   1HB   PRO   5          HB2       PRO   5   5.545 -10.318   7.041
   29   2HB   PRO   5          HB3       PRO   5   6.840 -11.056   8.030
   30   1HG   PRO   5          HG2       PRO   5   6.494  -8.130   7.312
   31   2HG   PRO   5          HG3       PRO   5   6.742  -8.840   8.944
   32   1HD   PRO   5          HD2       PRO   5   8.805  -7.823   7.537
   33   2HD   PRO   5          HD3       PRO   5   9.009  -9.340   8.467
   34    H    LEU   6           H        LEU   6   8.046  -8.494   4.463
   35    HA   LEU   6           HA       LEU   6   5.947  -9.163   2.443
   36   1HB   LEU   6          HB2       LEU   6   6.771  -6.415   3.452
   37   2HB   LEU   6          HB3       LEU   6   5.613  -6.729   2.157
   38    HG   LEU   6           HG       LEU   6   5.210  -7.540   5.069
   39   1HD1  LEU   6          HD11      LEU   6   5.193  -5.103   4.713
   40   2HD1  LEU   6          HD12      LEU   6   3.992  -5.294   3.423
   41   3HD1  LEU   6          HD13      LEU   6   3.575  -5.712   5.105
   42   1HD2  LEU   6          HD21      LEU   6   2.876  -7.946   4.388
   43   2HD2  LEU   6          HD22      LEU   6   3.289  -7.585   2.692
   44   3HD2  LEU   6          HD23      LEU   6   3.963  -9.014   3.504
   45    H    GLU   7           H        GLU   7   8.920  -9.747   2.617
   46    HA   GLU   7           HA       GLU   7  10.474  -8.199   0.923
   47   1HB   GLU   7          HB2       GLU   7  11.957  -9.974   0.769
   48   2HB   GLU   7          HB3       GLU   7  11.210 -10.148   2.340
   49   1HG   GLU   7          HG2       GLU   7  10.581 -11.790  -0.159
   50   2HG   GLU   7          HG3       GLU   7  11.593 -12.287   1.171
   51    H    PHE   8           H        PHE   8   7.942 -10.392  -0.166
   52    HA   PHE   8           HA       PHE   8   8.519 -10.639  -2.893
   53   1HB   PHE   8          HB2       PHE   8   6.678 -11.745  -1.728
   54   2HB   PHE   8          HB3       PHE   8   5.875 -10.198  -1.466
   55    HD1  PHE   8           HD1      PHE   8   7.318 -12.097  -4.409
   56    HD2  PHE   8           HD2      PHE   8   3.992  -9.865  -2.808
   57    HE1  PHE   8           HE1      PHE   8   6.073 -12.419  -6.533
   58    HE2  PHE   8           HE2      PHE   8   2.743 -10.221  -4.920
   59    HZ   PHE   8           HZ       PHE   8   3.787 -11.481  -6.792
   60    H    LEU   9           H        LEU   9   7.425  -7.725  -1.211
   61    HA   LEU   9           HA       LEU   9   6.689  -6.266  -3.620
   62   1HB   LEU   9          HB2       LEU   9   7.248  -5.245  -0.810
   63   2HB   LEU   9          HB3       LEU   9   6.394  -4.385  -2.083
   64    HG   LEU   9           HG       LEU   9   5.412  -6.886  -0.635
   65   1HD1  LEU   9          HD11      LEU   9   3.769  -5.377   0.344
   66   2HD1  LEU   9          HD12      LEU   9   5.405  -4.795   0.700
   67   3HD1  LEU   9          HD13      LEU   9   4.443  -4.002  -0.566
   68   1HD2  LEU   9          HD21      LEU   9   4.523  -6.901  -2.909
   69   2HD2  LEU   9          HD22      LEU   9   3.255  -6.430  -1.771
   70   3HD2  LEU   9          HD23      LEU   9   4.046  -5.190  -2.765
   71    H    ARG  10           H        ARG  10   9.773  -7.021  -2.385
   72    HA   ARG  10           HA       ARG  10  11.008  -4.455  -2.457
   73   1HB   ARG  10          HB2       ARG  10  12.987  -5.532  -1.854
   74   2HB   ARG  10          HB3       ARG  10  11.708  -6.512  -1.153
   75   1HG   ARG  10          HG2       ARG  10  11.944  -8.001  -3.285
   76   2HG   ARG  10          HG3       ARG  10  13.437  -7.106  -3.591
   77   1HD   ARG  10          HD2       ARG  10  14.332  -7.767  -1.405
   78   2HD   ARG  10          HD3       ARG  10  12.845  -8.638  -1.023
   79    HE   ARG  10           HE       ARG  10  15.045  -9.531  -2.697
   80   1HH1  ARG  10          HH22      ARG  10  11.588 -10.006  -2.264
   81   2HH1  ARG  10          HH21      ARG  10  11.646 -11.620  -2.938
   82   1HH2  ARG  10          HH12      ARG  10  15.027 -11.568  -3.561
   83   2HH2  ARG  10          HH11      ARG  10  13.535 -12.466  -3.661
   84    H    ASN  11           H        ASN  11  10.419  -6.529  -5.136
   85    HA   ASN  11           HA       ASN  11  12.296  -4.925  -6.845
   86   1HB   ASN  11          HB2       ASN  11  13.304  -7.070  -6.034
   87   2HB   ASN  11          HB3       ASN  11  11.994  -7.955  -6.824
   88   1HD2  ASN  11          HD21      ASN  11  12.712  -8.838  -8.742
   89   2HD2  ASN  11          HD22      ASN  11  13.872  -8.052  -9.810
   90    H    GLN  12           H        GLN  12   9.124  -6.366  -6.677
   91    HA   GLN  12           HA       GLN  12   8.595  -6.710  -9.467
   92   1HB   GLN  12          HB2       GLN  12   6.736  -6.043  -7.164
   93   2HB   GLN  12          HB3       GLN  12   6.206  -6.588  -8.749
   94   1HG   GLN  12          HG2       GLN  12   7.927  -8.202  -6.816
   95   2HG   GLN  12          HG3       GLN  12   6.189  -8.382  -7.026
   96   1HE2  GLN  12          HE21      GLN  12   8.066 -10.522  -7.363
   97   2HE2  GLN  12          HE22      GLN  12   8.016 -10.985  -9.062
   98    HA   PRO  13           HA       PRO  13   8.767  -2.306 -10.569
   99   1HB   PRO  13          HB2       PRO  13   7.152  -3.302 -12.924
  100   2HB   PRO  13          HB3       PRO  13   8.529  -2.159 -12.905
  101   1HG   PRO  13          HG2       PRO  13   8.935  -4.729 -13.607
  102   2HG   PRO  13          HG3       PRO  13  10.084  -3.927 -12.486
  103   1HD   PRO  13          HD2       PRO  13   7.814  -5.808 -11.823
  104   2HD   PRO  13          HD3       PRO  13   9.490  -5.783 -11.190
  105    H    GLN  14           H        GLN  14   5.662  -4.046 -10.870
  106    HA   GLN  14           HA       GLN  14   3.917  -1.805 -10.713
  107   1HB   GLN  14          HB2       GLN  14   2.189  -3.453 -10.196
  108   2HB   GLN  14          HB3       GLN  14   3.208  -3.962 -11.537
  109   1HG   GLN  14          HG2       GLN  14   4.440  -5.515 -10.031
  110   2HG   GLN  14          HG3       GLN  14   3.470  -4.962  -8.665
  111   1HE2  GLN  14          HE21      GLN  14   2.102  -6.643  -8.131
  112   2HE2  GLN  14          HE22      GLN  14   1.164  -7.559  -9.311
  113    H    PHE  15           H        PHE  15   5.839  -3.185  -8.184
  114    HA   PHE  15           HA       PHE  15   4.235  -1.820  -6.073
  115   1HB   PHE  15          HB2       PHE  15   6.151  -4.167  -5.885
  116   2HB   PHE  15          HB3       PHE  15   5.304  -3.425  -4.535
  117    HD1  PHE  15           HD1      PHE  15   5.316  -6.392  -5.486
  118    HD2  PHE  15           HD2      PHE  15   2.514  -3.149  -6.005
  119    HE1  PHE  15           HE1      PHE  15   3.463  -8.011  -5.663
  120    HE2  PHE  15           HE2      PHE  15   0.667  -4.776  -6.138
  121    HZ   PHE  15           HZ       PHE  15   1.124  -7.213  -5.952
  122    H    GLN  16           H        GLN  16   6.948  -1.377  -7.941
  123    HA   GLN  16           HA       GLN  16   8.353   0.270  -5.888
  124   1HB   GLN  16          HB2       GLN  16   8.890  -0.023  -8.867
  125   2HB   GLN  16          HB3       GLN  16   9.915   0.776  -7.674
  126   1HG   GLN  16          HG2       GLN  16   9.606  -2.106  -8.342
  127   2HG   GLN  16          HG3       GLN  16  11.049  -1.200  -7.950
  128   1HE2  GLN  16          HE21      GLN  16   8.732  -3.408  -6.799
  129   2HE2  GLN  16          HE22      GLN  16   9.217  -3.423  -5.111
  130    H    GLN  17           H        GLN  17   6.490   0.599  -8.940
  131    HA   GLN  17           HA       GLN  17   6.607   3.441  -9.104
  132   1HB   GLN  17          HB2       GLN  17   4.718   1.371 -10.275
  133   2HB   GLN  17          HB3       GLN  17   4.618   3.092 -10.674
  134   1HG   GLN  17          HG2       GLN  17   6.830   3.109 -11.631
  135   2HG   GLN  17          HG3       GLN  17   7.185   1.487 -11.034
  136   1HE2  GLN  17          HE21      GLN  17   5.944  -0.327 -11.932
  137   2HE2  GLN  17          HE22      GLN  17   5.335  -0.198 -13.592
  138    H    MET  18           H        MET  18   4.099   1.366  -7.570
  139    HA   MET  18           HA       MET  18   2.173   3.357  -7.080
  140   1HB   MET  18          HB2       MET  18   1.305   1.872  -5.432
  141   2HB   MET  18          HB3       MET  18   1.807   0.963  -6.856
  142   1HG   MET  18          HG2       MET  18   3.899   0.284  -5.663
  143   2HG   MET  18          HG3       MET  18   3.379   1.191  -4.242
  144   1HE   MET  18          HE1       MET  18   4.309  -1.480  -3.549
  145   2HE   MET  18          HE2       MET  18   3.339  -0.577  -2.365
  146   3HE   MET  18          HE3       MET  18   2.969  -2.283  -2.706
  147    H    ARG  19           H        ARG  19   5.140   2.757  -5.273
  148    HA   ARG  19           HA       ARG  19   4.467   4.414  -2.980
  149   1HB   ARG  19          HB2       ARG  19   7.286   3.886  -3.950
  150   2HB   ARG  19          HB3       ARG  19   6.698   4.043  -2.298
  151   1HG   ARG  19          HG2       ARG  19   5.524   1.805  -2.607
  152   2HG   ARG  19          HG3       ARG  19   6.309   1.674  -4.187
  153   1HD   ARG  19          HD2       ARG  19   8.544   2.079  -3.085
  154   2HD   ARG  19          HD3       ARG  19   7.749   1.862  -1.522
  155    HE   ARG  19           HE       ARG  19   7.250  -0.371  -3.297
  156   1HH1  ARG  19          HH22      ARG  19   9.746   0.956  -1.241
  157   2HH1  ARG  19          HH21      ARG  19  10.675  -0.487  -1.201
  158   1HH2  ARG  19          HH12      ARG  19   8.423  -2.309  -3.093
  159   2HH2  ARG  19          HH11      ARG  19   9.983  -2.250  -2.309
  160    H    GLN  20           H        GLN  20   5.931   5.063  -6.121
  161    HA   GLN  20           HA       GLN  20   6.915   7.723  -5.604
  162   1HB   GLN  20          HB2       GLN  20   5.761   6.651  -8.215
  163   2HB   GLN  20          HB3       GLN  20   6.742   8.087  -8.011
  164   1HG   GLN  20          HG2       GLN  20   8.636   6.662  -7.193
  165   2HG   GLN  20          HG3       GLN  20   7.666   5.223  -7.543
  166   1HE2  GLN  20          HE21      GLN  20   9.555   7.852  -8.994
  167   2HE2  GLN  20          HE22      GLN  20   9.484   7.193 -10.627
  168    H    ILE  21           H        ILE  21   3.705   6.459  -6.369
  169    HA   ILE  21           HA       ILE  21   2.427   8.938  -6.917
  170    HB   ILE  21           HB       ILE  21   1.093   6.446  -5.753
  171   1HG1  ILE  21          HG12      ILE  21   1.985   6.969  -8.604
  172   2HG1  ILE  21          HG13      ILE  21   2.511   5.667  -7.541
  173   1HG2  ILE  21          HG21      ILE  21  -0.273   8.535  -5.941
  174   2HG2  ILE  21          HG22      ILE  21   0.088   8.581  -7.681
  175   3HG2  ILE  21          HG23      ILE  21  -0.860   7.245  -6.986
  176   1HD1  ILE  21          HD11      ILE  21  -0.237   5.894  -8.775
  177   2HD1  ILE  21          HD12      ILE  21   1.035   4.702  -9.108
  178   3HD1  ILE  21          HD13      ILE  21   0.232   4.700  -7.532
  179    H    ILE  22           H        ILE  22   2.826   6.998  -3.989
  180    HA   ILE  22           HA       ILE  22   1.281   8.724  -2.233
  181    HB   ILE  22           HB       ILE  22   3.285   6.559  -1.503
  182   1HG1  ILE  22          HG12      ILE  22   1.762   5.346  -2.797
  183   2HG1  ILE  22          HG13      ILE  22   1.151   5.143  -1.170
  184   1HG2  ILE  22          HG21      ILE  22   2.004   6.375   0.583
  185   2HG2  ILE  22          HG22      ILE  22   2.676   7.988   0.413
  186   3HG2  ILE  22          HG23      ILE  22   0.948   7.708   0.077
  187   1HD1  ILE  22          HD11      ILE  22  -0.744   5.507  -2.494
  188   2HD1  ILE  22          HD12      ILE  22  -0.475   7.066  -1.678
  189   3HD1  ILE  22          HD13      ILE  22  -0.009   6.854  -3.382
  190    H    GLN  23           H        GLN  23   4.733   8.378  -2.931
  191    HA   GLN  23           HA       GLN  23   5.717  10.265  -1.022
  192   1HB   GLN  23          HB2       GLN  23   6.761   9.026  -3.578
  193   2HB   GLN  23          HB3       GLN  23   7.728  10.194  -2.658
  194   1HG   GLN  23          HG2       GLN  23   7.629   8.791  -0.652
  195   2HG   GLN  23          HG3       GLN  23   6.574   7.633  -1.459
  196   1HE2  GLN  23          HE21      GLN  23   8.190   5.992  -0.874
  197   2HE2  GLN  23          HE22      GLN  23   9.706   5.897  -1.761
  198    H    GLN  24           H        GLN  24   3.624  10.995  -3.429
  199    HA   GLN  24           HA       GLN  24   4.453  13.881  -3.477
  200   1HB   GLN  24          HB2       GLN  24   3.017  12.381  -5.707
  201   2HB   GLN  24          HB3       GLN  24   3.471  14.091  -5.707
  202   1HG   GLN  24          HG2       GLN  24   5.851  13.463  -5.686
  203   2HG   GLN  24          HG3       GLN  24   5.390  11.753  -5.558
  204   1HE2  GLN  24          HE21      GLN  24   4.956  10.609  -7.415
  205   2HE2  GLN  24          HE22      GLN  24   4.913  11.329  -9.029
  206    H    ASN  25           H        ASN  25   1.841  11.518  -3.591
  207    HA   ASN  25           HA       ASN  25   0.027  13.417  -2.156
  208   1HB   ASN  25          HB2       ASN  25  -0.512  11.680  -4.545
  209   2HB   ASN  25          HB3       ASN  25  -1.790  11.893  -3.343
  210   1HD2  ASN  25          HD21      ASN  25  -2.267  14.158  -2.623
  211   2HD2  ASN  25          HD22      ASN  25  -2.272  15.363  -3.909
  212    HA   PRO  26           HA       PRO  26   0.803   9.802   0.601
  213   1HB   PRO  26          HB2       PRO  26   0.793  11.182   2.973
  214   2HB   PRO  26          HB3       PRO  26   2.228  11.028   1.912
  215   1HG   PRO  26          HG2       PRO  26   0.236  13.311   2.008
  216   2HG   PRO  26          HG3       PRO  26   2.031  13.406   2.076
  217   1HD   PRO  26          HD2       PRO  26   0.677  13.795  -0.204
  218   2HD   PRO  26          HD3       PRO  26   2.204  12.855  -0.232
  219    H    SER  27           H        SER  27  -1.694  12.249   0.497
  220    HA   SER  27           HA       SER  27  -3.712  11.147   2.152
  221   1HB   SER  27          HB2       SER  27  -5.232  12.380   0.565
  222   2HB   SER  27          HB3       SER  27  -3.932  13.350   1.268
  223    HG   SER  27           HG       SER  27  -4.217  13.611  -1.031
  224    H    LEU  28           H        LEU  28  -2.433   9.897  -0.851
  225    HA   LEU  28           HA       LEU  28  -4.796   8.152  -1.273
  226   1HB   LEU  28          HB2       LEU  28  -2.329   8.604  -2.986
  227   2HB   LEU  28          HB3       LEU  28  -3.719   7.604  -3.407
  228    HG   LEU  28           HG       LEU  28  -3.674  10.628  -3.113
  229   1HD1  LEU  28          HD11      LEU  28  -2.761   9.653  -5.206
  230   2HD1  LEU  28          HD12      LEU  28  -4.282   8.760  -5.440
  231   3HD1  LEU  28          HD13      LEU  28  -4.268  10.540  -5.500
  232   1HD2  LEU  28          HD21      LEU  28  -6.060   8.806  -3.651
  233   2HD2  LEU  28          HD22      LEU  28  -5.844   9.893  -2.256
  234   3HD2  LEU  28          HD23      LEU  28  -6.041  10.572  -3.870
  235    H    LEU  29           H        LEU  29  -2.175   7.834   0.715
  236    HA   LEU  29           HA       LEU  29  -1.255   5.210   0.196
  237   1HB   LEU  29          HB2       LEU  29  -0.245   6.697   1.820
  238   2HB   LEU  29          HB3       LEU  29  -1.650   6.686   2.834
  239    HG   LEU  29           HG       LEU  29  -1.357   4.301   3.356
  240   1HD1  LEU  29          HD11      LEU  29   1.078   4.485   1.534
  241   2HD1  LEU  29          HD12      LEU  29   0.769   3.157   2.679
  242   3HD1  LEU  29          HD13      LEU  29  -0.335   3.430   1.321
  243   1HD2  LEU  29          HD21      LEU  29  -0.217   6.018   4.723
  244   2HD2  LEU  29          HD22      LEU  29   0.700   4.506   4.671
  245   3HD2  LEU  29          HD23      LEU  29   1.221   5.892   3.686
  246    HA   PRO  30           HA       PRO  30  -5.232   3.531   2.630
  247   1HB   PRO  30          HB2       PRO  30  -7.081   5.749   1.742
  248   2HB   PRO  30          HB3       PRO  30  -7.119   4.799   3.238
  249   1HG   PRO  30          HG2       PRO  30  -6.187   7.401   2.928
  250   2HG   PRO  30          HG3       PRO  30  -5.681   6.308   4.267
  251   1HD   PRO  30          HD2       PRO  30  -4.125   7.267   1.971
  252   2HD   PRO  30          HD3       PRO  30  -3.573   6.399   3.423
  253    H    ALA  31           H        ALA  31  -5.668   5.642  -0.162
  254    HA   ALA  31           HA       ALA  31  -7.381   3.930  -1.648
  255   1HB   ALA  31          HB1       ALA  31  -7.147   5.612  -3.357
  256   2HB   ALA  31          HB2       ALA  31  -7.162   6.420  -1.770
  257   3HB   ALA  31          HB3       ALA  31  -5.634   6.213  -2.651
  258    H    LEU  32           H        LEU  32  -3.951   3.601  -1.185
  259    HA   LEU  32           HA       LEU  32  -3.610   2.005  -3.680
  260   1HB   LEU  32          HB2       LEU  32  -1.838   3.564  -3.144
  261   2HB   LEU  32          HB3       LEU  32  -1.747   2.929  -1.487
  262    HG   LEU  32           HG       LEU  32  -0.846   0.826  -2.267
  263   1HD1  LEU  32          HD11      LEU  32  -2.015   0.605  -4.435
  264   2HD1  LEU  32          HD12      LEU  32  -1.082   1.971  -5.085
  265   3HD1  LEU  32          HD13      LEU  32  -0.286   0.433  -4.638
  266   1HD2  LEU  32          HD21      LEU  32   0.649   2.775  -1.855
  267   2HD2  LEU  32          HD22      LEU  32   1.345   1.646  -3.022
  268   3HD2  LEU  32          HD23      LEU  32   0.609   3.156  -3.588
  269    H    LEU  33           H        LEU  33  -3.542   1.721  -0.108
  270    HA   LEU  33           HA       LEU  33  -3.264  -1.121   0.062
  271   1HB   LEU  33          HB2       LEU  33  -4.692   0.918   1.806
  272   2HB   LEU  33          HB3       LEU  33  -4.425  -0.764   2.275
  273    HG   LEU  33           HG       LEU  33  -2.021   0.890   1.444
  274   1HD1  LEU  33          HD11      LEU  33  -1.757   1.690   3.738
  275   2HD1  LEU  33          HD12      LEU  33  -3.213   2.342   2.968
  276   3HD1  LEU  33          HD13      LEU  33  -3.358   1.029   4.167
  277   1HD2  LEU  33          HD21      LEU  33  -2.472  -1.308   3.506
  278   2HD2  LEU  33          HD22      LEU  33  -1.749  -1.514   1.895
  279   3HD2  LEU  33          HD23      LEU  33  -0.917  -0.540   3.121
  280    H    GLN  34           H        GLN  34  -6.233   0.923  -0.192
  281    HA   GLN  34           HA       GLN  34  -8.088  -1.207  -0.444
  282   1HB   GLN  34          HB2       GLN  34  -8.567   1.276  -0.106
  283   2HB   GLN  34          HB3       GLN  34  -8.256   1.494  -1.833
  284   1HG   GLN  34          HG2       GLN  34 -10.086  -0.289  -2.234
  285   2HG   GLN  34          HG3       GLN  34 -10.446  -0.172  -0.510
  286   1HE2  GLN  34          HE21      GLN  34 -11.078   2.123   0.279
  287   2HE2  GLN  34          HE22      GLN  34 -11.943   3.121  -0.884
  288    H    GLN  35           H        GLN  35  -5.836   0.152  -2.886
  289    HA   GLN  35           HA       GLN  35  -7.284  -1.035  -5.133
  290   1HB   GLN  35          HB2       GLN  35  -6.181   1.065  -5.471
  291   2HB   GLN  35          HB3       GLN  35  -4.650   0.457  -4.824
  292   1HG   GLN  35          HG2       GLN  35  -4.295  -0.951  -6.713
  293   2HG   GLN  35          HG3       GLN  35  -5.929  -0.636  -7.337
  294   1HE2  GLN  35          HE21      GLN  35  -5.747   0.672  -9.172
  295   2HE2  GLN  35          HE22      GLN  35  -4.640   2.039  -9.286
  296    H    ILE  36           H        ILE  36  -4.440  -1.844  -3.146
  297    HA   ILE  36           HA       ILE  36  -3.829  -4.336  -4.455
  298    HB   ILE  36           HB       ILE  36  -3.485  -3.480  -1.584
  299   1HG1  ILE  36          HG12      ILE  36  -1.345  -3.683  -3.753
  300   2HG1  ILE  36          HG13      ILE  36  -2.242  -2.195  -3.473
  301   1HG2  ILE  36          HG21      ILE  36  -3.458  -5.964  -1.720
  302   2HG2  ILE  36          HG22      ILE  36  -2.410  -5.917  -3.136
  303   3HG2  ILE  36          HG23      ILE  36  -1.796  -5.422  -1.547
  304   1HD1  ILE  36          HD11      ILE  36  -1.511  -2.211  -1.082
  305   2HD1  ILE  36          HD12      ILE  36  -0.450  -3.591  -1.478
  306   3HD1  ILE  36          HD13      ILE  36  -0.201  -2.022  -2.267
  307    H    GLY  37           H        GLY  37  -6.195  -3.489  -1.801
  308   1HA   GLY  37          HA2       GLY  37  -7.325  -6.029  -1.460
  309   2HA   GLY  37          HA3       GLY  37  -8.174  -4.491  -1.263
  310    H    ARG  38           H        ARG  38  -8.048  -3.695  -4.087
  311    HA   ARG  38           HA       ARG  38 -10.253  -5.178  -5.237
  312   1HB   ARG  38          HB2       ARG  38  -8.340  -3.204  -6.554
  313   2HB   ARG  38          HB3       ARG  38  -9.822  -3.821  -7.273
  314   1HG   ARG  38          HG2       ARG  38 -11.176  -2.777  -5.501
  315   2HG   ARG  38          HG3       ARG  38  -9.705  -2.172  -4.717
  316   1HD   ARG  38          HD2       ARG  38  -9.159  -0.968  -6.889
  317   2HD   ARG  38          HD3       ARG  38 -10.782  -1.404  -7.448
  318    HE   ARG  38           HE       ARG  38 -10.878  -0.104  -4.860
  319   1HH1  ARG  38          HH22      ARG  38 -10.537   0.676  -8.265
  320   2HH1  ARG  38          HH21      ARG  38 -11.069   2.326  -8.028
  321   1HH2  ARG  38          HH12      ARG  38 -11.458   2.018  -4.622
  322   2HH2  ARG  38          HH11      ARG  38 -11.609   3.050  -6.021
  323    H    GLU  39           H        GLU  39  -6.749  -5.401  -5.767
  324    HA   GLU  39           HA       GLU  39  -7.100  -7.249  -8.043
  325   1HB   GLU  39          HB2       GLU  39  -4.876  -5.541  -6.886
  326   2HB   GLU  39          HB3       GLU  39  -4.607  -6.689  -8.191
  327   1HG   GLU  39          HG2       GLU  39  -6.591  -4.371  -8.301
  328   2HG   GLU  39          HG3       GLU  39  -4.958  -4.346  -8.958
  329    H    ASN  40           H        ASN  40  -5.752  -7.239  -4.790
  330    HA   ASN  40           HA       ASN  40  -5.426 -10.138  -4.760
  331   1HB   ASN  40          HB2       ASN  40  -3.200  -9.038  -5.595
  332   2HB   ASN  40          HB3       ASN  40  -3.026  -8.443  -3.966
  333   1HD2  ASN  40          HD21      ASN  40  -1.442 -10.497  -5.502
  334   2HD2  ASN  40          HD22      ASN  40  -1.531 -11.949  -4.505
  335    HA   PRO  41           HA       PRO  41  -7.075  -8.139  -0.856
  336   1HB   PRO  41          HB2       PRO  41  -9.029  -9.996  -0.308
  337   2HB   PRO  41          HB3       PRO  41  -9.242  -8.591  -1.402
  338   1HG   PRO  41          HG2       PRO  41  -8.514 -11.421  -2.165
  339   2HG   PRO  41          HG3       PRO  41  -9.815 -10.391  -2.856
  340   1HD   PRO  41          HD2       PRO  41  -7.431 -10.600  -4.079
  341   2HD   PRO  41          HD3       PRO  41  -8.225  -9.000  -3.965
  342    H    GLN  42           H        GLN  42  -5.727 -11.265  -1.622
  343    HA   GLN  42           HA       GLN  42  -5.330 -12.140   1.144
  344   1HB   GLN  42          HB2       GLN  42  -3.988 -13.068  -1.419
  345   2HB   GLN  42          HB3       GLN  42  -4.019 -13.918   0.138
  346   1HG   GLN  42          HG2       GLN  42  -6.542 -13.973  -0.042
  347   2HG   GLN  42          HG3       GLN  42  -6.395 -13.346  -1.684
  348   1HE2  GLN  42          HE21      GLN  42  -7.436 -16.031  -0.647
  349   2HE2  GLN  42          HE22      GLN  42  -6.490 -17.207  -1.550
  350    H    LEU  43           H        LEU  43  -3.274 -10.621  -1.412
  351    HA   LEU  43           HA       LEU  43  -0.949 -10.288   0.250
  352   1HB   LEU  43          HB2       LEU  43  -1.082 -10.007  -2.296
  353   2HB   LEU  43          HB3       LEU  43  -1.960  -8.507  -2.011
  354    HG   LEU  43           HG       LEU  43  -0.076  -7.442  -1.040
  355   1HD1  LEU  43          HD11      LEU  43   2.153  -8.562  -0.838
  356   2HD1  LEU  43          HD12      LEU  43   0.957  -9.204   0.286
  357   3HD1  LEU  43          HD13      LEU  43   1.370 -10.123  -1.182
  358   1HD2  LEU  43          HD21      LEU  43  -0.175  -7.568  -3.501
  359   2HD2  LEU  43          HD22      LEU  43   1.496  -7.491  -2.925
  360   3HD2  LEU  43          HD23      LEU  43   0.821  -9.041  -3.473
  361    H    LEU  44           H        LEU  44  -3.943  -8.483  -0.147
  362    HA   LEU  44           HA       LEU  44  -3.047  -6.085   1.173
  363   1HB   LEU  44          HB2       LEU  44  -5.057  -6.405  -0.346
  364   2HB   LEU  44          HB3       LEU  44  -5.904  -7.151   0.964
  365    HG   LEU  44           HG       LEU  44  -6.148  -4.589   0.346
  366   1HD1  LEU  44          HD11      LEU  44  -6.217  -5.503   3.222
  367   2HD1  LEU  44          HD12      LEU  44  -7.057  -4.107   2.491
  368   3HD1  LEU  44          HD13      LEU  44  -7.483  -5.742   1.981
  369   1HD2  LEU  44          HD21      LEU  44  -4.032  -4.356   2.535
  370   2HD2  LEU  44          HD22      LEU  44  -3.807  -3.907   0.822
  371   3HD2  LEU  44          HD23      LEU  44  -4.992  -3.060   1.830
  372    H    GLN  45           H        GLN  45  -5.132  -8.683   2.309
  373    HA   GLN  45           HA       GLN  45  -5.109  -8.178   5.097
  374   1HB   GLN  45          HB2       GLN  45  -5.211 -10.779   3.543
  375   2HB   GLN  45          HB3       GLN  45  -5.329 -10.732   5.306
  376   1HG   GLN  45          HG2       GLN  45  -7.316  -9.376   5.254
  377   2HG   GLN  45          HG3       GLN  45  -7.179  -9.108   3.513
  378   1HE2  GLN  45          HE21      GLN  45  -7.549 -10.920   2.070
  379   2HE2  GLN  45          HE22      GLN  45  -8.553 -12.276   2.604
  380    H    GLN  46           H        GLN  46  -2.530  -9.842   3.193
  381    HA   GLN  46           HA       GLN  46  -0.911 -10.460   5.515
  382   1HB   GLN  46          HB2       GLN  46  -0.493 -10.377   2.513
  383   2HB   GLN  46          HB3       GLN  46   0.875 -10.603   3.594
  384   1HG   GLN  46          HG2       GLN  46  -0.170 -12.582   4.601
  385   2HG   GLN  46          HG3       GLN  46  -1.649 -12.330   3.681
  386   1HE2  GLN  46          HE21      GLN  46  -1.581 -12.601   1.350
  387   2HE2  GLN  46          HE22      GLN  46  -0.362 -13.667   0.628
  388    H    ILE  47           H        ILE  47  -0.836  -7.707   3.211
  389    HA   ILE  47           HA       ILE  47   1.292  -6.251   4.443
  390    HB   ILE  47           HB       ILE  47  -1.088  -5.527   2.729
  391   1HG1  ILE  47          HG12      ILE  47   1.921  -5.304   2.278
  392   2HG1  ILE  47          HG13      ILE  47   1.000  -6.759   1.891
  393   1HG2  ILE  47          HG21      ILE  47  -0.875  -3.551   4.083
  394   2HG2  ILE  47          HG22      ILE  47   0.898  -3.592   3.975
  395   3HG2  ILE  47          HG23      ILE  47  -0.087  -3.204   2.551
  396   1HD1  ILE  47          HD11      ILE  47  -0.442  -5.447   0.363
  397   2HD1  ILE  47          HD12      ILE  47   0.603  -4.030   0.632
  398   3HD1  ILE  47          HD13      ILE  47   1.271  -5.492  -0.120
  399    H    SER  48           H        SER  48  -2.194  -6.377   5.151
  400    HA   SER  48           HA       SER  48  -2.187  -4.324   7.168
  401   1HB   SER  48          HB2       SER  48  -4.135  -6.635   6.815
  402   2HB   SER  48          HB3       SER  48  -4.388  -5.188   7.803
  403    HG   SER  48           HG       SER  48  -4.048  -5.318   4.993
  404    H    GLN  49           H        GLN  49  -1.683  -7.828   7.385
  405    HA   GLN  49           HA       GLN  49  -1.510  -8.050  10.234
  406   1HB   GLN  49          HB2       GLN  49  -0.531  -9.662   7.865
  407   2HB   GLN  49          HB3       GLN  49  -0.125 -10.155   9.509
  408   1HG   GLN  49          HG2       GLN  49  -2.452 -10.351  10.126
  409   2HG   GLN  49          HG3       GLN  49  -2.995  -9.707   8.584
  410   1HE2  GLN  49          HE21      GLN  49  -3.827 -12.253   9.628
  411   2HE2  GLN  49          HE22      GLN  49  -3.187 -13.482   8.535
  412    H    HIS  50           H        HIS  50   0.730  -6.550   8.055
  413    HA   HIS  50           HA       HIS  50   2.905  -6.594  10.108
  414   1HB   HIS  50          HB2       HIS  50   3.207  -7.153   7.132
  415   2HB   HIS  50          HB3       HIS  50   4.505  -7.137   8.329
  416    HD1  HIS  50           HD1      HIS  50   1.899  -9.414   6.888
  417    HD2  HIS  50           HD2      HIS  50   4.454  -9.211  10.210
  418    HE1  HIS  50           HE1      HIS  50   2.021 -11.780   7.836
  419    H    GLN  51           H        GLN  51   0.969  -4.459   9.032
  420    HA   GLN  51           HA       GLN  51   1.942  -3.108   6.935
  421   1HB   GLN  51          HB2       GLN  51  -0.321  -3.033   8.191
  422   2HB   GLN  51          HB3       GLN  51   0.358  -1.651   9.061
  423   1HG   GLN  51          HG2       GLN  51   0.681  -0.471   6.898
  424   2HG   GLN  51          HG3       GLN  51   0.124  -1.904   6.024
  425   1HE2  GLN  51          HE21      GLN  51  -2.163  -2.306   5.883
  426   2HE2  GLN  51          HE22      GLN  51  -3.326  -1.161   6.547
  427    H    GLU  52           H        GLU  52   3.292  -2.524  10.136
  428    HA   GLU  52           HA       GLU  52   4.495   0.017   9.676
  429   1HB   GLU  52          HB2       GLU  52   4.345  -1.245  11.835
  430   2HB   GLU  52          HB3       GLU  52   5.558  -2.383  11.229
  431   1HG   GLU  52          HG2       GLU  52   7.188  -0.550  11.027
  432   2HG   GLU  52          HG3       GLU  52   5.952   0.617  11.510
  433    H    HIS  53           H        HIS  53   5.492  -3.268   8.673
  434    HA   HIS  53           HA       HIS  53   8.027  -2.516   7.498
  435   1HB   HIS  53          HB2       HIS  53   6.209  -4.878   6.865
  436   2HB   HIS  53          HB3       HIS  53   7.897  -4.709   6.402
  437    HD1  HIS  53           HD1      HIS  53   5.726  -5.518   9.416
  438    HD2  HIS  53           HD2      HIS  53   9.762  -5.174   8.314
  439    HE1  HIS  53           HE1      HIS  53   7.078  -6.602  11.298
  440    H    PHE  54           H        PHE  54   4.672  -2.770   6.253
  441    HA   PHE  54           HA       PHE  54   5.309  -2.310   3.486
  442   1HB   PHE  54          HB2       PHE  54   3.139  -3.201   4.228
  443   2HB   PHE  54          HB3       PHE  54   2.756  -1.673   5.022
  444    HD1  PHE  54           HD1      PHE  54   1.888   0.207   3.769
  445    HD2  PHE  54           HD2      PHE  54   3.396  -3.269   1.719
  446    HE1  PHE  54           HE1      PHE  54   0.951   1.056   1.630
  447    HE2  PHE  54           HE2      PHE  54   2.451  -2.418  -0.415
  448    HZ   PHE  54           HZ       PHE  54   1.232  -0.251  -0.462
  449    H    ILE  55           H        ILE  55   4.233  -0.031   6.059
  450    HA   ILE  55           HA       ILE  55   4.432   2.317   4.479
  451    HB   ILE  55           HB       ILE  55   4.436   1.918   7.435
  452   1HG1  ILE  55          HG12      ILE  55   2.400   2.896   5.364
  453   2HG1  ILE  55          HG13      ILE  55   2.409   1.298   6.117
  454   1HG2  ILE  55          HG21      ILE  55   4.046   4.351   7.665
  455   2HG2  ILE  55          HG22      ILE  55   5.636   4.036   7.002
  456   3HG2  ILE  55          HG23      ILE  55   4.325   4.567   5.923
  457   1HD1  ILE  55          HD11      ILE  55   2.072   2.389   8.340
  458   2HD1  ILE  55          HD12      ILE  55   1.838   3.936   7.473
  459   3HD1  ILE  55          HD13      ILE  55   0.731   2.581   7.183
  460    H    GLN  56           H        GLN  56   7.021   0.650   6.450
  461    HA   GLN  56           HA       GLN  56   8.979   2.651   6.011
  462   1HB   GLN  56          HB2       GLN  56   9.042   0.984   7.767
  463   2HB   GLN  56          HB3       GLN  56   9.055  -0.328   6.591
  464   1HG   GLN  56          HG2       GLN  56  11.173  -0.016   7.552
  465   2HG   GLN  56          HG3       GLN  56  11.282   0.326   5.819
  466   1HE2  GLN  56          HE21      GLN  56  11.459   2.681   5.171
  467   2HE2  GLN  56          HE22      GLN  56  12.170   3.797   6.332
  468    H    MET  57           H        MET  57   8.119  -0.288   4.057
  469    HA   MET  57           HA       MET  57  10.219   0.077   2.101
  470   1HB   MET  57          HB2       MET  57   7.575  -1.419   2.010
  471   2HB   MET  57          HB3       MET  57   8.759  -1.418   0.690
  472   1HG   MET  57          HG2       MET  57  10.479  -2.338   2.186
  473   2HG   MET  57          HG3       MET  57   9.359  -2.293   3.537
  474   1HE   MET  57          HE1       MET  57  10.693  -4.175   0.500
  475   2HE   MET  57          HE2       MET  57   9.445  -5.375   0.112
  476   3HE   MET  57          HE3       MET  57   9.168  -3.658  -0.262
  477    H    LEU  58           H        LEU  58   6.801   1.040   2.164
  478    HA   LEU  58           HA       LEU  58   6.460   2.611  -0.117
  479   1HB   LEU  58          HB2       LEU  58   4.870   1.652   1.351
  480   2HB   LEU  58          HB3       LEU  58   5.453   2.592   2.712
  481    HG   LEU  58           HG       LEU  58   3.239   3.057   1.660
  482   1HD1  LEU  58          HD11      LEU  58   3.350   5.425   2.293
  483   2HD1  LEU  58          HD12      LEU  58   4.237   4.398   3.425
  484   3HD1  LEU  58          HD13      LEU  58   5.126   5.370   2.229
  485   1HD2  LEU  58          HD21      LEU  58   3.027   4.491  -0.184
  486   2HD2  LEU  58          HD22      LEU  58   4.777   4.787  -0.300
  487   3HD2  LEU  58          HD23      LEU  58   4.096   3.185  -0.698
  488    H    ASN  59           H        ASN  59   8.487   3.308   2.635
  489    HA   ASN  59           HA       ASN  59   8.805   6.170   1.848
  490   1HB   ASN  59          HB2       ASN  59   9.044   4.642   4.430
  491   2HB   ASN  59          HB3       ASN  59  10.113   6.014   4.198
  492   1HD2  ASN  59          HD21      ASN  59   6.783   5.061   4.658
  493   2HD2  ASN  59          HD22      ASN  59   6.169   6.707   4.862
  494    H    GLU  60           H        GLU  60  10.322   3.289   1.073
  495    HA   GLU  60           HA       GLU  60  13.097   4.140   1.190
  496   1HB   GLU  60          HB2       GLU  60  11.675   2.060  -0.514
  497   2HB   GLU  60          HB3       GLU  60  13.418   2.316  -0.514
  498   1HG   GLU  60          HG2       GLU  60  13.560   1.749   1.858
  499   2HG   GLU  60          HG3       GLU  60  11.820   1.472   1.922
  500    HA   PRO  61           HA       PRO  61  13.265   6.282  -2.866
  501   1HB   PRO  61          HB2       PRO  61  15.855   5.816  -3.551
  502   2HB   PRO  61          HB3       PRO  61  15.374   7.022  -2.315
  503   1HG   PRO  61          HG2       PRO  61  16.396   4.214  -1.912
  504   2HG   PRO  61          HG3       PRO  61  16.847   5.709  -1.024
  505   1HD   PRO  61          HD2       PRO  61  15.027   3.857  -0.101
  506   2HD   PRO  61          HD3       PRO  61  14.938   5.594   0.312
  507    H    VAL  62           H        VAL  62  12.245   5.287  -4.529
  508    HA   VAL  62           HA       VAL  62  11.822   2.559  -4.551
  509    HB   VAL  62           HB       VAL  62  10.518   2.918  -6.554
  510   1HG1  VAL  62          HG11      VAL  62  10.212   5.324  -4.708
  511   2HG1  VAL  62          HG12      VAL  62   8.965   4.530  -5.684
  512   3HG1  VAL  62          HG13      VAL  62   9.691   3.673  -4.315
  513   1HG2  VAL  62          HG21      VAL  62  12.042   4.429  -7.831
  514   2HG2  VAL  62          HG22      VAL  62  10.402   5.054  -7.714
  515   3HG2  VAL  62          HG23      VAL  62  11.679   5.742  -6.688
  516    H    GLN  63           H        GLN  63  14.371   4.148  -6.269
  517    HA   GLN  63           HA       GLN  63  15.365   1.539  -7.253
  518   1HB   GLN  63          HB2       GLN  63  14.900   3.922  -9.102
  519   2HB   GLN  63          HB3       GLN  63  15.930   2.545  -9.488
  520   1HG   GLN  63          HG2       GLN  63  13.953   1.023  -9.235
  521   2HG   GLN  63          HG3       GLN  63  12.924   2.445  -9.024
  522   1HE2  GLN  63          HE21      GLN  63  14.390   0.364 -11.374
  523   2HE2  GLN  63          HE22      GLN  63  13.965   1.342 -12.773
  524    H    GLU  64           H        GLU  64  15.992   5.070  -6.970
  525    HA   GLU  64           HA       GLU  64  18.822   4.518  -6.206
  526   1HB   GLU  64          HB2       GLU  64  17.849   6.433  -8.363
  527   2HB   GLU  64          HB3       GLU  64  19.467   6.467  -7.652
  528   1HG   GLU  64          HG2       GLU  64  19.835   4.125  -8.429
  529   2HG   GLU  64          HG3       GLU  64  18.264   4.160  -9.229
  530    H    ALA  65           H        ALA  65  18.449   7.332  -3.953
  531    HA   ALA  65           HA       ALA  65  19.471   4.585  -4.261
  532   1HB   ALA  65          HB1       ALA  65  20.899   5.880  -5.834
  533   2HB   ALA  65          HB2       ALA  65  21.294   7.024  -4.533
  534   3HB   ALA  65          HB3       ALA  65  21.828   5.336  -4.432
  535    H    GLY  66           H        GLY  66  19.034   7.455  -2.282
  536   1HA   GLY  66          HA2       GLY  66  19.043   6.018   0.152
  537   2HA   GLY  66          HA3       GLY  66  20.635   6.752  -0.037
  538    H    GLY  67           H        GLY  67  19.349   7.551   2.103
  539   1HA   GLY  67          HA2       GLY  67  19.293  10.330   2.026
  540   2HA   GLY  67          HA3       GLY  67  17.609   9.838   1.827
  541    H    GLN  68           H        GLN  68  17.952  10.208   5.484
  542    HA   GLN  68           HA       GLN  68  17.277  11.782   3.140
  543   1HB   GLN  68          HB2       GLN  68  16.166  11.929   5.330
  544   2HB   GLN  68          HB3       GLN  68  17.631  12.554   6.068
  545   1HG   GLN  68          HG2       GLN  68  16.560  14.054   3.681
  546   2HG   GLN  68          HG3       GLN  68  15.580  14.076   5.134
  547   1HE2  GLN  68          HE21      GLN  68  18.714  15.122   3.801
  548   2HE2  GLN  68          HE22      GLN  68  19.032  16.264   5.106
  549    H    GLY  69           H        GLY  69  20.202  11.405   5.087
  550   1HA   GLY  69          HA2       GLY  69  22.017  12.435   3.234
  551   2HA   GLY  69          HA3       GLY  69  21.573  13.800   4.260
  552    H    GLY  70           H        GLY  70  24.089  13.337   4.402
  553   1HA   GLY  70          HA2       GLY  70  24.925  13.233   6.906
  554   2HA   GLY  70          HA3       GLY  70  24.798  11.495   6.630
  555    H    GLY  71           H        GLY  71  25.687  11.804   3.770
  556   1HA   GLY  71          HA2       GLY  71  28.224  12.979   3.465
  557   2HA   GLY  71          HA3       GLY  71  28.498  11.380   4.160
  558    H    GLY  72           H        GLY  72  27.071   9.826   1.039
  559   1HA   GLY  72          HA2       GLY  72  27.273   9.167   3.857
  560   2HA   GLY  72          HA3       GLY  72  25.629   9.634   3.398
  Start of MODEL   20
    1   1H    GLY   1           H1       GLY   1  17.309 -10.072  14.776
    2   2H    GLY   1           H2       GLY   1  18.146  -8.698  15.105
    3   3H    GLY   1           H3       GLY   1  18.827  -9.875  14.183
    4   1HA   GLY   1          HA2       GLY   1  16.475  -8.262  13.428
    5   2HA   GLY   1          HA3       GLY   1  18.118  -8.032  12.800
    6    H    SER   2           H        SER   2  15.352  -8.980  11.695
    7    HA   SER   2           HA       SER   2  16.326 -11.372  10.170
    8   1HB   SER   2          HB2       SER   2  13.578 -11.015  11.417
    9   2HB   SER   2          HB3       SER   2  14.148 -12.423  10.515
   10    HG   SER   2           HG       SER   2  15.653 -12.810  12.157
   11    H    HIS   3           H        HIS   3  15.608  -8.327   9.594
   12    HA   HIS   3           HA       HIS   3  14.720  -7.033   7.993
   13   1HB   HIS   3          HB2       HIS   3  16.225  -8.475   6.651
   14   2HB   HIS   3          HB3       HIS   3  14.859  -9.507   6.249
   15    HD1  HIS   3           HD1      HIS   3  14.030  -8.980   3.894
   16    HD2  HIS   3           HD2      HIS   3  15.564  -5.636   5.919
   17    HE1  HIS   3           HE1      HIS   3  13.848  -7.026   2.278
   18    H    MET   4           H        MET   4  12.861  -6.760   6.281
   19    HA   MET   4           HA       MET   4  10.432  -7.033   7.794
   20   1HB   MET   4          HB2       MET   4  11.026  -5.966   5.002
   21   2HB   MET   4          HB3       MET   4   9.407  -6.008   5.693
   22   1HG   MET   4          HG2       MET   4  10.137  -3.849   6.156
   23   2HG   MET   4          HG3       MET   4  10.319  -4.725   7.676
   24   1HE   MET   4          HE1       MET   4  12.448  -4.147   4.369
   25   2HE   MET   4          HE2       MET   4  11.940  -2.550   4.963
   26   3HE   MET   4          HE3       MET   4  13.658  -3.004   4.997
   27    HA   PRO   5           HA       PRO   5   9.021 -10.932   6.094
   28   1HB   PRO   5          HB2       PRO   5   6.380 -10.907   6.793
   29   2HB   PRO   5          HB3       PRO   5   7.702 -11.051   7.992
   30   1HG   PRO   5          HG2       PRO   5   6.233  -8.538   7.143
   31   2HG   PRO   5          HG3       PRO   5   6.521  -9.134   8.813
   32   1HD   PRO   5          HD2       PRO   5   8.126  -7.268   7.659
   33   2HD   PRO   5          HD3       PRO   5   8.806  -8.540   8.721
   34    H    LEU   6           H        LEU   6   8.042  -7.920   4.847
   35    HA   LEU   6           HA       LEU   6   6.390  -9.027   2.642
   36   1HB   LEU   6          HB2       LEU   6   6.988  -6.205   3.596
   37   2HB   LEU   6          HB3       LEU   6   5.974  -6.586   2.201
   38    HG   LEU   6           HG       LEU   6   5.341  -7.387   5.068
   39   1HD1  LEU   6          HD11      LEU   6   4.225  -5.220   3.240
   40   2HD1  LEU   6          HD12      LEU   6   3.603  -5.625   4.854
   41   3HD1  LEU   6          HD13      LEU   6   5.236  -4.970   4.681
   42   1HD2  LEU   6          HD21      LEU   6   3.076  -7.873   4.135
   43   2HD2  LEU   6          HD22      LEU   6   3.707  -7.609   2.495
   44   3HD2  LEU   6          HD23      LEU   6   4.308  -8.962   3.484
   45    H    GLU   7           H        GLU   7   9.594  -9.009   2.941
   46    HA   GLU   7           HA       GLU   7  10.655  -7.535   0.770
   47   1HB   GLU   7          HB2       GLU   7  12.532  -9.034   0.852
   48   2HB   GLU   7          HB3       GLU   7  12.005  -8.602   2.478
   49   1HG   GLU   7          HG2       GLU   7  10.943 -10.791   2.770
   50   2HG   GLU   7          HG3       GLU   7  11.281 -11.218   1.094
   51    H    PHE   8           H        PHE   8   8.585 -10.314   0.484
   52    HA   PHE   8           HA       PHE   8   9.192 -11.120  -2.178
   53   1HB   PHE   8          HB2       PHE   8   6.476 -10.945  -0.825
   54   2HB   PHE   8          HB3       PHE   8   6.898 -11.949  -2.211
   55    HD1  PHE   8           HD1      PHE   8   8.681 -13.786  -1.899
   56    HD2  PHE   8           HD2      PHE   8   6.786 -11.762   1.405
   57    HE1  PHE   8           HE1      PHE   8   9.385 -15.611  -0.370
   58    HE2  PHE   8           HE2      PHE   8   7.501 -13.580   2.927
   59    HZ   PHE   8           HZ       PHE   8   8.799 -15.510   2.044
   60    H    LEU   9           H        LEU   9   7.672  -8.169  -1.023
   61    HA   LEU   9           HA       LEU   9   6.426  -7.325  -3.491
   62   1HB   LEU   9          HB2       LEU   9   7.399  -5.732  -1.087
   63   2HB   LEU   9          HB3       LEU   9   6.410  -5.102  -2.394
   64    HG   LEU   9           HG       LEU   9   5.557  -7.252  -0.401
   65   1HD1  LEU   9          HD11      LEU   9   5.660  -4.919   0.461
   66   2HD1  LEU   9          HD12      LEU   9   4.596  -4.404  -0.868
   67   3HD1  LEU   9          HD13      LEU   9   4.001  -5.537   0.369
   68   1HD2  LEU   9          HD21      LEU   9   4.160  -6.093  -2.835
   69   2HD2  LEU   9          HD22      LEU   9   4.431  -7.803  -2.429
   70   3HD2  LEU   9          HD23      LEU   9   3.287  -6.834  -1.479
   71    H    ARG  10           H        ARG  10   9.732  -7.179  -2.307
   72    HA   ARG  10           HA       ARG  10  10.640  -4.936  -3.859
   73   1HB   ARG  10          HB2       ARG  10  12.098  -7.195  -2.425
   74   2HB   ARG  10          HB3       ARG  10  12.931  -5.894  -3.277
   75   1HG   ARG  10          HG2       ARG  10  11.682  -4.240  -1.832
   76   2HG   ARG  10          HG3       ARG  10  11.089  -5.606  -0.872
   77   1HD   ARG  10          HD2       ARG  10  13.368  -6.289  -0.326
   78   2HD   ARG  10          HD3       ARG  10  14.050  -5.071  -1.404
   79    HE   ARG  10           HE       ARG  10  13.195  -4.688   1.324
   80   1HH1  ARG  10          HH12      ARG  10  13.414  -2.903  -1.708
   81   2HH1  ARG  10          HH11      ARG  10  13.403  -1.370  -0.854
   82   1HH2  ARG  10          HH22      ARG  10  13.475  -2.679   2.280
   83   2HH2  ARG  10          HH21      ARG  10  13.553  -1.259   1.259
   84    H    ASN  11           H        ASN  11   9.704  -7.874  -5.072
   85    HA   ASN  11           HA       ASN  11  11.334  -7.485  -7.558
   86   1HB   ASN  11          HB2       ASN  11  10.349 -10.056  -6.252
   87   2HB   ASN  11          HB3       ASN  11  11.065  -9.971  -7.864
   88   1HD2  ASN  11          HD21      ASN  11  13.332  -9.401  -8.084
   89   2HD2  ASN  11          HD22      ASN  11  14.397  -9.590  -6.690
   90    H    GLN  12           H        GLN  12   8.286  -6.843  -6.493
   91    HA   GLN  12           HA       GLN  12   6.809  -8.015  -8.760
   92   1HB   GLN  12          HB2       GLN  12   5.841  -6.196  -6.543
   93   2HB   GLN  12          HB3       GLN  12   4.841  -7.101  -7.687
   94   1HG   GLN  12          HG2       GLN  12   6.618  -8.182  -5.479
   95   2HG   GLN  12          HG3       GLN  12   4.856  -8.211  -5.522
   96   1HE2  GLN  12          HE21      GLN  12   7.076 -10.360  -5.379
   97   2HE2  GLN  12          HE22      GLN  12   6.596 -11.507  -6.630
   98    HA   PRO  13           HA       PRO  13   7.869  -4.609 -11.382
   99   1HB   PRO  13          HB2       PRO  13   5.133  -5.123 -12.580
  100   2HB   PRO  13          HB3       PRO  13   6.681  -4.784 -13.416
  101   1HG   PRO  13          HG2       PRO  13   5.831  -7.327 -13.175
  102   2HG   PRO  13          HG3       PRO  13   7.548  -6.934 -12.837
  103   1HD   PRO  13          HD2       PRO  13   5.298  -7.384 -10.883
  104   2HD   PRO  13          HD3       PRO  13   6.998  -7.954 -10.820
  105    H    GLN  14           H        GLN  14   4.415  -4.356 -10.331
  106    HA   GLN  14           HA       GLN  14   4.416  -1.473 -10.656
  107   1HB   GLN  14          HB2       GLN  14   2.146  -1.568  -9.785
  108   2HB   GLN  14          HB3       GLN  14   2.410  -2.695 -11.110
  109   1HG   GLN  14          HG2       GLN  14   2.480  -4.594  -9.606
  110   2HG   GLN  14          HG3       GLN  14   2.457  -3.557  -8.182
  111   1HE2  GLN  14          HE21      GLN  14   0.517  -5.729  -9.094
  112   2HE2  GLN  14          HE22      GLN  14  -1.030  -4.896  -9.068
  113    H    PHE  15           H        PHE  15   5.574  -3.353  -8.043
  114    HA   PHE  15           HA       PHE  15   4.862  -1.387  -5.948
  115   1HB   PHE  15          HB2       PHE  15   6.315  -4.030  -5.914
  116   2HB   PHE  15          HB3       PHE  15   6.359  -2.924  -4.546
  117    HD1  PHE  15           HD1      PHE  15   4.527  -2.666  -3.040
  118    HD2  PHE  15           HD2      PHE  15   3.989  -4.886  -6.696
  119    HE1  PHE  15           HE1      PHE  15   2.307  -3.450  -2.247
  120    HE2  PHE  15           HE2      PHE  15   1.787  -5.686  -5.883
  121    HZ   PHE  15           HZ       PHE  15   0.940  -4.962  -3.661
  122    H    GLN  16           H        GLN  16   7.243  -1.681  -8.323
  123    HA   GLN  16           HA       GLN  16   9.266   0.085  -7.181
  124   1HB   GLN  16          HB2       GLN  16   8.356  -0.515 -10.017
  125   2HB   GLN  16          HB3       GLN  16   9.818   0.390  -9.602
  126   1HG   GLN  16          HG2       GLN  16  10.789  -1.619  -8.555
  127   2HG   GLN  16          HG3       GLN  16   9.323  -2.543  -8.922
  128   1HE2  GLN  16          HE21      GLN  16   8.648  -2.384 -11.387
  129   2HE2  GLN  16          HE22      GLN  16   9.994  -2.582 -12.509
  130    H    GLN  17           H        GLN  17   6.015   0.541  -8.396
  131    HA   GLN  17           HA       GLN  17   6.542   3.356  -9.260
  132   1HB   GLN  17          HB2       GLN  17   4.362   1.398 -10.075
  133   2HB   GLN  17          HB3       GLN  17   4.628   3.009 -10.746
  134   1HG   GLN  17          HG2       GLN  17   6.778   2.291 -11.696
  135   2HG   GLN  17          HG3       GLN  17   6.586   0.679 -10.999
  136   1HE2  GLN  17          HE21      GLN  17   6.873   1.269 -13.868
  137   2HE2  GLN  17          HE22      GLN  17   5.379   0.701 -14.605
  138    H    MET  18           H        MET  18   3.907   1.385  -7.700
  139    HA   MET  18           HA       MET  18   2.179   3.520  -7.181
  140   1HB   MET  18          HB2       MET  18   1.052   2.052  -5.695
  141   2HB   MET  18          HB3       MET  18   1.615   1.154  -7.100
  142   1HG   MET  18          HG2       MET  18   3.537   0.279  -5.766
  143   2HG   MET  18          HG3       MET  18   2.979   1.202  -4.366
  144   1HE   MET  18          HE1       MET  18   2.410  -1.905  -6.636
  145   2HE   MET  18          HE2       MET  18   0.881  -2.569  -6.019
  146   3HE   MET  18          HE3       MET  18   0.876  -1.048  -6.935
  147    H    ARG  19           H        ARG  19   4.966   2.539  -5.263
  148    HA   ARG  19           HA       ARG  19   4.324   4.111  -2.916
  149   1HB   ARG  19          HB2       ARG  19   7.111   3.203  -3.715
  150   2HB   ARG  19          HB3       ARG  19   6.441   3.439  -2.097
  151   1HG   ARG  19          HG2       ARG  19   4.798   1.501  -2.760
  152   2HG   ARG  19          HG3       ARG  19   5.897   1.216  -4.100
  153   1HD   ARG  19          HD2       ARG  19   6.208   0.612  -1.212
  154   2HD   ARG  19          HD3       ARG  19   6.650  -0.341  -2.616
  155    HE   ARG  19           HE       ARG  19   8.237   1.830  -1.319
  156   1HH1  ARG  19          HH12      ARG  19   8.367  -0.519  -3.926
  157   2HH1  ARG  19          HH11      ARG  19  10.077  -0.780  -3.674
  158   1HH2  ARG  19          HH22      ARG  19  10.288   1.507  -1.109
  159   2HH2  ARG  19          HH21      ARG  19  11.179   0.391  -2.079
  160    H    GLN  20           H        GLN  20   5.988   4.873  -5.913
  161    HA   GLN  20           HA       GLN  20   7.105   7.425  -5.099
  162   1HB   GLN  20          HB2       GLN  20   6.199   6.461  -7.848
  163   2HB   GLN  20          HB3       GLN  20   7.067   7.948  -7.523
  164   1HG   GLN  20          HG2       GLN  20   8.950   6.637  -6.544
  165   2HG   GLN  20          HG3       GLN  20   8.144   5.135  -7.025
  166   1HE2  GLN  20          HE21      GLN  20  10.782   6.408  -7.895
  167   2HE2  GLN  20          HE22      GLN  20  10.630   6.550  -9.649
  168    H    ILE  21           H        ILE  21   3.879   6.369  -6.162
  169    HA   ILE  21           HA       ILE  21   2.843   8.980  -6.661
  170    HB   ILE  21           HB       ILE  21   1.196   6.562  -5.792
  171   1HG1  ILE  21          HG12      ILE  21   2.366   7.165  -8.528
  172   2HG1  ILE  21          HG13      ILE  21   2.711   5.764  -7.520
  173   1HG2  ILE  21          HG21      ILE  21  -0.549   7.619  -7.137
  174   2HG2  ILE  21          HG22      ILE  21   0.060   8.784  -5.970
  175   3HG2  ILE  21          HG23      ILE  21   0.586   8.885  -7.664
  176   1HD1  ILE  21          HD11      ILE  21   0.082   6.303  -8.916
  177   2HD1  ILE  21          HD12      ILE  21   1.260   5.019  -9.236
  178   3HD1  ILE  21          HD13      ILE  21   0.352   5.006  -7.718
  179    H    ILE  22           H        ILE  22   2.874   6.824  -3.866
  180    HA   ILE  22           HA       ILE  22   1.259   8.466  -2.107
  181    HB   ILE  22           HB       ILE  22   3.227   6.258  -1.400
  182   1HG1  ILE  22          HG12      ILE  22   1.694   5.146  -2.779
  183   2HG1  ILE  22          HG13      ILE  22   1.062   4.876  -1.173
  184   1HG2  ILE  22          HG21      ILE  22   1.899   6.008   0.658
  185   2HG2  ILE  22          HG22      ILE  22   2.620   7.607   0.573
  186   3HG2  ILE  22          HG23      ILE  22   0.894   7.395   0.188
  187   1HD1  ILE  22          HD11      ILE  22  -0.029   6.747  -3.300
  188   2HD1  ILE  22          HD12      ILE  22  -0.812   5.355  -2.538
  189   3HD1  ILE  22          HD13      ILE  22  -0.540   6.842  -1.600
  190    H    GLN  23           H        GLN  23   4.733   8.244  -2.688
  191    HA   GLN  23           HA       GLN  23   5.556  10.149  -0.703
  192   1HB   GLN  23          HB2       GLN  23   6.738   8.965  -3.221
  193   2HB   GLN  23          HB3       GLN  23   7.608  10.219  -2.307
  194   1HG   GLN  23          HG2       GLN  23   7.473   8.843  -0.252
  195   2HG   GLN  23          HG3       GLN  23   6.593   7.592  -1.129
  196   1HE2  GLN  23          HE21      GLN  23   8.145   5.974  -0.734
  197   2HE2  GLN  23          HE22      GLN  23   9.790   6.070  -1.354
  198    H    GLN  24           H        GLN  24   3.513  10.809  -3.204
  199    HA   GLN  24           HA       GLN  24   4.244  13.726  -3.213
  200   1HB   GLN  24          HB2       GLN  24   2.798  12.188  -5.410
  201   2HB   GLN  24          HB3       GLN  24   3.240  13.900  -5.430
  202   1HG   GLN  24          HG2       GLN  24   5.614  13.314  -5.489
  203   2HG   GLN  24          HG3       GLN  24   5.208  11.603  -5.255
  204   1HE2  GLN  24          HE21      GLN  24   5.120  10.367  -7.052
  205   2HE2  GLN  24          HE22      GLN  24   4.875  10.980  -8.693
  206    H    ASN  25           H        ASN  25   1.700  11.302  -3.251
  207    HA   ASN  25           HA       ASN  25  -0.112  13.141  -1.743
  208   1HB   ASN  25          HB2       ASN  25  -0.716  11.509  -4.195
  209   2HB   ASN  25          HB3       ASN  25  -1.961  11.687  -2.954
  210   1HD2  ASN  25          HD21      ASN  25  -2.417  13.915  -2.146
  211   2HD2  ASN  25          HD22      ASN  25  -2.416  15.183  -3.371
  212    HA   PRO  26           HA       PRO  26   0.599   9.399   0.849
  213   1HB   PRO  26          HB2       PRO  26   0.629  10.672   3.271
  214   2HB   PRO  26          HB3       PRO  26   2.061  10.538   2.202
  215   1HG   PRO  26          HG2       PRO  26   0.121  12.857   2.411
  216   2HG   PRO  26          HG3       PRO  26   1.917  12.909   2.476
  217   1HD   PRO  26          HD2       PRO  26   0.550  13.428   0.219
  218   2HD   PRO  26          HD3       PRO  26   2.074  12.483   0.143
  219    H    SER  27           H        SER  27  -1.800  11.949   0.831
  220    HA   SER  27           HA       SER  27  -3.893  10.829   2.382
  221   1HB   SER  27          HB2       SER  27  -5.334  12.212   0.853
  222   2HB   SER  27          HB3       SER  27  -4.010  13.089   1.628
  223    HG   SER  27           HG       SER  27  -4.272  13.484  -0.659
  224    H    LEU  28           H        LEU  28  -2.581   9.687  -0.642
  225    HA   LEU  28           HA       LEU  28  -4.981   8.006  -1.160
  226   1HB   LEU  28          HB2       LEU  28  -2.569   8.601  -2.906
  227   2HB   LEU  28          HB3       LEU  28  -3.950   7.599  -3.352
  228    HG   LEU  28           HG       LEU  28  -3.973  10.600  -2.864
  229   1HD1  LEU  28          HD11      LEU  28  -4.564   8.879  -5.305
  230   2HD1  LEU  28          HD12      LEU  28  -4.599  10.657  -5.241
  231   3HD1  LEU  28          HD13      LEU  28  -3.064   9.794  -5.031
  232   1HD2  LEU  28          HD21      LEU  28  -6.311   8.744  -3.499
  233   2HD2  LEU  28          HD22      LEU  28  -6.110   9.735  -2.032
  234   3HD2  LEU  28          HD23      LEU  28  -6.351  10.519  -3.593
  235    H    LEU  29           H        LEU  29  -2.326   7.588   0.746
  236    HA   LEU  29           HA       LEU  29  -1.491   4.945   0.110
  237   1HB   LEU  29          HB2       LEU  29  -0.395   6.327   1.781
  238   2HB   LEU  29          HB3       LEU  29  -1.793   6.337   2.807
  239    HG   LEU  29           HG       LEU  29  -1.609   3.939   3.243
  240   1HD1  LEU  29          HD11      LEU  29  -0.627   3.104   1.155
  241   2HD1  LEU  29          HD12      LEU  29   0.862   4.031   1.460
  242   3HD1  LEU  29          HD13      LEU  29   0.407   2.678   2.523
  243   1HD2  LEU  29          HD21      LEU  29   1.039   5.397   3.608
  244   2HD2  LEU  29          HD22      LEU  29  -0.382   5.531   4.666
  245   3HD2  LEU  29          HD23      LEU  29   0.479   3.988   4.537
  246    HA   PRO  30           HA       PRO  30  -5.510   3.396   2.556
  247   1HB   PRO  30          HB2       PRO  30  -7.285   5.707   1.770
  248   2HB   PRO  30          HB3       PRO  30  -7.320   4.724   3.244
  249   1HG   PRO  30          HG2       PRO  30  -6.285   7.294   2.960
  250   2HG   PRO  30          HG3       PRO  30  -5.815   6.157   4.272
  251   1HD   PRO  30          HD2       PRO  30  -4.234   7.092   1.991
  252   2HD   PRO  30          HD3       PRO  30  -3.718   6.148   3.409
  253    H    ALA  31           H        ALA  31  -5.989   5.622  -0.163
  254    HA   ALA  31           HA       ALA  31  -7.782   4.011  -1.637
  255   1HB   ALA  31          HB1       ALA  31  -7.456   6.479  -1.732
  256   2HB   ALA  31          HB2       ALA  31  -5.941   6.220  -2.627
  257   3HB   ALA  31          HB3       ALA  31  -7.483   5.697  -3.337
  258    H    LEU  32           H        LEU  32  -4.377   3.520  -1.290
  259    HA   LEU  32           HA       LEU  32  -4.143   2.049  -3.876
  260   1HB   LEU  32          HB2       LEU  32  -2.360   3.605  -3.346
  261   2HB   LEU  32          HB3       LEU  32  -2.190   2.890  -1.730
  262    HG   LEU  32           HG       LEU  32  -1.306   0.841  -2.641
  263   1HD1  LEU  32          HD11      LEU  32  -2.516   0.658  -4.768
  264   2HD1  LEU  32          HD12      LEU  32  -1.677   2.103  -5.392
  265   3HD1  LEU  32          HD13      LEU  32  -0.786   0.595  -5.053
  266   1HD2  LEU  32          HD21      LEU  32   0.821   1.719  -3.421
  267   2HD2  LEU  32          HD22      LEU  32   0.061   3.241  -3.929
  268   3HD2  LEU  32          HD23      LEU  32   0.154   2.816  -2.203
  269    H    LEU  33           H        LEU  33  -3.870   1.633  -0.333
  270    HA   LEU  33           HA       LEU  33  -3.631  -1.214  -0.244
  271   1HB   LEU  33          HB2       LEU  33  -4.962   0.804   1.604
  272   2HB   LEU  33          HB3       LEU  33  -4.641  -0.870   2.050
  273    HG   LEU  33           HG       LEU  33  -2.349   0.909   1.130
  274   1HD1  LEU  33          HD11      LEU  33  -1.970   1.525   3.471
  275   2HD1  LEU  33          HD12      LEU  33  -3.497   2.168   2.837
  276   3HD1  LEU  33          HD13      LEU  33  -3.513   0.758   3.930
  277   1HD2  LEU  33          HD21      LEU  33  -2.495  -1.436   3.063
  278   2HD2  LEU  33          HD22      LEU  33  -1.949  -1.524   1.373
  279   3HD2  LEU  33          HD23      LEU  33  -1.033  -0.568   2.549
  280    H    GLN  34           H        GLN  34  -6.545   0.898  -0.325
  281    HA   GLN  34           HA       GLN  34  -8.488  -1.173  -0.532
  282   1HB   GLN  34          HB2       GLN  34  -8.440   1.720  -1.448
  283   2HB   GLN  34          HB3       GLN  34  -9.855   0.685  -1.653
  284   1HG   GLN  34          HG2       GLN  34 -10.024   0.285   0.735
  285   2HG   GLN  34          HG3       GLN  34  -8.569   1.213   1.063
  286   1HE2  GLN  34          HE22      GLN  34 -11.672   1.535   1.663
  287   2HE2  GLN  34          HE21      GLN  34 -11.910   3.237   1.284
  288    H    GLN  35           H        GLN  35  -6.229   0.007  -3.051
  289    HA   GLN  35           HA       GLN  35  -7.856  -1.248  -5.165
  290   1HB   GLN  35          HB2       GLN  35  -6.745   0.821  -5.731
  291   2HB   GLN  35          HB3       GLN  35  -5.191   0.213  -5.162
  292   1HG   GLN  35          HG2       GLN  35  -5.266   0.164  -7.586
  293   2HG   GLN  35          HG3       GLN  35  -5.124  -1.459  -6.912
  294   1HE2  GLN  35          HE21      GLN  35  -6.026  -2.648  -8.605
  295   2HE2  GLN  35          HE22      GLN  35  -7.686  -2.426  -9.159
  296    H    ILE  36           H        ILE  36  -4.852  -1.930  -3.309
  297    HA   ILE  36           HA       ILE  36  -4.243  -4.433  -4.558
  298    HB   ILE  36           HB       ILE  36  -3.840  -3.568  -1.697
  299   1HG1  ILE  36          HG12      ILE  36  -1.853  -3.589  -4.028
  300   2HG1  ILE  36          HG13      ILE  36  -2.718  -2.158  -3.488
  301   1HG2  ILE  36          HG21      ILE  36  -2.602  -5.901  -3.287
  302   2HG2  ILE  36          HG22      ILE  36  -2.125  -5.429  -1.644
  303   3HG2  ILE  36          HG23      ILE  36  -3.726  -6.074  -1.941
  304   1HD1  ILE  36          HD11      ILE  36  -1.716  -2.430  -1.207
  305   2HD1  ILE  36          HD12      ILE  36  -0.683  -3.721  -1.884
  306   3HD1  ILE  36          HD13      ILE  36  -0.562  -2.068  -2.509
  307    H    GLY  37           H        GLY  37  -6.535  -3.630  -1.873
  308   1HA   GLY  37          HA2       GLY  37  -7.701  -6.162  -1.540
  309   2HA   GLY  37          HA3       GLY  37  -8.477  -4.612  -1.229
  310    H    ARG  38           H        ARG  38  -7.838  -4.469  -4.482
  311    HA   ARG  38           HA       ARG  38 -10.314  -5.889  -5.397
  312   1HB   ARG  38          HB2       ARG  38  -8.982  -3.353  -6.401
  313   2HB   ARG  38          HB3       ARG  38 -10.349  -4.139  -7.176
  314   1HG   ARG  38          HG2       ARG  38 -10.422  -3.074  -4.322
  315   2HG   ARG  38          HG3       ARG  38 -10.926  -2.211  -5.774
  316   1HD   ARG  38          HD2       ARG  38 -12.923  -3.019  -4.896
  317   2HD   ARG  38          HD3       ARG  38 -12.558  -4.168  -6.190
  318    HE   ARG  38           HE       ARG  38 -11.427  -5.109  -3.731
  319   1HH1  ARG  38          HH22      ARG  38 -14.633  -4.796  -5.116
  320   2HH1  ARG  38          HH21      ARG  38 -15.243  -6.151  -4.192
  321   1HH2  ARG  38          HH12      ARG  38 -12.207  -6.776  -2.652
  322   2HH2  ARG  38          HH11      ARG  38 -13.886  -7.254  -2.798
  323    H    GLU  39           H        GLU  39  -7.032  -6.294  -5.498
  324    HA   GLU  39           HA       GLU  39  -7.269  -7.960  -7.966
  325   1HB   GLU  39          HB2       GLU  39  -5.301  -7.093  -8.971
  326   2HB   GLU  39          HB3       GLU  39  -6.416  -5.759  -8.632
  327   1HG   GLU  39          HG2       GLU  39  -5.066  -5.236  -6.577
  328   2HG   GLU  39          HG3       GLU  39  -3.932  -6.503  -7.063
  329    H    ASN  40           H        ASN  40  -5.640  -7.384  -4.929
  330    HA   ASN  40           HA       ASN  40  -5.236 -10.258  -4.707
  331   1HB   ASN  40          HB2       ASN  40  -3.030  -9.201  -5.598
  332   2HB   ASN  40          HB3       ASN  40  -2.852  -8.512  -4.000
  333   1HD2  ASN  40          HD21      ASN  40  -1.235 -10.618  -5.390
  334   2HD2  ASN  40          HD22      ASN  40  -1.333 -12.025  -4.330
  335    HA   PRO  41           HA       PRO  41  -6.934  -8.052  -0.952
  336   1HB   PRO  41          HB2       PRO  41  -8.990  -9.789  -0.394
  337   2HB   PRO  41          HB3       PRO  41  -9.102  -8.428  -1.556
  338   1HG   PRO  41          HG2       PRO  41  -8.473 -11.318  -2.170
  339   2HG   PRO  41          HG3       PRO  41  -9.713 -10.270  -2.941
  340   1HD   PRO  41          HD2       PRO  41  -7.304 -10.622  -4.083
  341   2HD   PRO  41          HD3       PRO  41  -8.041  -8.990  -4.059
  342    H    GLN  42           H        GLN  42  -5.621 -11.210  -1.555
  343    HA   GLN  42           HA       GLN  42  -5.296 -11.956   1.268
  344   1HB   GLN  42          HB2       GLN  42  -3.913 -12.995  -1.231
  345   2HB   GLN  42          HB3       GLN  42  -3.921 -13.756   0.370
  346   1HG   GLN  42          HG2       GLN  42  -6.443 -13.886   0.207
  347   2HG   GLN  42          HG3       GLN  42  -6.316 -13.337  -1.464
  348   1HE2  GLN  42          HE21      GLN  42  -6.545 -16.138   0.414
  349   2HE2  GLN  42          HE22      GLN  42  -5.853 -17.257  -0.754
  350    H    LEU  43           H        LEU  43  -3.224 -10.505  -1.314
  351    HA   LEU  43           HA       LEU  43  -0.943 -10.076   0.389
  352   1HB   LEU  43          HB2       LEU  43  -1.059  -9.939  -2.186
  353   2HB   LEU  43          HB3       LEU  43  -1.869  -8.386  -1.973
  354    HG   LEU  43           HG       LEU  43   0.088  -7.414  -0.968
  355   1HD1  LEU  43          HD11      LEU  43   2.252  -8.736  -0.861
  356   2HD1  LEU  43          HD12      LEU  43   1.045  -9.227   0.323
  357   3HD1  LEU  43          HD13      LEU  43   1.301 -10.208  -1.142
  358   1HD2  LEU  43          HD21      LEU  43   0.830  -9.043  -3.435
  359   2HD2  LEU  43          HD22      LEU  43  -0.085  -7.518  -3.436
  360   3HD2  LEU  43          HD23      LEU  43   1.601  -7.535  -2.902
  361    H    LEU  44           H        LEU  44  -3.956  -8.362  -0.142
  362    HA   LEU  44           HA       LEU  44  -3.187  -5.865   1.061
  363   1HB   LEU  44          HB2       LEU  44  -5.214  -6.348  -0.391
  364   2HB   LEU  44          HB3       LEU  44  -5.972  -7.129   0.958
  365    HG   LEU  44           HG       LEU  44  -6.436  -4.613   0.287
  366   1HD1  LEU  44          HD11      LEU  44  -7.318  -4.156   2.452
  367   2HD1  LEU  44          HD12      LEU  44  -7.629  -5.831   1.990
  368   3HD1  LEU  44          HD13      LEU  44  -6.349  -5.465   3.184
  369   1HD2  LEU  44          HD21      LEU  44  -4.290  -4.171   2.408
  370   2HD2  LEU  44          HD22      LEU  44  -4.137  -3.764   0.678
  371   3HD2  LEU  44          HD23      LEU  44  -5.367  -2.975   1.686
  372    H    GLN  45           H        GLN  45  -5.106  -8.516   2.349
  373    HA   GLN  45           HA       GLN  45  -5.076  -7.860   5.106
  374   1HB   GLN  45          HB2       GLN  45  -5.182 -10.537   3.680
  375   2HB   GLN  45          HB3       GLN  45  -5.339 -10.388   5.434
  376   1HG   GLN  45          HG2       GLN  45  -7.315  -9.024   5.257
  377   2HG   GLN  45          HG3       GLN  45  -7.137  -8.861   3.506
  378   1HE2  GLN  45          HE21      GLN  45  -7.550 -10.713   2.152
  379   2HE2  GLN  45          HE22      GLN  45  -8.549 -12.043   2.752
  380    H    GLN  46           H        GLN  46  -2.455  -9.459   3.243
  381    HA   GLN  46           HA       GLN  46  -0.820 -10.001   5.595
  382   1HB   GLN  46          HB2       GLN  46  -0.390  -9.974   2.591
  383   2HB   GLN  46          HB3       GLN  46   0.965 -10.166   3.694
  384   1HG   GLN  46          HG2       GLN  46  -0.059 -12.141   4.716
  385   2HG   GLN  46          HG3       GLN  46  -1.532 -11.927   3.780
  386   1HE2  GLN  46          HE21      GLN  46  -1.495 -12.332   1.498
  387   2HE2  GLN  46          HE22      GLN  46  -0.226 -13.344   0.785
  388    H    ILE  47           H        ILE  47  -0.778  -7.358   3.142
  389    HA   ILE  47           HA       ILE  47   1.338  -5.844   4.322
  390    HB   ILE  47           HB       ILE  47  -0.987  -5.120   2.538
  391   1HG1  ILE  47          HG12      ILE  47   2.040  -5.133   2.096
  392   2HG1  ILE  47          HG13      ILE  47   1.005  -6.518   1.740
  393   1HG2  ILE  47          HG21      ILE  47   1.184  -3.261   3.605
  394   2HG2  ILE  47          HG22      ILE  47   0.127  -2.879   2.231
  395   3HG2  ILE  47          HG23      ILE  47  -0.569  -3.087   3.830
  396   1HD1  ILE  47          HD11      ILE  47   0.908  -3.805   0.386
  397   2HD1  ILE  47          HD12      ILE  47   1.386  -5.361  -0.306
  398   3HD1  ILE  47          HD13      ILE  47  -0.309  -5.089   0.162
  399    H    SER  48           H        SER  48  -2.158  -5.931   5.012
  400    HA   SER  48           HA       SER  48  -2.180  -3.808   6.959
  401   1HB   SER  48          HB2       SER  48  -4.037  -6.213   6.742
  402   2HB   SER  48          HB3       SER  48  -4.341  -4.734   7.662
  403    HG   SER  48           HG       SER  48  -4.047  -4.980   4.852
  404    H    GLN  49           H        GLN  49  -1.624  -7.321   7.312
  405    HA   GLN  49           HA       GLN  49  -1.371  -7.314  10.196
  406   1HB   GLN  49          HB2       GLN  49  -0.689  -9.223   7.947
  407   2HB   GLN  49          HB3       GLN  49  -0.157  -9.569   9.592
  408   1HG   GLN  49          HG2       GLN  49  -2.425  -9.547  10.439
  409   2HG   GLN  49          HG3       GLN  49  -3.062  -8.981   8.896
  410   1HE2  GLN  49          HE21      GLN  49  -2.990 -10.437   7.057
  411   2HE2  GLN  49          HE22      GLN  49  -2.949 -12.189   7.326
  412    H    HIS  50           H        HIS  50   0.766  -6.216   7.745
  413    HA   HIS  50           HA       HIS  50   3.076  -6.085   9.636
  414   1HB   HIS  50          HB2       HIS  50   3.104  -6.833   6.689
  415   2HB   HIS  50          HB3       HIS  50   4.530  -6.667   7.723
  416    HD1  HIS  50           HD1      HIS  50   3.670  -8.464  10.191
  417    HD2  HIS  50           HD2      HIS  50   2.995  -9.355   6.141
  418    HE1  HIS  50           HE1      HIS  50   3.451 -10.991  10.044
  419    H    GLN  51           H        GLN  51   1.104  -4.016   9.109
  420    HA   GLN  51           HA       GLN  51   1.615  -2.474   6.905
  421   1HB   GLN  51          HB2       GLN  51  -0.413  -2.646   8.334
  422   2HB   GLN  51          HB3       GLN  51   0.398  -1.698   9.586
  423   1HG   GLN  51          HG2       GLN  51  -1.194  -0.411   8.301
  424   2HG   GLN  51          HG3       GLN  51   0.449   0.238   8.115
  425   1HE2  GLN  51          HE21      GLN  51   1.512  -0.066   6.011
  426   2HE2  GLN  51          HE22      GLN  51   0.525  -0.446   4.587
  427    H    GLU  52           H        GLU  52   3.195  -2.103  10.083
  428    HA   GLU  52           HA       GLU  52   4.547   0.370   9.502
  429   1HB   GLU  52          HB2       GLU  52   4.200  -0.607  11.759
  430   2HB   GLU  52          HB3       GLU  52   5.278  -1.950  11.347
  431   1HG   GLU  52          HG2       GLU  52   7.145  -0.392  11.055
  432   2HG   GLU  52          HG3       GLU  52   6.066   0.983  11.315
  433    H    HIS  53           H        HIS  53   5.388  -3.081   8.947
  434    HA   HIS  53           HA       HIS  53   8.033  -2.550   7.912
  435   1HB   HIS  53          HB2       HIS  53   6.224  -4.974   7.580
  436   2HB   HIS  53          HB3       HIS  53   7.926  -4.898   7.160
  437    HD1  HIS  53           HD1      HIS  53   9.111  -3.538   9.770
  438    HD2  HIS  53           HD2      HIS  53   6.182  -6.550   9.676
  439    HE1  HIS  53           HE1      HIS  53   9.228  -4.714  12.020
  440    H    PHE  54           H        PHE  54   4.823  -2.680   6.392
  441    HA   PHE  54           HA       PHE  54   5.819  -2.337   3.678
  442   1HB   PHE  54          HB2       PHE  54   3.484  -3.040   4.241
  443   2HB   PHE  54          HB3       PHE  54   3.183  -1.444   4.918
  444    HD1  PHE  54           HD1      PHE  54   4.256  -3.160   1.752
  445    HD2  PHE  54           HD2      PHE  54   2.364   0.299   3.497
  446    HE1  PHE  54           HE1      PHE  54   3.582  -2.378  -0.509
  447    HE2  PHE  54           HE2      PHE  54   1.636   1.030   1.239
  448    HZ   PHE  54           HZ       PHE  54   2.256  -0.296  -0.763
  449    H    ILE  55           H        ILE  55   4.754   0.071   6.188
  450    HA   ILE  55           HA       ILE  55   5.379   2.385   4.663
  451    HB   ILE  55           HB       ILE  55   5.169   1.970   7.594
  452   1HG1  ILE  55          HG12      ILE  55   3.482   3.490   5.546
  453   2HG1  ILE  55          HG13      ILE  55   3.182   1.811   6.002
  454   1HG2  ILE  55          HG21      ILE  55   5.237   4.455   7.827
  455   2HG2  ILE  55          HG22      ILE  55   6.784   3.829   7.292
  456   3HG2  ILE  55          HG23      ILE  55   5.699   4.602   6.120
  457   1HD1  ILE  55          HD11      ILE  55   2.878   2.525   8.363
  458   2HD1  ILE  55          HD12      ILE  55   3.005   4.224   7.821
  459   3HD1  ILE  55          HD13      ILE  55   1.684   3.197   7.226
  460    H    GLN  56           H        GLN  56   7.567   0.424   6.727
  461    HA   GLN  56           HA       GLN  56   9.910   1.973   6.411
  462   1HB   GLN  56          HB2       GLN  56   9.466  -1.000   6.849
  463   2HB   GLN  56          HB3       GLN  56  11.080  -0.294   6.795
  464   1HG   GLN  56          HG2       GLN  56  10.568   1.204   8.650
  465   2HG   GLN  56          HG3       GLN  56   8.926   0.590   8.763
  466   1HE2  GLN  56          HE21      GLN  56  11.671   0.429  10.457
  467   2HE2  GLN  56          HE22      GLN  56  11.609  -1.251  10.980
  468    H    MET  57           H        MET  57   8.279   0.372   3.894
  469    HA   MET  57           HA       MET  57  10.672   0.465   2.082
  470   1HB   MET  57          HB2       MET  57   8.158  -1.261   2.011
  471   2HB   MET  57          HB3       MET  57   9.367  -1.209   0.730
  472   1HG   MET  57          HG2       MET  57  11.084  -1.829   2.546
  473   2HG   MET  57          HG3       MET  57   9.710  -2.195   3.580
  474   1HE   MET  57          HE1       MET  57   7.983  -5.148   1.585
  475   2HE   MET  57          HE2       MET  57   7.847  -4.022   2.960
  476   3HE   MET  57          HE3       MET  57   7.652  -3.434   1.291
  477    H    LEU  58           H        LEU  58   7.125   0.964   2.194
  478    HA   LEU  58           HA       LEU  58   6.584   2.452  -0.104
  479   1HB   LEU  58          HB2       LEU  58   5.049   1.337   1.248
  480   2HB   LEU  58          HB3       LEU  58   5.533   2.205   2.692
  481    HG   LEU  58           HG       LEU  58   3.336   2.631   1.768
  482   1HD1  LEU  58          HD11      LEU  58   4.422   4.080   3.442
  483   2HD1  LEU  58          HD12      LEU  58   5.015   5.138   2.140
  484   3HD1  LEU  58          HD13      LEU  58   3.275   4.949   2.420
  485   1HD2  LEU  58          HD21      LEU  58   3.981   2.785  -0.637
  486   2HD2  LEU  58          HD22      LEU  58   2.928   4.082  -0.066
  487   3HD2  LEU  58          HD23      LEU  58   4.658   4.403  -0.313
  488    H    ASN  59           H        ASN  59   8.057   3.580   2.949
  489    HA   ASN  59           HA       ASN  59   8.055   6.373   1.970
  490   1HB   ASN  59          HB2       ASN  59   7.192   5.566   4.255
  491   2HB   ASN  59          HB3       ASN  59   8.885   5.282   4.675
  492   1HD2  ASN  59          HD21      ASN  59   8.674   6.794   6.396
  493   2HD2  ASN  59          HD22      ASN  59   8.554   8.523   6.078
  494    H    GLU  60           H        GLU  60  10.147   3.871   1.444
  495    HA   GLU  60           HA       GLU  60  12.661   5.267   2.069
  496   1HB   GLU  60          HB2       GLU  60  13.701   3.304   1.809
  497   2HB   GLU  60          HB3       GLU  60  12.091   2.653   2.080
  498   1HG   GLU  60          HG2       GLU  60  11.842   2.639  -0.487
  499   2HG   GLU  60          HG3       GLU  60  13.572   3.008  -0.539
  500    HA   PRO  61           HA       PRO  61  13.240   7.194  -1.981
  501   1HB   PRO  61          HB2       PRO  61  16.059   6.209  -1.992
  502   2HB   PRO  61          HB3       PRO  61  15.418   7.883  -2.089
  503   1HG   PRO  61          HG2       PRO  61  16.627   6.889   0.164
  504   2HG   PRO  61          HG3       PRO  61  15.343   8.135   0.179
  505   1HD   PRO  61          HD2       PRO  61  15.121   5.216   0.818
  506   2HD   PRO  61          HD3       PRO  61  14.259   6.649   1.484
  507    H    VAL  62           H        VAL  62  12.460   6.294  -3.829
  508    HA   VAL  62           HA       VAL  62  13.230   3.510  -4.588
  509    HB   VAL  62           HB       VAL  62  11.315   3.357  -3.156
  510   1HG1  VAL  62          HG11      VAL  62  10.335   5.638  -3.493
  511   2HG1  VAL  62          HG12      VAL  62   9.750   5.106  -5.085
  512   3HG1  VAL  62          HG13      VAL  62   9.157   4.329  -3.601
  513   1HG2  VAL  62          HG21      VAL  62  10.459   2.912  -6.048
  514   2HG2  VAL  62          HG22      VAL  62  11.423   1.791  -5.057
  515   3HG2  VAL  62          HG23      VAL  62   9.746   2.172  -4.617
  516    H    GLN  63           H        GLN  63  13.293   2.988  -6.621
  517    HA   GLN  63           HA       GLN  63  12.213   4.679  -8.791
  518   1HB   GLN  63          HB2       GLN  63  15.139   3.846  -8.552
  519   2HB   GLN  63          HB3       GLN  63  14.394   4.552  -9.987
  520   1HG   GLN  63          HG2       GLN  63  13.890   6.623  -8.696
  521   2HG   GLN  63          HG3       GLN  63  14.748   5.952  -7.304
  522   1HE2  GLN  63          HE21      GLN  63  15.524   8.409  -8.564
  523   2HE2  GLN  63          HE22      GLN  63  17.104   8.126  -9.289
  524    H    GLU  64           H        GLU  64  12.280   3.538 -10.868
  525    HA   GLU  64           HA       GLU  64  11.838   0.650 -10.739
  526   1HB   GLU  64          HB2       GLU  64  12.191   2.539 -13.103
  527   2HB   GLU  64          HB3       GLU  64  11.669   0.848 -13.199
  528   1HG   GLU  64          HG2       GLU  64   9.672   1.379 -11.836
  529   2HG   GLU  64          HG3       GLU  64  10.155   3.070 -11.758
  530    H    ALA  65           H        ALA  65  13.156  -0.973 -11.637
  531    HA   ALA  65           HA       ALA  65  15.896  -0.858 -11.150
  532   1HB   ALA  65          HB1       ALA  65  14.498  -2.886 -11.134
  533   2HB   ALA  65          HB2       ALA  65  14.330  -2.796 -12.902
  534   3HB   ALA  65          HB3       ALA  65  15.919  -3.101 -12.170
  535    H    GLY  66           H        GLY  66  14.399   0.380 -13.960
  536   1HA   GLY  66          HA2       GLY  66  17.074   0.852 -15.209
  537   2HA   GLY  66          HA3       GLY  66  15.700   0.352 -16.201
  538    H    GLY  67           H        GLY  67  14.939   2.465 -13.537
  539   1HA   GLY  67          HA2       GLY  67  13.903   4.510 -15.318
  540   2HA   GLY  67          HA3       GLY  67  13.850   4.498 -13.555
  541    H    GLN  68           H        GLN  68  17.016   4.072 -14.330
  542    HA   GLN  68           HA       GLN  68  17.771   6.942 -14.478
  543   1HB   GLN  68          HB2       GLN  68  19.184   6.729 -12.544
  544   2HB   GLN  68          HB3       GLN  68  17.547   6.286 -12.111
  545   1HG   GLN  68          HG2       GLN  68  19.842   4.329 -12.616
  546   2HG   GLN  68          HG3       GLN  68  19.243   4.838 -11.044
  547   1HE2  GLN  68          HE21      GLN  68  16.982   4.204 -10.451
  548   2HE2  GLN  68          HE22      GLN  68  16.284   2.775 -11.216
  549    H    GLY  69           H        GLY  69  18.026   4.371 -16.232
  550   1HA   GLY  69          HA2       GLY  69  20.859   3.760 -16.347
  551   2HA   GLY  69          HA3       GLY  69  19.588   3.139 -17.396
  552    H    GLY  70           H        GLY  70  20.167   6.618 -17.054
  553   1HA   GLY  70          HA2       GLY  70  21.955   7.046 -19.215
  554   2HA   GLY  70          HA3       GLY  70  20.309   7.143 -19.842
  555    H    GLY  71           H        GLY  71  21.570   9.343 -20.209
  556   1HA   GLY  71          HA2       GLY  71  20.173  11.428 -19.114
  557   2HA   GLY  71          HA3       GLY  71  21.525  11.260 -17.992
  558    H    GLY  72           H        GLY  72  23.357  10.422 -20.253
  559   1HA   GLY  72          HA2       GLY  72  23.539  12.345 -22.330
  560   2HA   GLY  72          HA3       GLY  72  24.498  12.938 -20.972